smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[NH+]1CCC(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])CC1 ZINC001182054649 1083618075 /nfs/dbraw/zinc/61/80/75/1083618075.db2.gz WJEDYQMZQUWHBJ-UHFFFAOYSA-N 2 0 305.422 3.151 20 5 DGBDRP C[C@H](CCNCc1ccc([N+](=O)[O-])cc1F)[NH+]1CCCCC1 ZINC001205390587 1091209822 /nfs/dbraw/zinc/20/98/22/1091209822.db2.gz BHPWJKSZNXPLMQ-CYBMUJFWSA-N 2 0 309.385 3.088 20 5 DGBDRP [NH3+][C@H]1CC[N@H+](Cc2ccc3ccc4cccnc4c3n2)CC[C@@H]1F ZINC001206188220 1091526037 /nfs/dbraw/zinc/52/60/37/1091526037.db2.gz UUQGDYPODMOERF-IRXDYDNUSA-N 2 0 324.403 3.044 20 5 DGBDRP O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH+](C3CCCCC3)CC2)C1 ZINC001168978002 1092457041 /nfs/dbraw/zinc/45/70/41/1092457041.db2.gz NNPJDIKXYKNWAF-IAGOWNOFSA-N 2 0 323.481 3.066 20 5 DGBDRP [NH3+]CCCCCCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172903322 1097268956 /nfs/dbraw/zinc/26/89/56/1097268956.db2.gz QDCDKPFCQGGETF-QGZVFWFLSA-N 2 0 319.449 3.341 20 5 DGBDRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173218027 1097369624 /nfs/dbraw/zinc/36/96/24/1097369624.db2.gz IRKLJKKJWRXNBF-HNNXBMFYSA-N 2 0 319.449 3.236 20 5 DGBDRP CN(CCC[NH+](C)C)Cc1ccc2ccc3cccnc3c2n1 ZINC001232219932 1097971169 /nfs/dbraw/zinc/97/11/69/1097971169.db2.gz XXVVBBNFXJBUKJ-UHFFFAOYSA-N 2 0 308.429 3.167 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246122347 1104396691 /nfs/dbraw/zinc/39/66/91/1104396691.db2.gz ADFGHKMLEJKRJE-ZBFHGGJFSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246138519 1104403293 /nfs/dbraw/zinc/40/32/93/1104403293.db2.gz YOGQDCOXAQSNCI-GOEBONIOSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246604230 1104620164 /nfs/dbraw/zinc/62/01/64/1104620164.db2.gz HEMIFNNKUBMUFM-CRAIPNDOSA-N 2 0 317.433 3.134 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC001308570250 1111445883 /nfs/dbraw/zinc/44/58/83/1111445883.db2.gz KTWJHLWILSYZFU-MAUKXSAKSA-N 2 0 317.433 3.128 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC001308570252 1111445896 /nfs/dbraw/zinc/44/58/96/1111445896.db2.gz KTWJHLWILSYZFU-YJBOKZPZSA-N 2 0 317.433 3.128 20 5 DGBDRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000415051877 237036609 /nfs/dbraw/zinc/03/66/09/237036609.db2.gz ZYLPHDDVJQDKFX-GXTWGEPZSA-N 2 0 315.373 3.072 20 5 DGBDRP CCC[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423332720 283560401 /nfs/dbraw/zinc/56/04/01/283560401.db2.gz PGWVXFNEVBEULG-MRXNPFEDSA-N 2 0 305.422 3.415 20 5 DGBDRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543775 241165376 /nfs/dbraw/zinc/16/53/76/241165376.db2.gz CRQLBOKWMBNBTN-SJORKVTESA-N 2 0 317.433 3.259 20 5 DGBDRP CCC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000423551905 283937650 /nfs/dbraw/zinc/93/76/50/283937650.db2.gz URWNSJHISMUBCQ-HPFXQQBRSA-N 2 0 317.433 3.414 20 5 DGBDRP CC[N@@H+]1CCC[C@H](C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000468621823 244056744 /nfs/dbraw/zinc/05/67/44/244056744.db2.gz ZCCAKTPYIUHCFN-XBNGYDHASA-N 2 0 317.433 3.320 20 5 DGBDRP CC[N@@H+]1CCC[C@H](C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000468621817 244057200 /nfs/dbraw/zinc/05/72/00/244057200.db2.gz ZCCAKTPYIUHCFN-IUYQLWOBSA-N 2 0 317.433 3.320 20 5 DGBDRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000248883077 285035599 /nfs/dbraw/zinc/03/55/99/285035599.db2.gz LFZVMUDPNBYCSS-DAYGRLMNSA-N 2 0 317.433 3.435 20 5 DGBDRP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000595052968 400091667 /nfs/dbraw/zinc/09/16/67/400091667.db2.gz UOYNQVWTRPXLSA-CYBMUJFWSA-N 2 0 321.421 3.128 20 5 DGBDRP C[NH+](C)CCCC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602525822 400488806 /nfs/dbraw/zinc/48/88/06/400488806.db2.gz SFBFXQQKZQTIEB-UHFFFAOYSA-N 2 0 319.327 3.045 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2cc([N+](=O)[O-])ccc21 ZINC000591578358 400541319 /nfs/dbraw/zinc/54/13/19/400541319.db2.gz WGXXGQVOFHWZEV-WBMJQRKESA-N 2 0 303.406 3.049 20 5 DGBDRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000593318764 400817310 /nfs/dbraw/zinc/81/73/10/400817310.db2.gz HEBDRLRGARRYJY-LLVKDONJSA-N 2 0 303.337 3.043 20 5 DGBDRP C[N@H+](CCCCNc1ccc2cnccc2c1[N+](=O)[O-])C1CC1 ZINC000599087571 400956777 /nfs/dbraw/zinc/95/67/77/400956777.db2.gz KUWLLEFQXDYFLU-UHFFFAOYSA-N 2 0 314.389 3.429 20 5 DGBDRP [NH3+]C1(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCCC1 ZINC000594738034 401165561 /nfs/dbraw/zinc/16/55/61/401165561.db2.gz ATGZTKQSGUJSJX-HOCLYGCPSA-N 2 0 317.433 3.167 20 5 DGBDRP O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000247031739 432193760 /nfs/dbraw/zinc/19/37/60/432193760.db2.gz YLBOBKAPQKBYFE-YJBOKZPZSA-N 2 0 315.417 3.044 20 5 DGBDRP [NH3+]CC1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000346686941 264079934 /nfs/dbraw/zinc/07/99/34/264079934.db2.gz LBAUPFSBCKOAQA-UHFFFAOYSA-N 2 0 315.373 3.026 20 5 DGBDRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000346693037 264080845 /nfs/dbraw/zinc/08/08/45/264080845.db2.gz KMGIFNUEYPWQTO-STQMWFEESA-N 2 0 315.373 3.024 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)cc1[N+](=O)[O-] ZINC000346827197 264104314 /nfs/dbraw/zinc/10/43/14/264104314.db2.gz HTRVSFTWZIJDKO-BHYGNILZSA-N 2 0 317.433 3.277 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)CCC2 ZINC000423474796 275037851 /nfs/dbraw/zinc/03/78/51/275037851.db2.gz HMFRDQJHVZEBPU-PBHICJAKSA-N 2 0 303.406 3.094 20 5 DGBDRP CC1(C)C[C@H]([NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000423478542 275867922 /nfs/dbraw/zinc/86/79/22/275867922.db2.gz TXDYPIXJJAJXTD-IGCXYCKISA-N 2 0 317.433 3.424 20 5 DGBDRP Cc1c([C@H](C)[NH2+]CCC2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000125377208 431922839 /nfs/dbraw/zinc/92/28/39/431922839.db2.gz QJLQWIGQWNEZTQ-AWEZNQCLSA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152427074 432332862 /nfs/dbraw/zinc/33/28/62/432332862.db2.gz SQRNRFVDWRUYIO-ZIAGYGMSSA-N 2 0 303.406 3.038 20 5 DGBDRP C[N@@H+]1CCC[C@@H]1CCN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154396667 432496818 /nfs/dbraw/zinc/49/68/18/432496818.db2.gz MGAFNJJNGIROOX-OAHLLOKOSA-N 2 0 303.406 3.044 20 5 DGBDRP CC(C)[N@H+](CC[C@H]1CCC[NH2+]C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000420297320 433147510 /nfs/dbraw/zinc/14/75/10/433147510.db2.gz CXBMYCYXGODFTN-OAHLLOKOSA-N 2 0 305.422 3.195 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C[NH+](C)C ZINC000425924540 433373468 /nfs/dbraw/zinc/37/34/68/433373468.db2.gz PPPLCZUDKJXANU-BFYDXBDKSA-N 2 0 319.449 3.093 20 5 DGBDRP C[NH+](C)CCCC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000283189363 433684921 /nfs/dbraw/zinc/68/49/21/433684921.db2.gz QOPJRFIKCCUWFK-UHFFFAOYSA-N 2 0 323.412 3.288 20 5 DGBDRP CCC([NH3+])(CC)C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414812815 433854607 /nfs/dbraw/zinc/85/46/07/433854607.db2.gz RXICCJOOQJQHQK-GOEBONIOSA-N 2 0 319.449 3.413 20 5 DGBDRP CC[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[NH2+]1 ZINC000422926059 434111631 /nfs/dbraw/zinc/11/16/31/434111631.db2.gz WBFOPMSHTSFCSH-IRXDYDNUSA-N 2 0 305.422 3.038 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000295114282 434209255 /nfs/dbraw/zinc/20/92/55/434209255.db2.gz WMPSUOGZRPQUEU-LNRIEFBSSA-N 2 0 317.433 3.131 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000423279586 434335688 /nfs/dbraw/zinc/33/56/88/434335688.db2.gz ROGFCCZFMWFMSM-CFVMTHIKSA-N 2 0 321.421 3.162 20 5 DGBDRP CC1(C)C[C@H]([NH2+]C[C@H]2CCC[C@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000423478540 434444089 /nfs/dbraw/zinc/44/40/89/434444089.db2.gz TXDYPIXJJAJXTD-DCGLDWPTSA-N 2 0 317.433 3.424 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2cc([N+](=O)[O-])ccc21 ZINC000423479299 434446310 /nfs/dbraw/zinc/44/63/10/434446310.db2.gz MCJXNBMJRRWVKX-CXAGYDPISA-N 2 0 317.433 3.439 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000423434542 434423758 /nfs/dbraw/zinc/42/37/58/434423758.db2.gz OCIUAZJZCMJSOO-CJNGLKHVSA-N 2 0 305.422 3.023 20 5 DGBDRP [NH3+]C[C@H](N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CCCC1 ZINC000423507240 434464314 /nfs/dbraw/zinc/46/43/14/434464314.db2.gz PVICZUAWPQZSCC-SJORKVTESA-N 2 0 303.406 3.079 20 5 DGBDRP CCC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000423551904 434483578 /nfs/dbraw/zinc/48/35/78/434483578.db2.gz URWNSJHISMUBCQ-CUSZFKRNSA-N 2 0 317.433 3.414 20 5 DGBDRP CCC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000423551907 434484171 /nfs/dbraw/zinc/48/41/71/434484171.db2.gz URWNSJHISMUBCQ-LHHMISFZSA-N 2 0 317.433 3.414 20 5 DGBDRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513789839 435401007 /nfs/dbraw/zinc/40/10/07/435401007.db2.gz ODJUVBBCKAAJHC-BFYDXBDKSA-N 2 0 319.449 3.236 20 5 DGBDRP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CCc1cn2ccccc2n1 ZINC000570058785 435586731 /nfs/dbraw/zinc/58/67/31/435586731.db2.gz BLRPANFTFLUTCV-INIZCTEOSA-N 2 0 322.368 3.062 20 5 DGBDRP CC[NH+]1CCC(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000565474814 315263981 /nfs/dbraw/zinc/26/39/81/315263981.db2.gz KVTPZBNRJFRRPB-GOSISDBHSA-N 2 0 317.433 3.294 20 5 DGBDRP CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCC[NH2+]CC1 ZINC000435389975 527871893 /nfs/dbraw/zinc/87/18/93/527871893.db2.gz NRBZIAXWYXSQLY-QKIRZYONSA-N 2 0 303.406 3.072 20 5 DGBDRP CCC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000468627734 534945683 /nfs/dbraw/zinc/94/56/83/534945683.db2.gz ODYUWUDGEZMBSS-MJSCBBHESA-N 2 0 317.433 3.320 20 5 DGBDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000925827434 618639022 /nfs/dbraw/zinc/63/90/22/618639022.db2.gz RZQKSOBATLPKFA-VXGBXAGGSA-N 2 0 314.389 3.169 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21)c1ccccc1[N+](=O)[O-] ZINC000903244874 619743506 /nfs/dbraw/zinc/74/35/06/619743506.db2.gz FWBAFUCHHCXDFS-MWQQHZPXSA-N 2 0 317.433 3.161 20 5 DGBDRP Cc1ccc(C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)cc1[N+](=O)[O-] ZINC000922847991 621108068 /nfs/dbraw/zinc/10/80/68/621108068.db2.gz JDYFNHKFSOXVSM-UHFFFAOYSA-N 2 0 317.433 3.400 20 5 DGBDRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000922847943 621108107 /nfs/dbraw/zinc/10/81/07/621108107.db2.gz ZKNAVKGUUHXAIT-UHFFFAOYSA-N 2 0 321.396 3.231 20 5 DGBDRP C[N@@H+]1CCN(c2ccnc3ccc([N+](=O)[O-])cc32)CCC1(C)C ZINC000866110259 622047495 /nfs/dbraw/zinc/04/74/95/622047495.db2.gz UEHOJLZMYWCVMZ-UHFFFAOYSA-N 2 0 314.389 3.064 20 5 DGBDRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1[N+](=O)[O-] ZINC000873249913 623091293 /nfs/dbraw/zinc/09/12/93/623091293.db2.gz DFBLJHWBJURRPY-BRWVUGGUSA-N 2 0 317.433 3.304 20 5 DGBDRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1[N+](=O)[O-] ZINC000873249915 623091442 /nfs/dbraw/zinc/09/14/42/623091442.db2.gz DFBLJHWBJURRPY-GVDBMIGSSA-N 2 0 317.433 3.304 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cccc1[N+](=O)[O-] ZINC000873263811 623096802 /nfs/dbraw/zinc/09/68/02/623096802.db2.gz KJWIKZKDUOCXPW-APIJFGDWSA-N 2 0 303.406 3.084 20 5 DGBDRP Cc1c(C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000779197863 623740870 /nfs/dbraw/zinc/74/08/70/623740870.db2.gz MNCPFAUCVPVBQS-INIZCTEOSA-N 2 0 307.438 3.359 20 5 DGBDRP Cc1c(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)cccc1[N+](=O)[O-] ZINC000877683453 623991099 /nfs/dbraw/zinc/99/10/99/623991099.db2.gz BWUIBBYVYBLCNB-UHFFFAOYSA-N 2 0 317.433 3.211 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000879248493 624463641 /nfs/dbraw/zinc/46/36/41/624463641.db2.gz TZCIZXUKJAJRLC-OAHLLOKOSA-N 2 0 317.433 3.464 20 5 DGBDRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C2CCCC2)cc1[N+](=O)[O-] ZINC000925733722 627784683 /nfs/dbraw/zinc/78/46/83/627784683.db2.gz LULIQTVBUBFVKE-SJORKVTESA-N 2 0 317.433 3.161 20 5 DGBDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817963511 627977135 /nfs/dbraw/zinc/97/71/35/627977135.db2.gz SQGPUOUDSUFIPD-VXGBXAGGSA-N 2 0 314.389 3.048 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000841079781 630405544 /nfs/dbraw/zinc/40/55/44/630405544.db2.gz NWIGSRDOBZSKRW-HAQNSBGRSA-N 2 0 311.813 3.103 20 5 DGBDRP [NH3+]CCCCCC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000843126187 630616684 /nfs/dbraw/zinc/61/66/84/630616684.db2.gz BZYQWIHRVBCDFN-UHFFFAOYSA-N 2 0 317.389 3.464 20 5 DGBDRP C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@@H]1CC[NH3+] ZINC000844902651 630972692 /nfs/dbraw/zinc/97/26/92/630972692.db2.gz URDHPGHJYZCAIR-BXUZGUMPSA-N 2 0 311.813 3.198 20 5 DGBDRP CC[NH+]1CCC(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000050443954 655784858 /nfs/dbraw/zinc/78/48/58/655784858.db2.gz AUKQUBZDSUDIKV-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)cc1Cl ZINC000261962662 657265096 /nfs/dbraw/zinc/26/50/96/657265096.db2.gz PKYRXXQHDIGNEG-HNNXBMFYSA-N 2 0 323.824 3.212 20 5 DGBDRP Cc1c(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)cccc1[N+](=O)[O-] ZINC001335584996 1178933427 /nfs/dbraw/zinc/93/34/27/1178933427.db2.gz ZMKWKKKEASCJLL-ULQDDVLXSA-N 2 0 317.433 3.065 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1N(C(N)=[NH2+])c1ccc(F)cc1 ZINC001167992625 1086057738 /nfs/dbraw/zinc/05/77/38/1086057738.db2.gz RTPPAXILWGDPBI-UHFFFAOYSA-N 2 0 315.416 3.454 20 5 DGBDRP O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]CC2CC[NH+](C3CCCCC3)CC2)C1 ZINC001168978003 1092456335 /nfs/dbraw/zinc/45/63/35/1092456335.db2.gz NNPJDIKXYKNWAF-IRXDYDNUSA-N 2 0 323.481 3.066 20 5 DGBDRP C[N+](C)(C)CCCO[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC001224621055 1096248690 /nfs/dbraw/zinc/24/86/90/1096248690.db2.gz JNQIJZZQABVNSN-SLFFLAALSA-N 2 0 317.497 3.010 20 5 DGBDRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1OCCC[N+](C)(C)C ZINC001224624038 1096248868 /nfs/dbraw/zinc/24/88/68/1096248868.db2.gz TVUZHAMWYKAAFB-LJQANCHMSA-N 2 0 319.513 3.400 20 5 DGBDRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1OCCC[N+](C)(C)C ZINC001224624032 1096248984 /nfs/dbraw/zinc/24/89/84/1096248984.db2.gz TVUZHAMWYKAAFB-IBGZPJMESA-N 2 0 319.513 3.400 20 5 DGBDRP C[C@H](C[N+](C)(C)C)Oc1ccc2ccccc2c1C[NH+](C)C ZINC001228441929 1097121812 /nfs/dbraw/zinc/12/18/12/1097121812.db2.gz OIJAYTLBVYKJRX-OAHLLOKOSA-N 2 0 301.454 3.375 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCN(C2CCCC2)C1 ZINC001173221176 1097371845 /nfs/dbraw/zinc/37/18/45/1097371845.db2.gz LFUKPVNAKMIEMC-GDBMZVCRSA-N 2 0 317.433 3.132 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCC1CC[NH+](C)CC1 ZINC001173221945 1097372029 /nfs/dbraw/zinc/37/20/29/1097372029.db2.gz RHPCKAMQUMHEAG-HNNXBMFYSA-N 2 0 319.449 3.237 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCCC[NH+]1CCCC1 ZINC001173235810 1097379721 /nfs/dbraw/zinc/37/97/21/1097379721.db2.gz VAUIAPIWKNEGDL-MRXNPFEDSA-N 2 0 319.449 3.382 20 5 DGBDRP C[N@H+](Cc1c2ccccc2cc2ccccc21)C[C@@]1(O)CC[NH2+]C1 ZINC001246048234 1104356318 /nfs/dbraw/zinc/35/63/18/1104356318.db2.gz ZADDRWZZRBYQGW-OAQYLSRUSA-N 2 0 320.436 3.149 20 5 DGBDRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC001329643403 1104358375 /nfs/dbraw/zinc/35/83/75/1104358375.db2.gz OEMAXGMWIJGANF-LBPRGKRZSA-N 2 0 309.385 3.116 20 5 DGBDRP C[C@]1([NH3+])CCC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001246555581 1104592938 /nfs/dbraw/zinc/59/29/38/1104592938.db2.gz XTIJJYFLBIPTIX-WMZOPIPTSA-N 2 0 317.433 3.046 20 5 DGBDRP CC(C)[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])[C@H]1CCC[NH2+]CC1 ZINC001246595273 1104612683 /nfs/dbraw/zinc/61/26/83/1104612683.db2.gz SZQVCVVLEPHNIN-RDJZCZTQSA-N 2 0 319.449 3.378 20 5 DGBDRP CC(C)[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])[C@H]1CCC[NH2+]CC1 ZINC001246595274 1104613022 /nfs/dbraw/zinc/61/30/22/1104613022.db2.gz SZQVCVVLEPHNIN-WBVHZDCISA-N 2 0 319.449 3.378 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCCC12CC[NH2+]CC2 ZINC001246646039 1104643598 /nfs/dbraw/zinc/64/35/98/1104643598.db2.gz GIAVBYLSGGYDAV-OAHLLOKOSA-N 2 0 317.433 3.134 20 5 DGBDRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC001254550337 1106101833 /nfs/dbraw/zinc/10/18/33/1106101833.db2.gz HUWZARCSSSDCQK-ZMSDIMECSA-N 2 0 319.449 3.234 20 5 DGBDRP CC1(C)CC([NH3+])CC(C)(C)[NH+]1[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254581000 1106108237 /nfs/dbraw/zinc/10/82/37/1106108237.db2.gz HOWKRRAGROBUTE-INIZCTEOSA-N 2 0 317.433 3.042 20 5 DGBDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000415050327 237033626 /nfs/dbraw/zinc/03/36/26/237033626.db2.gz YMMFDNVMESXOSF-TZMCWYRMSA-N 2 0 315.373 3.072 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@H](C)CCCC[NH3+])cc1[N+](=O)[O-] ZINC000423418810 237848731 /nfs/dbraw/zinc/84/87/31/237848731.db2.gz AFUQGUIJNNKLIQ-OLZOCXBDSA-N 2 0 309.410 3.162 20 5 DGBDRP CCC[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271883971 209293692 /nfs/dbraw/zinc/29/36/92/209293692.db2.gz QGBBAJQYIWWUEV-QGZVFWFLSA-N 2 0 303.406 3.288 20 5 DGBDRP O=[N+]([O-])c1ccccc1CN(CCC[NH+]1CCCCC1)C1CC1 ZINC000444615899 239306608 /nfs/dbraw/zinc/30/66/08/239306608.db2.gz MSRPGXLRUVTJRC-UHFFFAOYSA-N 2 0 317.433 3.435 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000449237113 240083968 /nfs/dbraw/zinc/08/39/68/240083968.db2.gz AQXGCJXFWLCRTP-HOTGVXAUSA-N 2 0 319.449 3.380 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC1CC[NH+](C)CC1 ZINC000468630431 244057577 /nfs/dbraw/zinc/05/75/77/244057577.db2.gz HQTLJHHYLPYCPD-QINSGFPZSA-N 2 0 317.433 3.320 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCN(C2CC2)CC1 ZINC000119682842 284148795 /nfs/dbraw/zinc/14/87/95/284148795.db2.gz PTOOJWYACSQSDL-ZDUSSCGKSA-N 2 0 303.406 3.181 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000470169720 533381679 /nfs/dbraw/zinc/38/16/79/533381679.db2.gz IFJGDWHLZYVMCZ-MJSCBBHESA-N 2 0 317.433 3.272 20 5 DGBDRP Cc1cc(N[C@H]2CC[N@@H+](C3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000322354115 400174346 /nfs/dbraw/zinc/17/43/46/400174346.db2.gz FIOONRHUVJSSIJ-LBPRGKRZSA-N 2 0 312.373 3.100 20 5 DGBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595901500 400290533 /nfs/dbraw/zinc/29/05/33/400290533.db2.gz XKQKUYRQZXEQIP-WMLDXEAASA-N 2 0 317.433 3.367 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595901633 400290687 /nfs/dbraw/zinc/29/06/87/400290687.db2.gz ZHNLDBQFDHOCOB-GOEBONIOSA-N 2 0 317.433 3.367 20 5 DGBDRP C[N@H+](CCCC[NH+]1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000603111632 400643671 /nfs/dbraw/zinc/64/36/71/400643671.db2.gz SRXKKNHMZGCZMR-UHFFFAOYSA-N 2 0 305.422 3.293 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCCC[N@H+](C)C1 ZINC000599069312 400947837 /nfs/dbraw/zinc/94/78/37/400947837.db2.gz FZGOJRYROVDBEG-HUUCEWRRSA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+][C@H](C)C2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000090217593 401262851 /nfs/dbraw/zinc/26/28/51/401262851.db2.gz WTPMAQQCQITYID-KGLIPLIRSA-N 2 0 305.422 3.284 20 5 DGBDRP C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000346642584 264071058 /nfs/dbraw/zinc/07/10/58/264071058.db2.gz MQQNPTJDMCYPIC-JSGCOSHPSA-N 2 0 315.373 3.024 20 5 DGBDRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000423461309 274957749 /nfs/dbraw/zinc/95/77/49/274957749.db2.gz CCAGVUUIWDJWBS-DXCKQFNASA-N 2 0 303.406 3.079 20 5 DGBDRP CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCC[NH2+]CC1 ZINC000435389974 276079046 /nfs/dbraw/zinc/07/90/46/276079046.db2.gz NRBZIAXWYXSQLY-IQIBNGDESA-N 2 0 303.406 3.072 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000414812961 278037771 /nfs/dbraw/zinc/03/77/71/278037771.db2.gz XUCRWNYVNXZMSZ-ZBFHGGJFSA-N 2 0 305.422 3.325 20 5 DGBDRP Cc1c(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000261812629 432452293 /nfs/dbraw/zinc/45/22/93/432452293.db2.gz GPGASGMXXKKPDE-GVDBMIGSSA-N 2 0 317.433 3.304 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000272560761 432525007 /nfs/dbraw/zinc/52/50/07/432525007.db2.gz NRTIFGJLPBFLMN-CQSZACIVSA-N 2 0 305.422 3.286 20 5 DGBDRP C[C@@H](NCc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185701725 432526433 /nfs/dbraw/zinc/52/64/33/432526433.db2.gz GDNMASZEYPHWQA-GDBMZVCRSA-N 2 0 317.433 3.337 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000420314450 433162856 /nfs/dbraw/zinc/16/28/56/433162856.db2.gz KXPMRBPXBVTJOE-GDBMZVCRSA-N 2 0 317.433 3.286 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453592311 433226339 /nfs/dbraw/zinc/22/63/39/433226339.db2.gz DRKRLBGTIKOPPL-NTCAYCPXSA-N 2 0 317.433 3.462 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-] ZINC000414176436 433441395 /nfs/dbraw/zinc/44/13/95/433441395.db2.gz IZZIEPYUFDCJHZ-CABCVRRESA-N 2 0 305.422 3.286 20 5 DGBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000414359600 433566941 /nfs/dbraw/zinc/56/69/41/433566941.db2.gz OULIKTREHWIYIA-FUHWJXTLSA-N 2 0 317.433 3.134 20 5 DGBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414689811 433792672 /nfs/dbraw/zinc/79/26/72/433792672.db2.gz LVCOLRTTXYVQSM-GOEBONIOSA-N 2 0 305.422 3.193 20 5 DGBDRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414887348 433900635 /nfs/dbraw/zinc/90/06/35/433900635.db2.gz DKEFCEJDEQXMBN-LLVKDONJSA-N 2 0 305.403 3.150 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCCCC1 ZINC000423203302 434281124 /nfs/dbraw/zinc/28/11/24/434281124.db2.gz SJTRBWHDNMWSOI-CQSZACIVSA-N 2 0 305.422 3.167 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423213891 434291774 /nfs/dbraw/zinc/29/17/74/434291774.db2.gz KMGDNEBAAAPCHI-YDHLFZDLSA-N 2 0 321.421 3.032 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423257764 434318470 /nfs/dbraw/zinc/31/84/70/434318470.db2.gz KWWAJIWZKBJNSJ-ZIAGYGMSSA-N 2 0 321.421 3.034 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000423380715 434391988 /nfs/dbraw/zinc/39/19/88/434391988.db2.gz NUMKHPNIYKFYIM-MCIONIFRSA-N 2 0 323.462 3.196 20 5 DGBDRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417303267 434351060 /nfs/dbraw/zinc/35/10/60/434351060.db2.gz ADBWWXUDJSEIGF-GOSISDBHSA-N 2 0 315.417 3.214 20 5 DGBDRP Cc1c([C@H](C)[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cccc1[N+](=O)[O-] ZINC000423421867 434416235 /nfs/dbraw/zinc/41/62/35/434416235.db2.gz KQQGZBJNCZFHRR-KKUMJFAQSA-N 2 0 305.422 3.319 20 5 DGBDRP CC[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423450264 434429469 /nfs/dbraw/zinc/42/94/69/434429469.db2.gz XCLYKMIOMLHGMS-YESZJQIVSA-N 2 0 303.406 3.024 20 5 DGBDRP CCC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000423551906 434486950 /nfs/dbraw/zinc/48/69/50/434486950.db2.gz URWNSJHISMUBCQ-KONPQCLYSA-N 2 0 317.433 3.414 20 5 DGBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000415027543 295259311 /nfs/dbraw/zinc/25/93/11/295259311.db2.gz BBILSKHJTHIHNP-JHNDHUHGSA-N 2 0 317.433 3.023 20 5 DGBDRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513789840 435403334 /nfs/dbraw/zinc/40/33/34/435403334.db2.gz ODJUVBBCKAAJHC-HLLBOEOZSA-N 2 0 319.449 3.236 20 5 DGBDRP CC(C)[NH2+]CCC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000568381421 435429704 /nfs/dbraw/zinc/42/97/04/435429704.db2.gz LBVJATLKYWNPSO-WBVHZDCISA-N 2 0 319.449 3.284 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000568461764 435437655 /nfs/dbraw/zinc/43/76/55/435437655.db2.gz XPAZIUIMWGRSRW-UONOGXRCSA-N 2 0 314.389 3.187 20 5 DGBDRP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CCc1cn2ccccc2n1 ZINC000570058786 435586549 /nfs/dbraw/zinc/58/65/49/435586549.db2.gz BLRPANFTFLUTCV-MRXNPFEDSA-N 2 0 322.368 3.062 20 5 DGBDRP [NH3+]C1CCC([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000437799231 303362203 /nfs/dbraw/zinc/36/22/03/303362203.db2.gz LITAYYSAKDHIBF-MFNRNEDNSA-N 2 0 317.433 3.166 20 5 DGBDRP Cc1ccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1[N+](=O)[O-] ZINC000415055878 534080421 /nfs/dbraw/zinc/08/04/21/534080421.db2.gz PFCMGFVCPOZMDG-KRWDZBQOSA-N 2 0 313.401 3.473 20 5 DGBDRP C[NH+]1CCC(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000894717656 618434272 /nfs/dbraw/zinc/43/42/72/618434272.db2.gz FSWVSZOPCPJIAD-QGZVFWFLSA-N 2 0 317.433 3.116 20 5 DGBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000903789103 619814103 /nfs/dbraw/zinc/81/41/03/619814103.db2.gz OFMHUPJQRYAVNP-ZDUSSCGKSA-N 2 0 305.422 3.353 20 5 DGBDRP CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@@H]1CCC[N@H+](C)C1 ZINC000153947255 620625979 /nfs/dbraw/zinc/62/59/79/620625979.db2.gz SMFJUPLSVISYQE-CYBMUJFWSA-N 2 0 311.813 3.022 20 5 DGBDRP CC(C)[NH+]1CCC(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000865715081 621982325 /nfs/dbraw/zinc/98/23/25/621982325.db2.gz IRBUANIYXRWLNC-UHFFFAOYSA-N 2 0 305.422 3.195 20 5 DGBDRP CC(C)[NH+]1CCC([NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866290419 622086105 /nfs/dbraw/zinc/08/61/05/622086105.db2.gz XPNPGFDCKHNVGN-CYBMUJFWSA-N 2 0 323.412 3.127 20 5 DGBDRP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCCC[N@H+](C)C1CC1 ZINC000866368741 622104720 /nfs/dbraw/zinc/10/47/20/622104720.db2.gz GBKJQFCRWFAHOZ-ZDUSSCGKSA-N 2 0 323.412 3.129 20 5 DGBDRP Cc1c(C[N@@H+]2CC[C@](C[NH3+])(C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000866702986 622158217 /nfs/dbraw/zinc/15/82/17/622158217.db2.gz FZVBEOLITDKDRE-QGZVFWFLSA-N 2 0 305.422 3.100 20 5 DGBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866704658 622158298 /nfs/dbraw/zinc/15/82/98/622158298.db2.gz PYJRNJONWACTPX-DYVFJYSZSA-N 2 0 305.422 3.353 20 5 DGBDRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872081493 622794634 /nfs/dbraw/zinc/79/46/34/622794634.db2.gz YFYVMIKRXWNTNO-HIFPTAJRSA-N 2 0 309.385 3.257 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000873130252 623042634 /nfs/dbraw/zinc/04/26/34/623042634.db2.gz CGDDNPPJMCEKBD-HNNXBMFYSA-N 2 0 305.422 3.033 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)c(F)c1 ZINC000873232811 623085797 /nfs/dbraw/zinc/08/57/97/623085797.db2.gz NQODGYAEKOSASE-MRXNPFEDSA-N 2 0 321.396 3.136 20 5 DGBDRP CC(C)CC[NH+]1CCC([NH2+]CCc2ccccc2[N+](=O)[O-])CC1 ZINC000925154957 627713814 /nfs/dbraw/zinc/71/38/14/627713814.db2.gz SUCOQRAAFYUVDI-UHFFFAOYSA-N 2 0 319.449 3.237 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]C[C@@H]2CC[C@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000925879732 627811286 /nfs/dbraw/zinc/81/12/86/627811286.db2.gz JHMSPKWCJONSQV-BFQNTYOBSA-N 2 0 303.406 3.034 20 5 DGBDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001578741409 1191953968 /nfs/dbraw/zinc/95/39/68/1191953968.db2.gz NTCYVMRMYGLUQS-UHFFFAOYSA-N 2 0 319.792 3.257 20 5 DGBDRP C[C@H](CC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])[NH+](C)C ZINC001658642126 1196282917 /nfs/dbraw/zinc/28/29/17/1196282917.db2.gz PWTYLCKZSXRBFJ-HLLBOEOZSA-N 2 0 319.449 3.236 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1NC[C@@H]1CCC[NH2+]C[C@H]1C ZINC001162456340 1089741675 /nfs/dbraw/zinc/74/16/75/1089741675.db2.gz HWDJDUXFRFHXBP-SJORKVTESA-N 2 0 304.502 3.331 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168998300 1092479219 /nfs/dbraw/zinc/47/92/19/1092479219.db2.gz LBXNWYXCEWCRMJ-TVFCKZIOSA-N 2 0 323.481 3.194 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168998302 1092479477 /nfs/dbraw/zinc/47/94/77/1092479477.db2.gz LBXNWYXCEWCRMJ-XSLAGTTESA-N 2 0 323.481 3.194 20 5 DGBDRP C[N@H+](Cc1c2ccccc2cc2ccccc21)C[C@]1(O)CC[NH2+]C1 ZINC001246048230 1104358686 /nfs/dbraw/zinc/35/86/86/1104358686.db2.gz ZADDRWZZRBYQGW-NRFANRHFSA-N 2 0 320.436 3.149 20 5 DGBDRP CC(C)[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])[C@@H]1CCC[NH2+]CC1 ZINC001246595268 1104611845 /nfs/dbraw/zinc/61/18/45/1104611845.db2.gz SZQVCVVLEPHNIN-DOTOQJQBSA-N 2 0 319.449 3.378 20 5 DGBDRP CCCC[N@H+](C)CCC[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC001254534732 1106096797 /nfs/dbraw/zinc/09/67/97/1106096797.db2.gz CDNKDNYXWFNGLD-OAHLLOKOSA-N 2 0 307.438 3.237 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC1CC[NH+](C)CC1 ZINC001254549449 1106101387 /nfs/dbraw/zinc/10/13/87/1106101387.db2.gz VVALUWKWGNBSBW-OAHLLOKOSA-N 2 0 319.449 3.237 20 5 DGBDRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC001319382644 1108438440 /nfs/dbraw/zinc/43/84/40/1108438440.db2.gz HYMHNUGTKQKADK-RHSMWYFYSA-N 2 0 305.422 3.367 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000415013571 237004555 /nfs/dbraw/zinc/00/45/55/237004555.db2.gz YLTMKLLNBRLIKN-YCPHGPKFSA-N 2 0 305.422 3.023 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000449138096 240035565 /nfs/dbraw/zinc/03/55/65/240035565.db2.gz AUACWUULSCOECB-YOEHRIQHSA-N 2 0 321.465 3.482 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)C[NH+](C)C ZINC000468635948 244056296 /nfs/dbraw/zinc/05/62/96/244056296.db2.gz VMMFJHVKBQTWHZ-ZROIWOOFSA-N 2 0 305.422 3.176 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000468602825 244056639 /nfs/dbraw/zinc/05/66/39/244056639.db2.gz ZTLUVFWPIWFRSR-RVDMUPIBSA-N 2 0 317.433 3.320 20 5 DGBDRP C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1CC[NH+](C)CC1 ZINC000063120739 184271874 /nfs/dbraw/zinc/27/18/74/184271874.db2.gz GAYJFNVHVXFZQF-UHFFFAOYSA-N 2 0 311.813 3.022 20 5 DGBDRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000121793438 195348461 /nfs/dbraw/zinc/34/84/61/195348461.db2.gz XNXZUKOGAMTYFX-AWEZNQCLSA-N 2 0 305.422 3.367 20 5 DGBDRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000415025571 533553451 /nfs/dbraw/zinc/55/34/51/533553451.db2.gz REOZERPHGCBVMW-LBPRGKRZSA-N 2 0 303.362 3.072 20 5 DGBDRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000596106087 400318419 /nfs/dbraw/zinc/31/84/19/400318419.db2.gz PHJLLPRHOHXXQW-OAHLLOKOSA-N 2 0 317.389 3.318 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCC1 ZINC000596649318 400472186 /nfs/dbraw/zinc/47/21/86/400472186.db2.gz YPDJRTPSKSKEQR-ZDUSSCGKSA-N 2 0 323.462 3.327 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[NH2+]CC1 ZINC000591578317 400541911 /nfs/dbraw/zinc/54/19/11/400541911.db2.gz QICFNHYIDBJGPN-KGLIPLIRSA-N 2 0 323.462 3.197 20 5 DGBDRP CC[NH+](CC)CC1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000047973379 400637164 /nfs/dbraw/zinc/63/71/64/400637164.db2.gz UKPOAPHYRRCRKK-UHFFFAOYSA-N 2 0 319.449 3.457 20 5 DGBDRP CCC[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000593324701 400819365 /nfs/dbraw/zinc/81/93/65/400819365.db2.gz YOVFRJNOSRUWRP-KRWDZBQOSA-N 2 0 305.422 3.415 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000599071790 400950918 /nfs/dbraw/zinc/95/09/18/400950918.db2.gz SWIZXRNBOVTKAJ-JKSUJKDBSA-N 2 0 319.449 3.237 20 5 DGBDRP CC[N@@H+]1CCC[C@H]1CNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000599015125 400927107 /nfs/dbraw/zinc/92/71/07/400927107.db2.gz FTHIJJSOWHVNLD-ZDUSSCGKSA-N 2 0 300.362 3.039 20 5 DGBDRP CC[NH+]1CCC(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000615721222 401143749 /nfs/dbraw/zinc/14/37/49/401143749.db2.gz AMHRZRGFIZPOLX-RVDMUPIBSA-N 2 0 317.433 3.320 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000364448463 287027894 /nfs/dbraw/zinc/02/78/94/287027894.db2.gz QKWZQFOJOPZPDI-DJIMGWMZSA-N 2 0 317.433 3.132 20 5 DGBDRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000346693035 264080242 /nfs/dbraw/zinc/08/02/42/264080242.db2.gz KMGIFNUEYPWQTO-OLZOCXBDSA-N 2 0 315.373 3.024 20 5 DGBDRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000423461315 274956642 /nfs/dbraw/zinc/95/66/42/274956642.db2.gz CCAGVUUIWDJWBS-SUYBPPKGSA-N 2 0 303.406 3.079 20 5 DGBDRP CC1(C)C[C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2cc([N+](=O)[O-])ccc21 ZINC000423479301 275867376 /nfs/dbraw/zinc/86/73/76/275867376.db2.gz MCJXNBMJRRWVKX-DYVFJYSZSA-N 2 0 317.433 3.439 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)cc1[N+](=O)[O-] ZINC000442928106 278035655 /nfs/dbraw/zinc/03/56/55/278035655.db2.gz PIRHSKWNKXKWCW-AWEZNQCLSA-N 2 0 305.422 3.279 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000415014441 279254881 /nfs/dbraw/zinc/25/48/81/279254881.db2.gz MFNDUTHTUIUETI-HLLBOEOZSA-N 2 0 319.449 3.413 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000420314451 433162975 /nfs/dbraw/zinc/16/29/75/433162975.db2.gz KXPMRBPXBVTJOE-GOEBONIOSA-N 2 0 317.433 3.286 20 5 DGBDRP C[NH+](C)C1CCC(Nc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000420633381 433236508 /nfs/dbraw/zinc/23/65/08/433236508.db2.gz YIJMUHZLNPSNMY-UHFFFAOYSA-N 2 0 314.389 3.428 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000449091278 433722776 /nfs/dbraw/zinc/72/27/76/433722776.db2.gz POVQOOQRWSLEAG-CQSZACIVSA-N 2 0 319.449 3.378 20 5 DGBDRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422915872 434108870 /nfs/dbraw/zinc/10/88/70/434108870.db2.gz BVUXIVWADYMGMM-NVXWUHKLSA-N 2 0 305.422 3.025 20 5 DGBDRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422915873 434110119 /nfs/dbraw/zinc/11/01/19/434110119.db2.gz BVUXIVWADYMGMM-RDJZCZTQSA-N 2 0 305.422 3.025 20 5 DGBDRP O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000423010049 434160790 /nfs/dbraw/zinc/16/07/90/434160790.db2.gz FRKXWBXLSVJXFH-FGTMMUONSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000423011961 434166501 /nfs/dbraw/zinc/16/65/01/434166501.db2.gz JUDSLEJFIPLHEI-GOEBONIOSA-N 2 0 305.422 3.038 20 5 DGBDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423147416 434247298 /nfs/dbraw/zinc/24/72/98/434247298.db2.gz RZQKSOBATLPKFA-RYUDHWBXSA-N 2 0 314.389 3.169 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423244949 434309374 /nfs/dbraw/zinc/30/93/74/434309374.db2.gz ICBRWQAGGWQCGV-ZIAGYGMSSA-N 2 0 323.462 3.055 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423257762 434318842 /nfs/dbraw/zinc/31/88/42/434318842.db2.gz KWWAJIWZKBJNSJ-UONOGXRCSA-N 2 0 321.421 3.034 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21)C[NH+](C)C ZINC000417353443 434361435 /nfs/dbraw/zinc/36/14/35/434361435.db2.gz XHALQHYSTOLBJT-CXAGYDPISA-N 2 0 305.422 3.150 20 5 DGBDRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000437799025 434337111 /nfs/dbraw/zinc/33/71/11/434337111.db2.gz LITAYYSAKDHIBF-LHUBUQBQSA-N 2 0 317.433 3.166 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423444022 434429176 /nfs/dbraw/zinc/42/91/76/434429176.db2.gz WDGNOCDLONROID-MLGOLLRUSA-N 2 0 305.422 3.424 20 5 DGBDRP CCC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423572067 434490154 /nfs/dbraw/zinc/49/01/54/434490154.db2.gz YFNYVIQITCUUQE-QGZVFWFLSA-N 2 0 303.406 3.335 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459777184 434715051 /nfs/dbraw/zinc/71/50/51/434715051.db2.gz KGDGDXQBKDZCOM-HZPDHXFCSA-N 2 0 319.449 3.237 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459777186 434715555 /nfs/dbraw/zinc/71/55/55/434715555.db2.gz KGDGDXQBKDZCOM-JKSUJKDBSA-N 2 0 319.449 3.237 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000531721903 435112665 /nfs/dbraw/zinc/11/26/65/435112665.db2.gz XMLWLPXJWVTFPM-HZSPNIEDSA-N 2 0 303.406 3.179 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000560897080 435194608 /nfs/dbraw/zinc/19/46/08/435194608.db2.gz SWCZJZNRAOGQLU-CABCVRRESA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000560897081 435195078 /nfs/dbraw/zinc/19/50/78/435195078.db2.gz SWCZJZNRAOGQLU-GJZGRUSLSA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1ccc([C@H](C)NCC[C@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000538278049 435490822 /nfs/dbraw/zinc/49/08/22/435490822.db2.gz JGEWMASVDSHLAB-GOEBONIOSA-N 2 0 305.422 3.428 20 5 DGBDRP CN(CCC[NH+](C)C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000576623944 316150354 /nfs/dbraw/zinc/15/03/54/316150354.db2.gz ZPDWVVGKKUUZSM-UHFFFAOYSA-N 2 0 317.389 3.238 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000576742577 316162167 /nfs/dbraw/zinc/16/21/67/316162167.db2.gz VKUCKXQHLJBEFH-FVLHSZHDSA-N 2 0 317.433 3.318 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000415010786 533847418 /nfs/dbraw/zinc/84/74/18/533847418.db2.gz GTEAHFHRENJGJG-CYBMUJFWSA-N 2 0 317.389 3.462 20 5 DGBDRP CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CCC[NH2+]CC1 ZINC000435389972 527871002 /nfs/dbraw/zinc/87/10/02/527871002.db2.gz NRBZIAXWYXSQLY-BVBGJJFLSA-N 2 0 303.406 3.072 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[C@@H](n2ccnc2)C1 ZINC000746666501 575467827 /nfs/dbraw/zinc/46/78/27/575467827.db2.gz OOYFMOLCQALCPG-CQSZACIVSA-N 2 0 320.780 3.282 20 5 DGBDRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000897465720 619130517 /nfs/dbraw/zinc/13/05/17/619130517.db2.gz GZQPHMWGCTZUIR-LZWOXQAQSA-N 2 0 305.422 3.018 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1)c1ccccc1[N+](=O)[O-] ZINC000902428007 619634114 /nfs/dbraw/zinc/63/41/14/619634114.db2.gz AEEAVTXEHFKDMC-XLNGHYISSA-N 2 0 317.433 3.209 20 5 DGBDRP C[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000902428322 619634318 /nfs/dbraw/zinc/63/43/18/619634318.db2.gz BULKSIIIEWTMAI-JLZZUVOBSA-N 2 0 311.385 3.433 20 5 DGBDRP [NH3+]CC1([C@H]2CCCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000903814148 619814486 /nfs/dbraw/zinc/81/44/86/619814486.db2.gz KOUQUQGRAAFUSM-MRXNPFEDSA-N 2 0 303.406 3.078 20 5 DGBDRP [NH3+]CC[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000904405133 619920207 /nfs/dbraw/zinc/92/02/07/619920207.db2.gz FHQHNDUDQIBBKZ-ZDUSSCGKSA-N 2 0 315.373 3.026 20 5 DGBDRP Cc1c(C[NH2+]C2CCC(C)([NH+]3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000922845977 621108004 /nfs/dbraw/zinc/10/80/04/621108004.db2.gz IRHCNVVJOXJBAL-UHFFFAOYSA-N 2 0 317.433 3.400 20 5 DGBDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872033077 622764872 /nfs/dbraw/zinc/76/48/72/622764872.db2.gz DXNUBNYENQKXDN-LBPRGKRZSA-N 2 0 309.385 3.116 20 5 DGBDRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077766 622792636 /nfs/dbraw/zinc/79/26/36/622792636.db2.gz AXTBSPZDRBSXJR-CHWSQXEVSA-N 2 0 309.385 3.116 20 5 DGBDRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077768 622792897 /nfs/dbraw/zinc/79/28/97/622792897.db2.gz AXTBSPZDRBSXJR-QWHCGFSZSA-N 2 0 309.385 3.116 20 5 DGBDRP CCC[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000873264929 623097004 /nfs/dbraw/zinc/09/70/04/623097004.db2.gz JLZKJAHGSRYSOE-CXAGYDPISA-N 2 0 305.422 3.414 20 5 DGBDRP C[NH+](C)CCCC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811476110 627278776 /nfs/dbraw/zinc/27/87/76/627278776.db2.gz FMCVTHZINHWPPW-UHFFFAOYSA-N 2 0 320.220 3.333 20 5 DGBDRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C2CCCC2)cc1[N+](=O)[O-] ZINC000925733720 627784340 /nfs/dbraw/zinc/78/43/40/627784340.db2.gz LULIQTVBUBFVKE-IAGOWNOFSA-N 2 0 317.433 3.161 20 5 DGBDRP C[NH+](C)C1CCC([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000817415948 627896756 /nfs/dbraw/zinc/89/67/56/627896756.db2.gz BIBRGZBCCWSODN-UHFFFAOYSA-N 2 0 311.813 3.211 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)cc1Cl ZINC000843126591 630616376 /nfs/dbraw/zinc/61/63/76/630616376.db2.gz LAINRBZDJUCDIR-AWEZNQCLSA-N 2 0 323.824 3.070 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)c1 ZINC000843127853 630616920 /nfs/dbraw/zinc/61/69/20/630616920.db2.gz UCHUIALQENCLPP-CYBMUJFWSA-N 2 0 323.824 3.070 20 5 DGBDRP C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@H]1CC[NH3+] ZINC000844902653 630973071 /nfs/dbraw/zinc/97/30/71/630973071.db2.gz URDHPGHJYZCAIR-FZMZJTMJSA-N 2 0 311.813 3.198 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC001620965182 1192682854 /nfs/dbraw/zinc/68/28/54/1192682854.db2.gz VGBUZODDDQWBOZ-VGOFMYFVSA-N 2 0 322.368 3.436 20 5 DGBDRP CC[NH+]1CCC(CC[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC001655714693 1195954987 /nfs/dbraw/zinc/95/49/87/1195954987.db2.gz JJSXFMIAYGKJEU-UHFFFAOYSA-N 2 0 319.449 3.423 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1NC[C@@]1(F)CCCC[NH2+]C1 ZINC001162583252 1089808346 /nfs/dbraw/zinc/80/83/46/1089808346.db2.gz LOZTYJOTMDYBHX-GOSISDBHSA-N 2 0 308.465 3.177 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCN(CC(C)(C)C)C1 ZINC001173222609 1097373241 /nfs/dbraw/zinc/37/32/41/1097373241.db2.gz XMLMEAIQRDCRCO-ZBFHGGJFSA-N 2 0 319.449 3.236 20 5 DGBDRP CC[NH+](CC)CCCC[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC001254534849 1106096785 /nfs/dbraw/zinc/09/67/85/1106096785.db2.gz CMTBVKIZXTVQHL-HNNXBMFYSA-N 2 0 307.438 3.237 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC[C@H]1N(C)C ZINC001319201284 1108362031 /nfs/dbraw/zinc/36/20/31/1108362031.db2.gz OPZZQNJNVKGQNG-UWWQBHOKSA-N 2 0 319.449 3.378 20 5 DGBDRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000278391261 214138934 /nfs/dbraw/zinc/13/89/34/214138934.db2.gz FUZOPEHLDRDDKY-CYBMUJFWSA-N 2 0 303.406 3.120 20 5 DGBDRP CC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cccc([N+](=O)[O-])c1 ZINC000423372865 529629526 /nfs/dbraw/zinc/62/95/26/529629526.db2.gz HIFPMVKSAAQZAC-SFHVURJKSA-N 2 0 311.385 3.439 20 5 DGBDRP Cc1c([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000152427859 186071675 /nfs/dbraw/zinc/07/16/75/186071675.db2.gz CRBMGMQMYRQPCZ-KBPBESRZSA-N 2 0 303.406 3.038 20 5 DGBDRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000173447515 198215483 /nfs/dbraw/zinc/21/54/83/198215483.db2.gz MNRIYAJMTJHOGT-AWEZNQCLSA-N 2 0 305.422 3.367 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000415069952 237052530 /nfs/dbraw/zinc/05/25/30/237052530.db2.gz PRWRVHKITSJWPP-RHSMWYFYSA-N 2 0 317.433 3.038 20 5 DGBDRP [NH3+]C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435390400 238299824 /nfs/dbraw/zinc/29/98/24/238299824.db2.gz OYYGKZIBHLXSCZ-LBPRGKRZSA-N 2 0 317.414 3.104 20 5 DGBDRP CCC[NH+]1CCC(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449133663 240033248 /nfs/dbraw/zinc/03/32/48/240033248.db2.gz ZKAWCDFFECUTLZ-OAHLLOKOSA-N 2 0 319.449 3.237 20 5 DGBDRP CCC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000121211877 284191305 /nfs/dbraw/zinc/19/13/05/284191305.db2.gz IUWMMRAFSUEMDI-WMLDXEAASA-N 2 0 305.422 3.367 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000344792502 254306157 /nfs/dbraw/zinc/30/61/57/254306157.db2.gz NAMUWOIUEYAAMT-MBSJSRAVSA-N 2 0 315.417 3.072 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000468650666 533410464 /nfs/dbraw/zinc/41/04/64/533410464.db2.gz VFKCSVCJGLXUJR-POPWGMBXSA-N 2 0 303.406 3.070 20 5 DGBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000595900367 400290999 /nfs/dbraw/zinc/29/09/99/400290999.db2.gz DHBBOCMLZPQGCV-YOEHRIQHSA-N 2 0 317.433 3.367 20 5 DGBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595901499 400291060 /nfs/dbraw/zinc/29/10/60/400291060.db2.gz XKQKUYRQZXEQIP-RHSMWYFYSA-N 2 0 317.433 3.367 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000595900987 400291110 /nfs/dbraw/zinc/29/11/10/400291110.db2.gz RGVKHGGGHGEHDN-GOEBONIOSA-N 2 0 317.433 3.367 20 5 DGBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000596111354 400320517 /nfs/dbraw/zinc/32/05/17/400320517.db2.gz WEQZWCUXXOEWTI-USXIJHARSA-N 2 0 319.449 3.269 20 5 DGBDRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000592438263 400649255 /nfs/dbraw/zinc/64/92/55/400649255.db2.gz IAPATTBNGLNQEY-RYUDHWBXSA-N 2 0 303.362 3.070 20 5 DGBDRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cccc([N+](=O)[O-])c1 ZINC000593318581 400817220 /nfs/dbraw/zinc/81/72/20/400817220.db2.gz FDJQBOBXHATMIE-KRWDZBQOSA-N 2 0 317.364 3.434 20 5 DGBDRP C[C@H]([NH2+]C[C@@H]1CCN1C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599073495 400950948 /nfs/dbraw/zinc/95/09/48/400950948.db2.gz HBZFUGZAWQJIDI-GUYCJALGSA-N 2 0 303.406 3.262 20 5 DGBDRP CC1(C)CCC[N@@H+]1CCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000599088303 400956643 /nfs/dbraw/zinc/95/66/43/400956643.db2.gz QAXAKBAUMNOGCJ-UHFFFAOYSA-N 2 0 314.389 3.429 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420327197 292296055 /nfs/dbraw/zinc/29/60/55/292296055.db2.gz KYOZZGLIXVGLBV-JYJNAYRXSA-N 2 0 317.433 3.286 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)cc1[N+](=O)[O-] ZINC000346827199 264104870 /nfs/dbraw/zinc/10/48/70/264104870.db2.gz HTRVSFTWZIJDKO-UAGQMJEPSA-N 2 0 317.433 3.277 20 5 DGBDRP [NH3+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000347091347 264154796 /nfs/dbraw/zinc/15/47/96/264154796.db2.gz FDJZLNHCTQNSPP-ZDUSSCGKSA-N 2 0 315.373 3.026 20 5 DGBDRP C[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@H]1[NH3+] ZINC000347106895 264157648 /nfs/dbraw/zinc/15/76/48/264157648.db2.gz MCOLTRHKXYRZEM-MLGOLLRUSA-N 2 0 315.373 3.024 20 5 DGBDRP Cc1cc(NCC[C@H]2CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261611574 432433380 /nfs/dbraw/zinc/43/33/80/432433380.db2.gz BDOGDZMEJCAHLN-CYBMUJFWSA-N 2 0 314.389 3.253 20 5 DGBDRP O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000261661043 432439520 /nfs/dbraw/zinc/43/95/20/432439520.db2.gz GEVWKZGBRWUCDU-RCCFBDPRSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000262051551 432472395 /nfs/dbraw/zinc/47/23/95/432472395.db2.gz CXINFESUILKMBI-ZBFHGGJFSA-N 2 0 305.422 3.038 20 5 DGBDRP C[C@@H](NCc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185701767 432525225 /nfs/dbraw/zinc/52/52/25/432525225.db2.gz GDNMASZEYPHWQA-ZBFHGGJFSA-N 2 0 317.433 3.337 20 5 DGBDRP C[NH+](C)CCCC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278960553 432921759 /nfs/dbraw/zinc/92/17/59/432921759.db2.gz BGJZYJMAUXONNH-INIZCTEOSA-N 2 0 305.422 3.249 20 5 DGBDRP C[N@@H+]1CC[C@@H]2[C@H](CCCN2C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000290574188 433101057 /nfs/dbraw/zinc/10/10/57/433101057.db2.gz UAKAMMGDWAIGKK-MWRSBEEJSA-N 2 0 315.417 3.024 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420327196 433167179 /nfs/dbraw/zinc/16/71/79/433167179.db2.gz KYOZZGLIXVGLBV-HRCADAONSA-N 2 0 317.433 3.286 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000420338160 433171397 /nfs/dbraw/zinc/17/13/97/433171397.db2.gz PCYBNCONONJADV-KSSFIOAISA-N 2 0 317.433 3.428 20 5 DGBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414689814 433792204 /nfs/dbraw/zinc/79/22/04/433792204.db2.gz LVCOLRTTXYVQSM-ZBFHGGJFSA-N 2 0 305.422 3.193 20 5 DGBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2CC[NH2+]CC2)s1 ZINC000414795792 433838451 /nfs/dbraw/zinc/83/84/51/433838451.db2.gz XAFQHBOLOPYFAQ-UHFFFAOYSA-N 2 0 317.414 3.165 20 5 DGBDRP C[NH+]1CCC(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433180493 433841313 /nfs/dbraw/zinc/84/13/13/433841313.db2.gz VOGRXMYIWGINLT-KRWDZBQOSA-N 2 0 317.433 3.249 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)c(Cl)c1 ZINC000357058615 433848217 /nfs/dbraw/zinc/84/82/17/433848217.db2.gz VWXNJIAOBTYJMD-CYBMUJFWSA-N 2 0 323.824 3.070 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]([NH3+])C(C)C ZINC000423279210 434333592 /nfs/dbraw/zinc/33/35/92/434333592.db2.gz RUCVKHSNOHUTAX-OLZOCXBDSA-N 2 0 311.451 3.038 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1[N+](=O)[O-] ZINC000423362325 434379761 /nfs/dbraw/zinc/37/97/61/434379761.db2.gz SQZPPEPDAAIWDT-ZDUSSCGKSA-N 2 0 311.385 3.357 20 5 DGBDRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000423284184 434338974 /nfs/dbraw/zinc/33/89/74/434338974.db2.gz WNHQDCPWHPUFMY-XKQJLSEDSA-N 2 0 303.406 3.079 20 5 DGBDRP CC1(C)C[C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc21 ZINC000423283572 434340908 /nfs/dbraw/zinc/34/09/08/434340908.db2.gz XLLKFOKPUZVEGA-GUYCJALGSA-N 2 0 317.433 3.297 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000423290788 434345777 /nfs/dbraw/zinc/34/57/77/434345777.db2.gz FLWDLGUMRNKJCW-KGLIPLIRSA-N 2 0 313.401 3.335 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000420338561 301865702 /nfs/dbraw/zinc/86/57/02/301865702.db2.gz PCYBNCONONJADV-RDTXWAMCSA-N 2 0 317.433 3.428 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)cc1[N+](=O)[O-] ZINC000925840735 618642887 /nfs/dbraw/zinc/64/28/87/618642887.db2.gz KOHMXVLSNDQVQX-KBRIMQKVSA-N 2 0 303.406 3.086 20 5 DGBDRP [NH3+]CC1([C@H]2CCCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000903815878 619814408 /nfs/dbraw/zinc/81/44/08/619814408.db2.gz TXCAZOMHRHYHLJ-QGZVFWFLSA-N 2 0 317.433 3.121 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2C[C@@H](C)[C@H](CC[NH3+])C2)cc1[N+](=O)[O-] ZINC000903977344 619848699 /nfs/dbraw/zinc/84/86/99/619848699.db2.gz PHUIABDZBHTXPH-UKRRQHHQSA-N 2 0 305.422 3.135 20 5 DGBDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872033075 622765062 /nfs/dbraw/zinc/76/50/62/622765062.db2.gz DXNUBNYENQKXDN-GFCCVEGCSA-N 2 0 309.385 3.116 20 5 DGBDRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872060166 622782087 /nfs/dbraw/zinc/78/20/87/622782087.db2.gz NGSIRHCBUZWZIJ-LBPRGKRZSA-N 2 0 309.385 3.116 20 5 DGBDRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872068622 622787771 /nfs/dbraw/zinc/78/77/71/622787771.db2.gz YAZOMJLHYFVQDU-GFCCVEGCSA-N 2 0 321.396 3.259 20 5 DGBDRP O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)cs1 ZINC000873233005 623085558 /nfs/dbraw/zinc/08/55/58/623085558.db2.gz VTOBOVLEEHHNBS-CYBMUJFWSA-N 2 0 309.435 3.058 20 5 DGBDRP C[C@@H](NCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815554796 627684132 /nfs/dbraw/zinc/68/41/32/627684132.db2.gz IZESTIDXCLBAJB-UONOGXRCSA-N 2 0 320.437 3.092 20 5 DGBDRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000925576243 627757407 /nfs/dbraw/zinc/75/74/07/627757407.db2.gz WLBWWYQKUIPGKH-SFYZZRBRSA-N 2 0 317.433 3.023 20 5 DGBDRP Cc1c(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cccc1[N+](=O)[O-] ZINC000925658002 627771880 /nfs/dbraw/zinc/77/18/80/627771880.db2.gz MKBUMKRDCSGJJR-KRWDZBQOSA-N 2 0 313.401 3.473 20 5 DGBDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817963508 627976978 /nfs/dbraw/zinc/97/69/78/627976978.db2.gz SQGPUOUDSUFIPD-NEPJUHHUSA-N 2 0 314.389 3.048 20 5 DGBDRP C[C@@H]1CC2(C[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-])CC[NH2+]CC2 ZINC000818340689 628015675 /nfs/dbraw/zinc/01/56/75/628015675.db2.gz QNQQSOMGVDLEIA-GFCCVEGCSA-N 2 0 323.824 3.212 20 5 DGBDRP [NH3+]CCCCCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000843126479 630616242 /nfs/dbraw/zinc/61/62/42/630616242.db2.gz GTUNZDQEUMVGDE-UHFFFAOYSA-N 2 0 317.389 3.464 20 5 DGBDRP C[C@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1CC[NH3+] ZINC000844902882 630973004 /nfs/dbraw/zinc/97/30/04/630973004.db2.gz WEIZXEJAINZOLD-NHYWBVRUSA-N 2 0 311.813 3.198 20 5 DGBDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000844905261 630973041 /nfs/dbraw/zinc/97/30/41/630973041.db2.gz WYIGYUUYRLRIFW-UHFFFAOYSA-N 2 0 319.792 3.257 20 5 DGBDRP CC[NH2+]CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000261646327 656942026 /nfs/dbraw/zinc/94/20/26/656942026.db2.gz ATCPHUMMGSMYDC-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1C[C@H]2CCCC[C@]2(C[NH3+])C1 ZINC001579734924 1191989983 /nfs/dbraw/zinc/98/99/83/1191989983.db2.gz SZTLKAOYJZAUKM-QAPCUYQASA-N 2 0 317.433 3.163 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC001580419768 1192025929 /nfs/dbraw/zinc/02/59/29/1192025929.db2.gz LITAYYSAKDHIBF-QSPRXWTASA-N 2 0 317.433 3.166 20 5 DGBDRP C[C@H](C[NH+](C)C)[C@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001183065893 1083872959 /nfs/dbraw/zinc/87/29/59/1083872959.db2.gz RDVOLVZAVZIKIE-CRAIPNDOSA-N 2 0 319.449 3.190 20 5 DGBDRP C[N+](C)(C)CCCO[C@H]1[C@@H]2CC[C@H]1C[N@@H+](Cc1ccccc1)C2 ZINC001224621729 1096248285 /nfs/dbraw/zinc/24/82/85/1096248285.db2.gz CMHVDCZDGKHBGP-PMOLBWCYSA-N 2 0 317.497 3.010 20 5 DGBDRP C[N@H+](C1CCC([NH3+])CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899567 1097267334 /nfs/dbraw/zinc/26/73/34/1097267334.db2.gz APSLUNRWVQARAN-AQFXKWCLSA-N 2 0 317.433 3.044 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC001173217095 1097368949 /nfs/dbraw/zinc/36/89/49/1097368949.db2.gz LLKMKRAQCQLBEO-CVEARBPZSA-N 2 0 319.449 3.380 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCC1CC[NH+](C)CC1 ZINC001173221946 1097372364 /nfs/dbraw/zinc/37/23/64/1097372364.db2.gz RHPCKAMQUMHEAG-OAHLLOKOSA-N 2 0 319.449 3.237 20 5 DGBDRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC001173228911 1097375815 /nfs/dbraw/zinc/37/58/15/1097375815.db2.gz NNCFITSFAZLLBD-HDMKZQKVSA-N 2 0 319.449 3.234 20 5 DGBDRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC001173228912 1097376612 /nfs/dbraw/zinc/37/66/12/1097376612.db2.gz NNCFITSFAZLLBD-IIDMSEBBSA-N 2 0 319.449 3.234 20 5 DGBDRP [NH3+]C1(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCCCC1 ZINC001246279627 1104472543 /nfs/dbraw/zinc/47/25/43/1104472543.db2.gz NYRUVVQXKSGADJ-INIZCTEOSA-N 2 0 317.433 3.093 20 5 DGBDRP C[C@]1([NH3+])CCC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001246555571 1104593870 /nfs/dbraw/zinc/59/38/70/1104593870.db2.gz XTIJJYFLBIPTIX-AEFFLSMTSA-N 2 0 317.433 3.046 20 5 DGBDRP CC(C)[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[NH2+]CC1 ZINC001246581842 1104604136 /nfs/dbraw/zinc/60/41/36/1104604136.db2.gz BGHUUJSGXJGJRG-DOTOQJQBSA-N 2 0 319.449 3.378 20 5 DGBDRP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000278554453 214234197 /nfs/dbraw/zinc/23/41/97/214234197.db2.gz ZQFFQARHRLJUIZ-HWKANZROSA-N 2 0 315.417 3.072 20 5 DGBDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000415019003 237010711 /nfs/dbraw/zinc/01/07/11/237010711.db2.gz VFFAJPSWQGVLIH-ZDUSSCGKSA-N 2 0 317.389 3.462 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000415051879 237036867 /nfs/dbraw/zinc/03/68/67/237036867.db2.gz ZYLPHDDVJQDKFX-JSGCOSHPSA-N 2 0 315.373 3.072 20 5 DGBDRP C[C@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])C[NH+]1CCCCC1 ZINC000449089739 240013104 /nfs/dbraw/zinc/01/31/04/240013104.db2.gz LDXKKEVRNSQKOH-CVEARBPZSA-N 2 0 319.449 3.237 20 5 DGBDRP C[NH+]1CCC(CC[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000105454409 194104730 /nfs/dbraw/zinc/10/47/30/194104730.db2.gz FMJVQNDFHDKTBW-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000470169722 533380769 /nfs/dbraw/zinc/38/07/69/533380769.db2.gz IFJGDWHLZYVMCZ-XBNGYDHASA-N 2 0 317.433 3.272 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000468648021 533384257 /nfs/dbraw/zinc/38/42/57/533384257.db2.gz MWOPCPYEUYZAIG-QYRJGMMTSA-N 2 0 315.417 3.215 20 5 DGBDRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000595101418 400106272 /nfs/dbraw/zinc/10/62/72/400106272.db2.gz FLFCOYHRNOQILS-AWEZNQCLSA-N 2 0 317.433 3.367 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595901635 400290614 /nfs/dbraw/zinc/29/06/14/400290614.db2.gz ZHNLDBQFDHOCOB-HOCLYGCPSA-N 2 0 317.433 3.367 20 5 DGBDRP Cc1c(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)cccc1[N+](=O)[O-] ZINC000595901418 400290963 /nfs/dbraw/zinc/29/09/63/400290963.db2.gz VMHHDWHSYWVGJT-KRWDZBQOSA-N 2 0 317.433 3.115 20 5 DGBDRP C[C@@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@@H]1CCC[NH3+] ZINC000595904638 400292146 /nfs/dbraw/zinc/29/21/46/400292146.db2.gz JJZIYWKNNNIIOZ-IUODEOHRSA-N 2 0 309.385 3.073 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000591578318 400541608 /nfs/dbraw/zinc/54/16/08/400541608.db2.gz QICFNHYIDBJGPN-UONOGXRCSA-N 2 0 323.462 3.197 20 5 DGBDRP Cc1c(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000592492870 400658394 /nfs/dbraw/zinc/65/83/94/400658394.db2.gz FCQGMTXYBLWDQK-WBVHZDCISA-N 2 0 317.433 3.115 20 5 DGBDRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000593318765 400816685 /nfs/dbraw/zinc/81/66/85/400816685.db2.gz HEBDRLRGARRYJY-NSHDSACASA-N 2 0 303.337 3.043 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cc1[N+](=O)[O-] ZINC000593321015 400818409 /nfs/dbraw/zinc/81/84/09/400818409.db2.gz WMAKANFPKAGLEN-GFCCVEGCSA-N 2 0 317.364 3.352 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCCC[N@H+](C)C1 ZINC000599069311 400948169 /nfs/dbraw/zinc/94/81/69/400948169.db2.gz FZGOJRYROVDBEG-GJZGRUSLSA-N 2 0 305.422 3.286 20 5 DGBDRP CC1(C)C[C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2cc([N+](=O)[O-])ccc21 ZINC000423479303 273589160 /nfs/dbraw/zinc/58/91/60/273589160.db2.gz MCJXNBMJRRWVKX-GUYCJALGSA-N 2 0 317.433 3.439 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]C[C@@]2(C)CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc21 ZINC000423350992 275860850 /nfs/dbraw/zinc/86/08/50/275860850.db2.gz YIQYDOGPWVUVJF-AEFFLSMTSA-N 2 0 317.433 3.297 20 5 DGBDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000423434541 278227488 /nfs/dbraw/zinc/22/74/88/278227488.db2.gz OCIUAZJZCMJSOO-BBRMVZONSA-N 2 0 305.422 3.023 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000449218661 278298573 /nfs/dbraw/zinc/29/85/73/278298573.db2.gz KLEGOINMIHLQPT-ZDUSSCGKSA-N 2 0 319.449 3.425 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000449096288 279381980 /nfs/dbraw/zinc/38/19/80/279381980.db2.gz GEIKLDCSPRHAMV-CQSZACIVSA-N 2 0 317.433 3.132 20 5 DGBDRP Cc1c(C[NH+]2CCC(CC[NH+](C)C)CC2)cccc1[N+](=O)[O-] ZINC000056521980 431988193 /nfs/dbraw/zinc/98/81/93/431988193.db2.gz IEVINVMALYENSP-UHFFFAOYSA-N 2 0 305.422 3.067 20 5 DGBDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192720833 432405212 /nfs/dbraw/zinc/40/52/12/432405212.db2.gz ZVVNQBWJLWCNMK-KBXCAEBGSA-N 2 0 317.433 3.294 20 5 DGBDRP CC[C@@H]([NH2+]C[C@@H](C)Cn1ccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000178703817 432768803 /nfs/dbraw/zinc/76/88/03/432768803.db2.gz JPSAJGNZIPQIGC-CXAGYDPISA-N 2 0 316.405 3.477 20 5 DGBDRP C[NH+]1CCC(C)(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000278879702 432911808 /nfs/dbraw/zinc/91/18/08/432911808.db2.gz XRUCQBHAFFPSND-KRWDZBQOSA-N 2 0 317.433 3.294 20 5 DGBDRP Cc1c(C[N@H+]2CCC[C@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000373115434 433097006 /nfs/dbraw/zinc/09/70/06/433097006.db2.gz KOKZOIZUQNXBMY-HNNXBMFYSA-N 2 0 314.389 3.016 20 5 DGBDRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414884774 433898314 /nfs/dbraw/zinc/89/83/14/433898314.db2.gz BEOJEQOQDMGOBQ-NSHDSACASA-N 2 0 305.403 3.150 20 5 DGBDRP [NH3+]CCCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414897660 433904798 /nfs/dbraw/zinc/90/47/98/433904798.db2.gz CBIDAQFKFWIJNK-UHFFFAOYSA-N 2 0 323.780 3.337 20 5 DGBDRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414888868 433906475 /nfs/dbraw/zinc/90/64/75/433906475.db2.gz FRJKOLGFOPYKRL-SNVBAGLBSA-N 2 0 323.780 3.335 20 5 DGBDRP [NH3+]C[C@H](N[C@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CCCC1 ZINC000423507239 434464887 /nfs/dbraw/zinc/46/48/87/434464887.db2.gz PVICZUAWPQZSCC-IRXDYDNUSA-N 2 0 303.406 3.079 20 5 DGBDRP [NH3+]C[C@@H](N[C@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CCCC1 ZINC000423507237 434465869 /nfs/dbraw/zinc/46/58/69/434465869.db2.gz PVICZUAWPQZSCC-DLBZAZTESA-N 2 0 303.406 3.079 20 5 DGBDRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000536867845 435417538 /nfs/dbraw/zinc/41/75/38/435417538.db2.gz FJIOSDRFIUNMBH-VKJFTORMSA-N 2 0 319.449 3.236 20 5 DGBDRP CC[N@@H+]1CC[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000539089488 435538392 /nfs/dbraw/zinc/53/83/92/435538392.db2.gz SLRUGJHDBHQZEF-MAUKXSAKSA-N 2 0 319.449 3.237 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1CC[NH2+]CC1 ZINC000517918256 435618208 /nfs/dbraw/zinc/61/82/08/435618208.db2.gz BBBNXIGGLHFGDO-CQSZACIVSA-N 2 0 323.462 3.055 20 5 DGBDRP CC[NH+](CC)CCNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000302066962 528138544 /nfs/dbraw/zinc/13/85/44/528138544.db2.gz AYKCWWUSURQTCD-UHFFFAOYSA-N 2 0 302.378 3.205 20 5 DGBDRP CCC1([NH3+])CC[NH+]([C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000925756611 618601161 /nfs/dbraw/zinc/60/11/61/618601161.db2.gz MQLSWLWRFMSINI-KRWDZBQOSA-N 2 0 317.433 3.119 20 5 DGBDRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000897465719 619130577 /nfs/dbraw/zinc/13/05/77/619130577.db2.gz GZQPHMWGCTZUIR-FMKPAKJESA-N 2 0 305.422 3.018 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C)c1ccccc1[N+](=O)[O-] ZINC000902432713 619634975 /nfs/dbraw/zinc/63/49/75/619634975.db2.gz WTLAEPDRIMNFAE-QIJZBDPFSA-N 2 0 317.433 3.065 20 5 DGBDRP C[C@H](C[NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-] ZINC000903244735 619743332 /nfs/dbraw/zinc/74/33/32/619743332.db2.gz CIQIZAPINBNGPR-KGLIPLIRSA-N 2 0 305.422 3.018 20 5 DGBDRP Cc1ccc(C[NH+]2CCC(C(C)(C)C[NH3+])CC2)cc1[N+](=O)[O-] ZINC000903791171 619811098 /nfs/dbraw/zinc/81/10/98/619811098.db2.gz QAXCLPUQJYWZKH-UHFFFAOYSA-N 2 0 305.422 3.100 20 5 DGBDRP [NH3+]CC[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000904406933 619919910 /nfs/dbraw/zinc/91/99/10/619919910.db2.gz XUFDSRIFZCOCJP-CYBMUJFWSA-N 2 0 315.373 3.026 20 5 DGBDRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077668 622792936 /nfs/dbraw/zinc/79/29/36/622792936.db2.gz KVMRILWWSFYVCN-LBPRGKRZSA-N 2 0 309.385 3.259 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1C[C@H]3CC[C@@H](C1)[NH2+]3)CCC2 ZINC000873261103 623096321 /nfs/dbraw/zinc/09/63/21/623096321.db2.gz LFWMMYCNDHGMTE-MJXUCMMTSA-N 2 0 315.417 3.092 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000879248492 624463526 /nfs/dbraw/zinc/46/35/26/624463526.db2.gz TZCIZXUKJAJRLC-HNNXBMFYSA-N 2 0 317.433 3.464 20 5 DGBDRP [NH3+]CCc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000841032641 630399027 /nfs/dbraw/zinc/39/90/27/630399027.db2.gz VEXPDWUIPNXNEJ-UHFFFAOYSA-N 2 0 319.792 3.039 20 5 DGBDRP [NH3+]CCCCCC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000843130095 630617713 /nfs/dbraw/zinc/61/77/13/630617713.db2.gz WUBHFJBUXQYHQW-RDJZCZTQSA-N 2 0 319.449 3.415 20 5 DGBDRP C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@@H]1CC[NH3+] ZINC000844902656 630972644 /nfs/dbraw/zinc/97/26/44/630972644.db2.gz URDHPGHJYZCAIR-SMDDNHRTSA-N 2 0 311.813 3.198 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC001580419767 1192025720 /nfs/dbraw/zinc/02/57/20/1192025720.db2.gz LITAYYSAKDHIBF-MWQQHZPXSA-N 2 0 317.433 3.166 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC001580419765 1192025894 /nfs/dbraw/zinc/02/58/94/1192025894.db2.gz LITAYYSAKDHIBF-DZUCGIPZSA-N 2 0 317.433 3.166 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1-n1nc(C[NH3+])c2ccccc21 ZINC001167698429 1083107497 /nfs/dbraw/zinc/10/74/97/1083107497.db2.gz WWVPAAIROBCSQV-UHFFFAOYSA-N 2 0 309.437 3.081 20 5 DGBDRP CCC(CC)[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169000830 1092480907 /nfs/dbraw/zinc/48/09/07/1092480907.db2.gz YTZXZNVCXWKSHP-SRABZTEZSA-N 2 0 311.470 3.192 20 5 DGBDRP C[N+](C)(C)CCCO[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC001224621054 1096249020 /nfs/dbraw/zinc/24/90/20/1096249020.db2.gz JNQIJZZQABVNSN-HSALFYBXSA-N 2 0 317.497 3.010 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCCCCCC[NH3+] ZINC001246079063 1104375026 /nfs/dbraw/zinc/37/50/26/1104375026.db2.gz JAASZAOIVLTJCX-OAHLLOKOSA-N 2 0 307.438 3.415 20 5 DGBDRP CC[NH+](CC)CCCC[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC001254534850 1106096497 /nfs/dbraw/zinc/09/64/97/1106096497.db2.gz CMTBVKIZXTVQHL-OAHLLOKOSA-N 2 0 307.438 3.237 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])n1cc(CC[NH3+])c2c[nH+]ccc21 ZINC001254545822 1106100749 /nfs/dbraw/zinc/10/07/49/1106100749.db2.gz DBOSTZKOUNGNTL-ZDUSSCGKSA-N 2 0 324.384 3.249 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000278465777 214170022 /nfs/dbraw/zinc/17/00/22/214170022.db2.gz GGXFDMMNWMMXJV-UHFFFAOYSA-N 2 0 323.824 3.212 20 5 DGBDRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000423547764 529660995 /nfs/dbraw/zinc/66/09/95/529660995.db2.gz QDWQYMCNXPXKGQ-HWMZRRJGSA-N 2 0 303.406 3.024 20 5 DGBDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000415014852 237004451 /nfs/dbraw/zinc/00/44/51/237004451.db2.gz NGECCHWRIHIFJD-ZDUSSCGKSA-N 2 0 317.389 3.462 20 5 DGBDRP Cc1ccc(C[NH2+]CCCCC[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000292906828 223302850 /nfs/dbraw/zinc/30/28/50/223302850.db2.gz FCQAGQMAAUPPLF-UHFFFAOYSA-N 2 0 305.422 3.259 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCCC[NH+]1CCCC1 ZINC000449345637 240145846 /nfs/dbraw/zinc/14/58/46/240145846.db2.gz WILDDYDOHAFWCJ-MRXNPFEDSA-N 2 0 319.449 3.382 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[N@@H+](C)C(C)C ZINC000468649207 244059645 /nfs/dbraw/zinc/05/96/45/244059645.db2.gz PEVOGASTXUYBFA-RVDMUPIBSA-N 2 0 305.422 3.318 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000125376089 284274720 /nfs/dbraw/zinc/27/47/20/284274720.db2.gz RSNPGEUHYGZITC-CQSZACIVSA-N 2 0 305.422 3.286 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000595900986 400290715 /nfs/dbraw/zinc/29/07/15/400290715.db2.gz RGVKHGGGHGEHDN-GDBMZVCRSA-N 2 0 317.433 3.367 20 5 DGBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000596111353 400321114 /nfs/dbraw/zinc/32/11/14/400321114.db2.gz WEQZWCUXXOEWTI-UAGQMJEPSA-N 2 0 319.449 3.269 20 5 DGBDRP CC1(C)C[C@@H]([NH2+][C@@H]2CC23CC[NH2+]CC3)c2cc([N+](=O)[O-])ccc21 ZINC000591581817 400542980 /nfs/dbraw/zinc/54/29/80/400542980.db2.gz WUCWPSFBCJBZMS-HZPDHXFCSA-N 2 0 315.417 3.049 20 5 DGBDRP CCC[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000591579377 400543057 /nfs/dbraw/zinc/54/30/57/400543057.db2.gz UNKLRDSENACBNU-HOTGVXAUSA-N 2 0 303.406 3.168 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592493985 400658218 /nfs/dbraw/zinc/65/82/18/400658218.db2.gz YFEQXCANLCHRIM-PMPSAXMXSA-N 2 0 317.433 3.367 20 5 DGBDRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCCC1 ZINC000594738032 401166062 /nfs/dbraw/zinc/16/60/62/401166062.db2.gz ATGZTKQSGUJSJX-GDBMZVCRSA-N 2 0 317.433 3.167 20 5 DGBDRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000346678639 264078331 /nfs/dbraw/zinc/07/83/31/264078331.db2.gz MKOAXQBODSROGM-CHWSQXEVSA-N 2 0 315.373 3.024 20 5 DGBDRP CC(C)c1ccc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)cc1[N+](=O)[O-] ZINC000347049249 264146710 /nfs/dbraw/zinc/14/67/10/264146710.db2.gz QINPJJMHPISIQI-CYBMUJFWSA-N 2 0 305.422 3.277 20 5 DGBDRP C[C@@H](C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21)C[NH+](C)C ZINC000417353445 274225634 /nfs/dbraw/zinc/22/56/34/274225634.db2.gz XHALQHYSTOLBJT-GUYCJALGSA-N 2 0 305.422 3.150 20 5 DGBDRP Cc1cc(NC2CCC([NH3+])CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000262146681 274718636 /nfs/dbraw/zinc/71/86/36/274718636.db2.gz MWBVYYOIUVNBIC-UHFFFAOYSA-N 2 0 300.362 3.133 20 5 DGBDRP CC1(C)C[C@H]([NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000423478544 275867898 /nfs/dbraw/zinc/86/78/98/275867898.db2.gz TXDYPIXJJAJXTD-XNJGSVPQSA-N 2 0 317.433 3.424 20 5 DGBDRP O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000261661037 432439191 /nfs/dbraw/zinc/43/91/91/432439191.db2.gz GEVWKZGBRWUCDU-FGTMMUONSA-N 2 0 317.433 3.038 20 5 DGBDRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000264391772 432641435 /nfs/dbraw/zinc/64/14/35/432641435.db2.gz ZEZGUPUCMBUAFP-AWEZNQCLSA-N 2 0 323.437 3.204 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000414173002 433436496 /nfs/dbraw/zinc/43/64/96/433436496.db2.gz FYBGVDHPXFQLGT-CABCVRRESA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1c([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-] ZINC000414176437 433442324 /nfs/dbraw/zinc/44/23/24/433442324.db2.gz IZZIEPYUFDCJHZ-GJZGRUSLSA-N 2 0 305.422 3.286 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000414795282 433838161 /nfs/dbraw/zinc/83/81/61/433838161.db2.gz GMFVNEVABCKISN-BMFZPTHFSA-N 2 0 305.422 3.023 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000414795283 433839697 /nfs/dbraw/zinc/83/96/97/433839697.db2.gz GMFVNEVABCKISN-FVQBIDKESA-N 2 0 305.422 3.023 20 5 DGBDRP [NH3+]CCCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414914915 433914228 /nfs/dbraw/zinc/91/42/28/433914228.db2.gz YHOOZZWRGSCMFZ-UHFFFAOYSA-N 2 0 305.403 3.152 20 5 DGBDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC[NH2+]1 ZINC000414955900 293893205 /nfs/dbraw/zinc/89/32/05/293893205.db2.gz UWVSFLXZNJNNIH-YALNPMBYSA-N 2 0 317.433 3.036 20 5 DGBDRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423039441 434180277 /nfs/dbraw/zinc/18/02/77/434180277.db2.gz FLJUYYQRFJZIPK-ZIAGYGMSSA-N 2 0 311.813 3.040 20 5 DGBDRP C[C@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[NH2+]C1 ZINC000423221526 434293452 /nfs/dbraw/zinc/29/34/52/434293452.db2.gz WXMDDNVRGAWLQZ-OGHNNQOOSA-N 2 0 317.433 3.295 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)C1CC1 ZINC000423484868 434444488 /nfs/dbraw/zinc/44/44/88/434444488.db2.gz REPOROWSTZMMHO-SJORKVTESA-N 2 0 317.433 3.038 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000423499123 434459635 /nfs/dbraw/zinc/45/96/35/434459635.db2.gz HHGFCDCGHPPXCM-MJBXVCDLSA-N 2 0 323.462 3.183 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459785455 434719480 /nfs/dbraw/zinc/71/94/80/434719480.db2.gz OORKCHZTHVMGHE-SFKKXYGYSA-N 2 0 317.433 3.320 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](c2nccn2C)C1 ZINC000568461762 435438488 /nfs/dbraw/zinc/43/84/88/435438488.db2.gz XPAZIUIMWGRSRW-KBPBESRZSA-N 2 0 314.389 3.187 20 5 DGBDRP CC[N@@H+]1CC[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000539089487 435536909 /nfs/dbraw/zinc/53/69/09/435536909.db2.gz SLRUGJHDBHQZEF-CRAIPNDOSA-N 2 0 319.449 3.237 20 5 DGBDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000519155157 435672153 /nfs/dbraw/zinc/67/21/53/435672153.db2.gz AICLJCRQGBNUMJ-VXGBXAGGSA-N 2 0 303.362 3.070 20 5 DGBDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000581285694 324099468 /nfs/dbraw/zinc/09/94/68/324099468.db2.gz NPKMHIBEGJXLMI-CQSZACIVSA-N 2 0 305.422 3.286 20 5 DGBDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000581978659 324174304 /nfs/dbraw/zinc/17/43/04/324174304.db2.gz HRCPAXLMSABYDE-CQSZACIVSA-N 2 0 305.422 3.286 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000415019002 533846120 /nfs/dbraw/zinc/84/61/20/533846120.db2.gz VFFAJPSWQGVLIH-CYBMUJFWSA-N 2 0 317.389 3.462 20 5 DGBDRP O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000419694699 546804038 /nfs/dbraw/zinc/80/40/38/546804038.db2.gz QNOCMRPWCUOUBW-GJZGRUSLSA-N 2 0 323.824 3.007 20 5 DGBDRP O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000419694701 546804270 /nfs/dbraw/zinc/80/42/70/546804270.db2.gz QNOCMRPWCUOUBW-LSDHHAIUSA-N 2 0 323.824 3.007 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1)c1ccccc1[N+](=O)[O-] ZINC000902428006 619634125 /nfs/dbraw/zinc/63/41/25/619634125.db2.gz AEEAVTXEHFKDMC-MXASKKJJSA-N 2 0 317.433 3.209 20 5 DGBDRP C[C@@H]([NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC000903244737 619743342 /nfs/dbraw/zinc/74/33/42/619743342.db2.gz CIQIZAPINBNGPR-ZIAGYGMSSA-N 2 0 305.422 3.018 20 5 DGBDRP O=[N+]([O-])c1cccc(C[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CC2)c1 ZINC000903884407 619828125 /nfs/dbraw/zinc/82/81/25/619828125.db2.gz ZBHKSJUBZGHSBF-MQVJKMGUSA-N 2 0 315.417 3.090 20 5 DGBDRP C[N@@H+]1CCCC[C@H](CNCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000858245729 621167910 /nfs/dbraw/zinc/16/79/10/621167910.db2.gz WPUYMJGAWCDPRR-GFCCVEGCSA-N 2 0 311.813 3.070 20 5 DGBDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000839183480 621344329 /nfs/dbraw/zinc/34/43/29/621344329.db2.gz WWRFMGDQURBIBY-LBPRGKRZSA-N 2 0 311.813 3.070 20 5 DGBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000866282711 622084825 /nfs/dbraw/zinc/08/48/25/622084825.db2.gz PQYPIWNZIKKCBX-KCXAZCMYSA-N 2 0 323.412 3.127 20 5 DGBDRP CCC[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000873269675 623099502 /nfs/dbraw/zinc/09/95/02/623099502.db2.gz JLZKJAHGSRYSOE-SUMWQHHRSA-N 2 0 305.422 3.414 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1CN(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000877516522 623919853 /nfs/dbraw/zinc/91/98/53/623919853.db2.gz BHVXKZPGTCQDCA-XYPWUTKMSA-N 2 0 317.433 3.269 20 5 DGBDRP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788613560 625229876 /nfs/dbraw/zinc/22/98/76/625229876.db2.gz YEIIFHQWIWMTEN-MLGOLLRUSA-N 2 0 322.453 3.194 20 5 DGBDRP [NH3+]C1CCC([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000843106999 630614714 /nfs/dbraw/zinc/61/47/14/630614714.db2.gz OOUZJTVAPOQKHR-UHFFFAOYSA-N 2 0 315.373 3.214 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)cc1Cl ZINC000843124850 630616217 /nfs/dbraw/zinc/61/62/17/630616217.db2.gz JGVOZCFRLPVTBF-ZIAGYGMSSA-N 2 0 323.824 3.070 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843125601 630616388 /nfs/dbraw/zinc/61/63/88/630616388.db2.gz YNTZGUWENLZJOP-CHWSQXEVSA-N 2 0 323.824 3.070 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1C[C@H]2CCCC[C@@]2(C[NH3+])C1 ZINC001579734922 1191989825 /nfs/dbraw/zinc/98/98/25/1191989825.db2.gz SZTLKAOYJZAUKM-CRAIPNDOSA-N 2 0 317.433 3.163 20 5 DGBDRP [NH3+]C[C@H]1CCCC12CC[NH+](Cc1ccc([N+](=O)[O-])cc1F)CC2 ZINC001580260348 1192016999 /nfs/dbraw/zinc/01/69/99/1192016999.db2.gz OBWHSHHVNMRAKT-CQSZACIVSA-N 2 0 321.396 3.075 20 5 DGBDRP C[N@H+](CCCC[NH+]1CCCCC1)CCc1ccc([N+](=O)[O-])cc1 ZINC001473750026 1183797024 /nfs/dbraw/zinc/79/70/24/1183797024.db2.gz SUYVOBLUDJRBLK-UHFFFAOYSA-N 2 0 319.449 3.335 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC001574979665 1191461757 /nfs/dbraw/zinc/46/17/57/1191461757.db2.gz KXBJOFARSWDJOT-NTEUORMPSA-N 2 0 311.385 3.247 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1N1C[C@H]([NH3+])Cc2ccccc21 ZINC001162851112 1089992690 /nfs/dbraw/zinc/99/26/90/1089992690.db2.gz WRBIFZJNBOLIPL-GOSISDBHSA-N 2 0 310.465 3.304 20 5 DGBDRP CCC(CC)[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169000829 1092480762 /nfs/dbraw/zinc/48/07/62/1092480762.db2.gz YTZXZNVCXWKSHP-OTRWWLKZSA-N 2 0 311.470 3.192 20 5 DGBDRP C[C@@H](C[N+](C)(C)C)OC[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001224826917 1096295650 /nfs/dbraw/zinc/29/56/50/1096295650.db2.gz STRKTNGDXSPNHC-PKOBYXMFSA-N 2 0 305.486 3.010 20 5 DGBDRP C[NH+](C)CCCCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899950 1097267785 /nfs/dbraw/zinc/26/77/85/1097267785.db2.gz QIVFMQNUTZCUQJ-KRWDZBQOSA-N 2 0 319.449 3.164 20 5 DGBDRP CC(C)[NH+]1CCC(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173215589 1097367941 /nfs/dbraw/zinc/36/79/41/1097367941.db2.gz XBYSPFQERCHMQQ-OAHLLOKOSA-N 2 0 319.449 3.236 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H](C)[NH2+]C ZINC001326034836 1103188788 /nfs/dbraw/zinc/18/87/88/1103188788.db2.gz APCFVEHMRUAEQQ-OLZOCXBDSA-N 2 0 311.451 3.053 20 5 DGBDRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC001326075889 1103201818 /nfs/dbraw/zinc/20/18/18/1103201818.db2.gz MRIQIEMHNDQQJK-GFCCVEGCSA-N 2 0 319.430 3.411 20 5 DGBDRP O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001328411687 1103937502 /nfs/dbraw/zinc/93/75/02/1103937502.db2.gz HLIDGXQYIDZBPV-ZZXKWVIFSA-N 2 0 315.417 3.074 20 5 DGBDRP CC(C)[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[NH2+]CC1 ZINC001246581846 1104604810 /nfs/dbraw/zinc/60/48/10/1104604810.db2.gz BGHUUJSGXJGJRG-WBVHZDCISA-N 2 0 319.449 3.378 20 5 DGBDRP CC1(C)CC([NH3+])CC(C)(C)[NH+]1[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254581001 1106108585 /nfs/dbraw/zinc/10/85/85/1106108585.db2.gz HOWKRRAGROBUTE-MRXNPFEDSA-N 2 0 317.433 3.042 20 5 DGBDRP CC(C)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)CC1CC[NH+](C)CC1 ZINC001308028086 1111368126 /nfs/dbraw/zinc/36/81/26/1111368126.db2.gz PZDCLFPWDITGFU-UHFFFAOYSA-N 2 0 319.449 3.395 20 5 DGBDRP Cc1c([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000152428049 186071624 /nfs/dbraw/zinc/07/16/24/186071624.db2.gz CRBMGMQMYRQPCZ-UONOGXRCSA-N 2 0 303.406 3.038 20 5 DGBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000415051881 237039323 /nfs/dbraw/zinc/03/93/23/237039323.db2.gz ZYLPHDDVJQDKFX-OCCSQVGLSA-N 2 0 315.373 3.072 20 5 DGBDRP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000193507168 201065425 /nfs/dbraw/zinc/06/54/25/201065425.db2.gz HAAIYCMPDPDLNL-DYVFJYSZSA-N 2 0 303.406 3.120 20 5 DGBDRP C[NH+](C)CCCC(C)(C)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000449527932 240269933 /nfs/dbraw/zinc/26/99/33/240269933.db2.gz LZXQGLJYBJYFCE-JXMROGBWSA-N 2 0 305.422 3.318 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000269006183 432149887 /nfs/dbraw/zinc/14/98/87/432149887.db2.gz QNERRHXCWASOBY-YCPHGPKFSA-N 2 0 303.406 3.072 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000468650665 533385180 /nfs/dbraw/zinc/38/51/80/533385180.db2.gz VFKCSVCJGLXUJR-HHFPWCGMSA-N 2 0 303.406 3.070 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595901636 400290820 /nfs/dbraw/zinc/29/08/20/400290820.db2.gz ZHNLDBQFDHOCOB-ZBFHGGJFSA-N 2 0 317.433 3.367 20 5 DGBDRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000596103459 400318836 /nfs/dbraw/zinc/31/88/36/400318836.db2.gz LHDYHYMVVIZTMH-MRXNPFEDSA-N 2 0 317.389 3.318 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CCC2 ZINC000591582592 400542749 /nfs/dbraw/zinc/54/27/49/400542749.db2.gz MYAFFCRSGVVZQD-RHSMWYFYSA-N 2 0 315.417 3.237 20 5 DGBDRP Cc1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000592433826 400648627 /nfs/dbraw/zinc/64/86/27/400648627.db2.gz ZADUROJDAPLGEH-DLBZAZTESA-N 2 0 317.433 3.115 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]CCCC2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000592470658 400656044 /nfs/dbraw/zinc/65/60/44/400656044.db2.gz AZKCSLSGLGYKHV-AWEZNQCLSA-N 2 0 305.422 3.334 20 5 DGBDRP C[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@@H]1CC[NH3+] ZINC000593316290 400816967 /nfs/dbraw/zinc/81/69/67/400816967.db2.gz OROGWYVSHCXZBH-LTVAEWHBSA-N 2 0 303.406 3.057 20 5 DGBDRP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000599072932 400950422 /nfs/dbraw/zinc/95/04/22/400950422.db2.gz COILPYSFUZLKPZ-YOEHRIQHSA-N 2 0 315.417 3.189 20 5 DGBDRP CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC(C)(C)[NH3+] ZINC000594734859 401164158 /nfs/dbraw/zinc/16/41/58/401164158.db2.gz GCOHRTGAMJJNBL-UHFFFAOYSA-N 2 0 319.430 3.492 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000420305408 292297080 /nfs/dbraw/zinc/29/70/80/292297080.db2.gz KDOVYMVVEDRNHP-MGBSGCIJSA-N 2 0 303.406 3.023 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000269006181 432151878 /nfs/dbraw/zinc/15/18/78/432151878.db2.gz QNERRHXCWASOBY-IJEWVQPXSA-N 2 0 303.406 3.072 20 5 DGBDRP Cc1cc(N[C@@H](C)CC[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302199692 230156033 /nfs/dbraw/zinc/15/60/33/230156033.db2.gz UQBGINDITAXQMJ-NSHDSACASA-N 2 0 302.378 3.204 20 5 DGBDRP C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000346642585 264071357 /nfs/dbraw/zinc/07/13/57/264071357.db2.gz MQQNPTJDMCYPIC-OCCSQVGLSA-N 2 0 315.373 3.024 20 5 DGBDRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346655330 264073512 /nfs/dbraw/zinc/07/35/12/264073512.db2.gz FZHZFZKHIAWYTO-OLZOCXBDSA-N 2 0 315.373 3.024 20 5 DGBDRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000346665661 264076513 /nfs/dbraw/zinc/07/65/13/264076513.db2.gz DGDVSDZDPSOOOE-CHWSQXEVSA-N 2 0 315.373 3.024 20 5 DGBDRP C[NH+]1CCC2(CCC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)CC1 ZINC000368482562 271162854 /nfs/dbraw/zinc/16/28/54/271162854.db2.gz KWXNSKQKZWIBJA-UHFFFAOYSA-N 2 0 321.396 3.042 20 5 DGBDRP Cc1ccc(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)cc1[N+](=O)[O-] ZINC000369203439 271250981 /nfs/dbraw/zinc/25/09/81/271250981.db2.gz LEJUSIACYUKMMY-UHFFFAOYSA-N 2 0 317.433 3.211 20 5 DGBDRP CC1(C)C[C@H]([NH2+]CCC2=CC[NH2+]CC2)c2cc([N+](=O)[O-])ccc21 ZINC000423544544 275867423 /nfs/dbraw/zinc/86/74/23/275867423.db2.gz WYXVCCPGSVOOOW-KRWDZBQOSA-N 2 0 315.417 3.217 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]CCC2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000125351084 431922361 /nfs/dbraw/zinc/92/23/61/431922361.db2.gz IYQIGJXFSXBXQD-CQSZACIVSA-N 2 0 305.422 3.286 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000271353484 432378943 /nfs/dbraw/zinc/37/89/43/432378943.db2.gz YUSOYPDUHVAJPW-KEYYUXOJSA-N 2 0 314.389 3.435 20 5 DGBDRP Cc1c([C@H](C)[NH2+]CCCC[N@H+](C)C2CC2)cccc1[N+](=O)[O-] ZINC000453396435 433153119 /nfs/dbraw/zinc/15/31/19/433153119.db2.gz ITPCNWSOELNPDA-AWEZNQCLSA-N 2 0 305.422 3.428 20 5 DGBDRP C[NH2+]CCC1CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000420314607 433158689 /nfs/dbraw/zinc/15/86/89/433158689.db2.gz VXIDSOSZVCBJAP-CQSZACIVSA-N 2 0 305.422 3.286 20 5 DGBDRP CC[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000414188363 433451606 /nfs/dbraw/zinc/45/16/06/433451606.db2.gz QPAAMTNWANWQAR-YOEHRIQHSA-N 2 0 305.422 3.367 20 5 DGBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000414359599 433566865 /nfs/dbraw/zinc/56/68/65/433566865.db2.gz OULIKTREHWIYIA-AEFFLSMTSA-N 2 0 317.433 3.134 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH2+]CCCCC[NH+]2CCCC2)c(F)c1 ZINC000339501074 433619510 /nfs/dbraw/zinc/61/95/10/433619510.db2.gz UVSNXBBLUMQLMV-UHFFFAOYSA-N 2 0 309.385 3.090 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000449063940 433719482 /nfs/dbraw/zinc/71/94/82/433719482.db2.gz RZZYNCDMMXLGKR-JKSUJKDBSA-N 2 0 319.449 3.380 20 5 DGBDRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414836521 433875195 /nfs/dbraw/zinc/87/51/95/433875195.db2.gz JNZDDJGUICYZHU-GFCCVEGCSA-N 2 0 319.430 3.268 20 5 DGBDRP CCC([NH3+])(CC)C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414812814 433854159 /nfs/dbraw/zinc/85/41/59/433854159.db2.gz RXICCJOOQJQHQK-GDBMZVCRSA-N 2 0 319.449 3.413 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414908275 433909499 /nfs/dbraw/zinc/90/94/99/433909499.db2.gz RLZNYZIDBDKXNV-OIISXLGYSA-N 2 0 317.433 3.038 20 5 DGBDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000414933994 433922251 /nfs/dbraw/zinc/92/22/51/433922251.db2.gz XNPPUKBLCFURAV-QWHCGFSZSA-N 2 0 315.373 3.214 20 5 DGBDRP [NH3+]CC1CCC([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000422918105 434107713 /nfs/dbraw/zinc/10/77/13/434107713.db2.gz HLGQVKYUYNMDAJ-UHFFFAOYSA-N 2 0 305.422 3.025 20 5 DGBDRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000517373089 294671226 /nfs/dbraw/zinc/67/12/26/294671226.db2.gz AWMULTOCPAPJNV-GOSISDBHSA-N 2 0 311.385 3.221 20 5 DGBDRP Cc1c([C@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cccc1[N+](=O)[O-] ZINC000423372085 434392366 /nfs/dbraw/zinc/39/23/66/434392366.db2.gz GRLGMNXSXNSJJP-ZDUSSCGKSA-N 2 0 311.385 3.357 20 5 DGBDRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423471991 434442205 /nfs/dbraw/zinc/44/22/05/434442205.db2.gz ZZOUYCFFUIAGCT-KDOFPFPSSA-N 2 0 313.401 3.401 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459784780 434719859 /nfs/dbraw/zinc/71/98/59/434719859.db2.gz OORKCHZTHVMGHE-QZFKAFNDSA-N 2 0 317.433 3.320 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@H](c2nccn2C)C1 ZINC000568461763 435438929 /nfs/dbraw/zinc/43/89/29/435438929.db2.gz XPAZIUIMWGRSRW-KGLIPLIRSA-N 2 0 314.389 3.187 20 5 DGBDRP CC[N@@H+]1CC[C@H](N(C)C/C=C\c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000539818647 435571141 /nfs/dbraw/zinc/57/11/41/435571141.db2.gz CAVPKYIISJLVPQ-GPXGYGPYSA-N 2 0 317.433 3.413 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000902428317 619634159 /nfs/dbraw/zinc/63/41/59/619634159.db2.gz BULKSIIIEWTMAI-CSMYWGQOSA-N 2 0 311.385 3.433 20 5 DGBDRP N[C@@H]1c2ccccc2C[C@H]1[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000902435528 619635890 /nfs/dbraw/zinc/63/58/90/619635890.db2.gz UOOJMXWVSOAVIE-GUDVDZBRSA-N 2 0 323.396 3.187 20 5 DGBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCC[NH2+]C1 ZINC000903727503 619805049 /nfs/dbraw/zinc/80/50/49/619805049.db2.gz TZWCINJQDUUAJX-INIZCTEOSA-N 2 0 305.422 3.195 20 5 DGBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903887016 619828825 /nfs/dbraw/zinc/82/88/25/619828825.db2.gz WPHCZPXGPAXCLL-ALOPSCKCSA-N 2 0 317.433 3.336 20 5 DGBDRP [NH3+]CC[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000904406934 619920116 /nfs/dbraw/zinc/92/01/16/619920116.db2.gz XUFDSRIFZCOCJP-ZDUSSCGKSA-N 2 0 315.373 3.026 20 5 DGBDRP C[N@H+](CCOCC[NH3+])Cc1c2ccccc2cc2ccccc21 ZINC000863652534 621693820 /nfs/dbraw/zinc/69/38/20/621693820.db2.gz RQJMLXBKQGTBMF-UHFFFAOYSA-N 2 0 308.425 3.400 20 5 DGBDRP Cc1c(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cccc1[N+](=O)[O-] ZINC000757645073 621730745 /nfs/dbraw/zinc/73/07/45/621730745.db2.gz YUQMELIDHKHGJW-QGZVFWFLSA-N 2 0 317.433 3.067 20 5 DGBDRP CC(C)[NH+]1CCC(CC[NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000865717256 621982589 /nfs/dbraw/zinc/98/25/89/621982589.db2.gz UKMJKXNLFTXHBV-UHFFFAOYSA-N 2 0 311.451 3.256 20 5 DGBDRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000865765386 621991606 /nfs/dbraw/zinc/99/16/06/621991606.db2.gz SMULMDXJDDLBRW-UHFFFAOYSA-N 2 0 309.385 3.086 20 5 DGBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000872083718 622795660 /nfs/dbraw/zinc/79/56/60/622795660.db2.gz NWJJQDVUUDZNLB-SGMGOOAPSA-N 2 0 323.462 3.308 20 5 DGBDRP O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)cs1 ZINC000873233006 623085991 /nfs/dbraw/zinc/08/59/91/623085991.db2.gz VTOBOVLEEHHNBS-ZDUSSCGKSA-N 2 0 309.435 3.058 20 5 DGBDRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000783664324 624381244 /nfs/dbraw/zinc/38/12/44/624381244.db2.gz ITKOIVMTHICDSP-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP Cc1c(C[NH2+][C@H]2CC[NH2+]C[C@H]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000925659012 627771587 /nfs/dbraw/zinc/77/15/87/627771587.db2.gz RUVCIUBAVPQZES-IRXDYDNUSA-N 2 0 317.433 3.161 20 5 DGBDRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C[C@H]2C2CCCC2)cc1[N+](=O)[O-] ZINC000925733721 627784160 /nfs/dbraw/zinc/78/41/60/627784160.db2.gz LULIQTVBUBFVKE-IRXDYDNUSA-N 2 0 317.433 3.161 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000843126026 630616599 /nfs/dbraw/zinc/61/65/99/630616599.db2.gz DWCPHHJHRUVWKE-CYBMUJFWSA-N 2 0 323.824 3.070 20 5 DGBDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000844905107 630973100 /nfs/dbraw/zinc/97/31/00/630973100.db2.gz WBYOUTKFUYLYMY-UHFFFAOYSA-N 2 0 319.792 3.257 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC001579734772 1191989792 /nfs/dbraw/zinc/98/97/92/1191989792.db2.gz LCMNZOYJZAXMLZ-INIZCTEOSA-N 2 0 317.433 3.033 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC001620965181 1192682963 /nfs/dbraw/zinc/68/29/63/1192682963.db2.gz VGBUZODDDQWBOZ-AUWJEWJLSA-N 2 0 322.368 3.436 20 5 DGBDRP CC(C)([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccccc1[N+](=O)[O-] ZINC001575379160 1191476954 /nfs/dbraw/zinc/47/69/54/1191476954.db2.gz XKXZRJWRBQZGDM-HDJSIYSDSA-N 2 0 305.422 3.185 20 5 DGBDRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC001576384106 1191576402 /nfs/dbraw/zinc/57/64/02/1191576402.db2.gz UAAIWXQKOBVLCZ-UOJCXKCYSA-N 2 0 317.433 3.021 20 5 DGBDRP C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C1CC[NH+](C2CCCCC2)CC1 ZINC001169054570 1092512239 /nfs/dbraw/zinc/51/22/39/1092512239.db2.gz MRINJYZXCNORNE-QAPCUYQASA-N 2 0 323.481 3.161 20 5 DGBDRP C[N+](C)(C)CCCO[C@@H]1CC[N@H+](Cc2ccccc2Cl)C1 ZINC001224620735 1096248442 /nfs/dbraw/zinc/24/84/42/1096248442.db2.gz CGBRQKXQYDCIRH-MRXNPFEDSA-N 2 0 311.877 3.027 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC001173217096 1097368444 /nfs/dbraw/zinc/36/84/44/1097368444.db2.gz LLKMKRAQCQLBEO-HOTGVXAUSA-N 2 0 319.449 3.380 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCCCCCC[NH3+] ZINC001246082860 1104376090 /nfs/dbraw/zinc/37/60/90/1104376090.db2.gz YVLJZKZLFWSLCZ-OAHLLOKOSA-N 2 0 307.438 3.415 20 5 DGBDRP [NH3+]C1(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCCCC1 ZINC001246279628 1104472769 /nfs/dbraw/zinc/47/27/69/1104472769.db2.gz NYRUVVQXKSGADJ-MRXNPFEDSA-N 2 0 317.433 3.093 20 5 DGBDRP CC(C)[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])[C@@H]1CCC[NH2+]CC1 ZINC001246595269 1104612860 /nfs/dbraw/zinc/61/28/60/1104612860.db2.gz SZQVCVVLEPHNIN-NVXWUHKLSA-N 2 0 319.449 3.378 20 5 DGBDRP [NH3+]CCC[N@H+]([C@H]1Cc2ccc([N+](=O)[O-])cc2C1)C1CCCCC1 ZINC001254571672 1106106204 /nfs/dbraw/zinc/10/62/04/1106106204.db2.gz ADENEOGGXUMGOQ-SFHVURJKSA-N 2 0 317.433 3.046 20 5 DGBDRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cccc1[N+](=O)[O-] ZINC000278516433 214206356 /nfs/dbraw/zinc/20/63/56/214206356.db2.gz RYTGNSUCFMFBRC-AWEZNQCLSA-N 2 0 317.433 3.428 20 5 DGBDRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000173447528 198215909 /nfs/dbraw/zinc/21/59/09/198215909.db2.gz MNRIYAJMTJHOGT-CQSZACIVSA-N 2 0 305.422 3.367 20 5 DGBDRP C[NH+](C)CC(C)(C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000132107268 432044525 /nfs/dbraw/zinc/04/45/25/432044525.db2.gz ZEVAPKDDZCCLOC-INIZCTEOSA-N 2 0 319.449 3.093 20 5 DGBDRP CC(C)N(CC[C@@H]1CCC[N@@H+]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000179409397 432057141 /nfs/dbraw/zinc/05/71/41/432057141.db2.gz DRLSXUWVQXXODM-INIZCTEOSA-N 2 0 305.422 3.290 20 5 DGBDRP CCC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271883968 209293835 /nfs/dbraw/zinc/29/38/35/209293835.db2.gz QGBBAJQYIWWUEV-KRWDZBQOSA-N 2 0 303.406 3.288 20 5 DGBDRP C[C@@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])C[NH+]1CCCCC1 ZINC000449089740 240012301 /nfs/dbraw/zinc/01/23/01/240012301.db2.gz LDXKKEVRNSQKOH-HOTGVXAUSA-N 2 0 319.449 3.237 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCCC[NH+]1CCCC1 ZINC000449345550 240146055 /nfs/dbraw/zinc/14/60/55/240146055.db2.gz WILDDYDOHAFWCJ-INIZCTEOSA-N 2 0 319.449 3.382 20 5 DGBDRP CCC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000121212149 284191267 /nfs/dbraw/zinc/19/12/67/284191267.db2.gz IUWMMRAFSUEMDI-RHSMWYFYSA-N 2 0 305.422 3.367 20 5 DGBDRP CN(CCC[NH+]1CCCC1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000337221119 253064790 /nfs/dbraw/zinc/06/47/90/253064790.db2.gz DVGJOTDWUHFSQF-UHFFFAOYSA-N 2 0 311.813 3.166 20 5 DGBDRP CC(C)c1ccc(C[NH2+]CC2=CC[N@H+](C)CC2)cc1[N+](=O)[O-] ZINC000345159818 254335029 /nfs/dbraw/zinc/33/50/29/254335029.db2.gz FVRSBCHNMAJDQG-UHFFFAOYSA-N 2 0 303.406 3.070 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000344792495 254305988 /nfs/dbraw/zinc/30/59/88/254305988.db2.gz NAMUWOIUEYAAMT-IDJPSDCMSA-N 2 0 315.417 3.072 20 5 DGBDRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000415024116 533553803 /nfs/dbraw/zinc/55/38/03/533553803.db2.gz OIXHLEBRMUPJCZ-LBPRGKRZSA-N 2 0 303.362 3.072 20 5 DGBDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000589195028 400274059 /nfs/dbraw/zinc/27/40/59/400274059.db2.gz BZLDSUGYAGBBHO-CVEARBPZSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@@H]1CCC[NH3+] ZINC000595905621 400292507 /nfs/dbraw/zinc/29/25/07/400292507.db2.gz WEIXGTOIGVQDGC-MLGOLLRUSA-N 2 0 309.385 3.073 20 5 DGBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000596111352 400319951 /nfs/dbraw/zinc/31/99/51/400319951.db2.gz WEQZWCUXXOEWTI-OIISXLGYSA-N 2 0 319.449 3.269 20 5 DGBDRP O=[N+]([O-])c1ccc(CN2CCC[C@@H](n3ccnc3)C2)c(Cl)c1 ZINC000611782104 400452219 /nfs/dbraw/zinc/45/22/19/400452219.db2.gz MRFRTEJYSZXJPL-CQSZACIVSA-N 2 0 320.780 3.282 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000591282648 400506562 /nfs/dbraw/zinc/50/65/62/400506562.db2.gz JURCBXJFUKOCHM-ZBFHGGJFSA-N 2 0 317.433 3.180 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[NH2+]CC1 ZINC000591578316 400541827 /nfs/dbraw/zinc/54/18/27/400541827.db2.gz QICFNHYIDBJGPN-KBPBESRZSA-N 2 0 323.462 3.197 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CCC2 ZINC000591582593 400542519 /nfs/dbraw/zinc/54/25/19/400542519.db2.gz MYAFFCRSGVVZQD-WMLDXEAASA-N 2 0 315.417 3.237 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CCC2 ZINC000591582591 400542881 /nfs/dbraw/zinc/54/28/81/400542881.db2.gz MYAFFCRSGVVZQD-PBHICJAKSA-N 2 0 315.417 3.237 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000075645037 400600537 /nfs/dbraw/zinc/60/05/37/400600537.db2.gz NYZQKBGODWEBBJ-AWEZNQCLSA-N 2 0 305.422 3.320 20 5 DGBDRP CC1(C)C[C@H]([NH2+]CCC2CC[NH2+]CC2)c2cc([N+](=O)[O-])ccc21 ZINC000593322459 400818297 /nfs/dbraw/zinc/81/82/97/400818297.db2.gz NIGBKGDXKBNDLM-KRWDZBQOSA-N 2 0 317.433 3.297 20 5 DGBDRP CN(CC1([NH+](C)C)CCC1)c1ccc2cnccc2c1[N+](=O)[O-] ZINC000599071957 400950581 /nfs/dbraw/zinc/95/05/81/400950581.db2.gz CTRNBCJLZZJRRG-UHFFFAOYSA-N 2 0 314.389 3.064 20 5 DGBDRP CC[NH+]1CCC(CC[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000594496885 401079731 /nfs/dbraw/zinc/07/97/31/401079731.db2.gz YMENDKWQOTVAMS-QGZVFWFLSA-N 2 0 317.433 3.294 20 5 DGBDRP Cc1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)cc1[N+](=O)[O-] ZINC000594736594 401165719 /nfs/dbraw/zinc/16/57/19/401165719.db2.gz SKVWJYDDRXBQPT-KRWDZBQOSA-N 2 0 317.433 3.115 20 5 DGBDRP C[C@@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000192698719 274225923 /nfs/dbraw/zinc/22/59/23/274225923.db2.gz MVIXSWZQSGJTNX-KSSFIOAISA-N 2 0 317.433 3.294 20 5 DGBDRP CCC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000124165754 431885396 /nfs/dbraw/zinc/88/53/96/431885396.db2.gz DTUQAIBMLGUGGV-PBHICJAKSA-N 2 0 305.422 3.367 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000420311372 281021471 /nfs/dbraw/zinc/02/14/71/281021471.db2.gz QZASBHDZOLQNEK-AWEZNQCLSA-N 2 0 303.406 3.040 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCC[NH+]1CCCC1)CCC2 ZINC000192618776 432393365 /nfs/dbraw/zinc/39/33/65/432393365.db2.gz NKSPEGIBMPTBFG-QGZVFWFLSA-N 2 0 303.406 3.048 20 5 DGBDRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000262051539 432472422 /nfs/dbraw/zinc/47/24/22/432472422.db2.gz CXINFESUILKMBI-GOEBONIOSA-N 2 0 305.422 3.038 20 5 DGBDRP CC(C)[N@H+](CC[C@@H]1CCC[NH2+]C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000420297318 433148629 /nfs/dbraw/zinc/14/86/29/433148629.db2.gz CXBMYCYXGODFTN-HNNXBMFYSA-N 2 0 305.422 3.195 20 5 DGBDRP C[N@@H+]1CC[C@H]2[C@@H](CCCN2C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000290574191 433100986 /nfs/dbraw/zinc/10/09/86/433100986.db2.gz UAKAMMGDWAIGKK-SFXFJHKKSA-N 2 0 315.417 3.024 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420327195 433166250 /nfs/dbraw/zinc/16/62/50/433166250.db2.gz KYOZZGLIXVGLBV-ARFHVFGLSA-N 2 0 317.433 3.286 20 5 DGBDRP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CCCCC[NH+]1CCCC1 ZINC000293140929 433629813 /nfs/dbraw/zinc/62/98/13/433629813.db2.gz UEXBCWHOKBCHST-CSKARUKUSA-N 2 0 317.433 3.464 20 5 DGBDRP C[NH+](C)C1CCC([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000421872415 433786951 /nfs/dbraw/zinc/78/69/51/433786951.db2.gz GUDFHTUWCHIMIR-JTTJXQCZSA-N 2 0 317.433 3.435 20 5 DGBDRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284182746 433854874 /nfs/dbraw/zinc/85/48/74/433854874.db2.gz RCUXYNALHSWIMZ-UONOGXRCSA-N 2 0 322.453 3.338 20 5 DGBDRP CCC([NH3+])(CC)C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414812817 433855392 /nfs/dbraw/zinc/85/53/92/433855392.db2.gz RXICCJOOQJQHQK-ZBFHGGJFSA-N 2 0 319.449 3.413 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000344792499 433884546 /nfs/dbraw/zinc/88/45/46/433884546.db2.gz NAMUWOIUEYAAMT-IHWMJMDHSA-N 2 0 315.417 3.072 20 5 DGBDRP C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[NH2+]1 ZINC000422918011 434108817 /nfs/dbraw/zinc/10/88/17/434108817.db2.gz HCNOSKFDVZHYGN-RHSMWYFYSA-N 2 0 305.422 3.038 20 5 DGBDRP Cc1cc(N[C@@H]2CC[N@H+](C)[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000322737228 434264173 /nfs/dbraw/zinc/26/41/73/434264173.db2.gz XKBMCBZBYZBBSM-QWHCGFSZSA-N 2 0 314.389 3.346 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000423279587 434336093 /nfs/dbraw/zinc/33/60/93/434336093.db2.gz ROGFCCZFMWFMSM-NWANDNLSSA-N 2 0 321.421 3.162 20 5 DGBDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000423290789 434344218 /nfs/dbraw/zinc/34/42/18/434344218.db2.gz FLWDLGUMRNKJCW-UONOGXRCSA-N 2 0 313.401 3.335 20 5 DGBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417331973 434358323 /nfs/dbraw/zinc/35/83/23/434358323.db2.gz WSFYCZAKVHKGCX-KSSFIOAISA-N 2 0 317.433 3.294 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC000423380720 434392498 /nfs/dbraw/zinc/39/24/98/434392498.db2.gz NUMKHPNIYKFYIM-MJBXVCDLSA-N 2 0 323.462 3.196 20 5 DGBDRP C[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423471997 434440572 /nfs/dbraw/zinc/44/05/72/434440572.db2.gz ZZOUYCFFUIAGCT-RDTXWAMCSA-N 2 0 313.401 3.401 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@H]2CC[C@@H](C[NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000423514480 434468812 /nfs/dbraw/zinc/46/88/12/434468812.db2.gz SGGWCYZEVHZDKA-WQGACYEGSA-N 2 0 303.406 3.034 20 5 DGBDRP CC[N@@H+]1CC[C@@H](N(C)Cc2cccc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000354219260 434673249 /nfs/dbraw/zinc/67/32/49/434673249.db2.gz DJBYXVRCGKFCQT-XJKSGUPXSA-N 2 0 305.422 3.208 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459777183 434716280 /nfs/dbraw/zinc/71/62/80/434716280.db2.gz KGDGDXQBKDZCOM-HOTGVXAUSA-N 2 0 319.449 3.237 20 5 DGBDRP C[N@@H+]1CCC[C@@H]2CN(Cc3c(Cl)cccc3[N+](=O)[O-])CC[C@H]21 ZINC000493363791 435157336 /nfs/dbraw/zinc/15/73/36/435157336.db2.gz NKUJGQYPMXWKQL-IUODEOHRSA-N 2 0 323.824 3.164 20 5 DGBDRP CC(C)[NH2+]CCC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000568381418 435429439 /nfs/dbraw/zinc/42/94/39/435429439.db2.gz LBVJATLKYWNPSO-DOTOQJQBSA-N 2 0 319.449 3.284 20 5 DGBDRP CC[N@@H+]1CC[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000539089490 435537296 /nfs/dbraw/zinc/53/72/96/435537296.db2.gz SLRUGJHDBHQZEF-YJBOKZPZSA-N 2 0 319.449 3.237 20 5 DGBDRP CCC[NH+]1CCC([NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897463913 619130620 /nfs/dbraw/zinc/13/06/20/619130620.db2.gz CGGDOIVDNFDVCW-AWEZNQCLSA-N 2 0 305.422 3.162 20 5 DGBDRP CC(C)[NH+]1CCC([NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897463944 619130656 /nfs/dbraw/zinc/13/06/56/619130656.db2.gz CZCSFGDKJWTEGW-CQSZACIVSA-N 2 0 305.422 3.161 20 5 DGBDRP COc1cc([C@@H](C)[NH2+]CCCC[N@H+](C)C2CC2)cc([N+](=O)[O-])c1 ZINC000903182545 619731637 /nfs/dbraw/zinc/73/16/37/619731637.db2.gz DMZJJTGFMVHGGW-CYBMUJFWSA-N 2 0 321.421 3.128 20 5 DGBDRP C[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866518274 622131266 /nfs/dbraw/zinc/13/12/66/622131266.db2.gz WQKAJVBFRJMCQB-RFSCMCKOSA-N 2 0 320.437 3.091 20 5 DGBDRP C[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866518273 622131429 /nfs/dbraw/zinc/13/14/29/622131429.db2.gz WQKAJVBFRJMCQB-MKQDKFQKSA-N 2 0 320.437 3.091 20 5 DGBDRP C[NH+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000783527182 624362212 /nfs/dbraw/zinc/36/22/12/624362212.db2.gz XVEZDABVWWBANL-UHFFFAOYSA-N 2 0 311.813 3.022 20 5 DGBDRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000886543271 627159864 /nfs/dbraw/zinc/15/98/64/627159864.db2.gz MNFZUDBQIQQHPX-UHFFFAOYSA-N 2 0 317.433 3.482 20 5 DGBDRP CC(C)CC[NH+]1CCC(NCc2ccccc2[N+](=O)[O-])CC1 ZINC000925310600 627729114 /nfs/dbraw/zinc/72/91/14/627729114.db2.gz NMDMLYSYIZRDPS-UHFFFAOYSA-N 2 0 305.422 3.195 20 5 DGBDRP Cc1c(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000925659009 627771855 /nfs/dbraw/zinc/77/18/55/627771855.db2.gz RUVCIUBAVPQZES-DLBZAZTESA-N 2 0 317.433 3.161 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000925842435 627804342 /nfs/dbraw/zinc/80/43/42/627804342.db2.gz JRLZEWFPPXMOLE-KBRIMQKVSA-N 2 0 303.406 3.086 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1[N+](=O)[O-] ZINC000817947091 627970750 /nfs/dbraw/zinc/97/07/50/627970750.db2.gz JWQAQRVLBCOWPD-AWEZNQCLSA-N 2 0 313.401 3.255 20 5 DGBDRP [NH3+]CCc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000841034059 630399279 /nfs/dbraw/zinc/39/92/79/630399279.db2.gz VYVGXPGCWRGQNE-UHFFFAOYSA-N 2 0 319.792 3.039 20 5 DGBDRP [NH3+]CCCCCC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000843130093 630617492 /nfs/dbraw/zinc/61/74/92/630617492.db2.gz WUBHFJBUXQYHQW-DOTOQJQBSA-N 2 0 319.449 3.415 20 5 DGBDRP Cc1cc(N[C@@H](C)[C@H]2CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261845798 657133019 /nfs/dbraw/zinc/13/30/19/657133019.db2.gz JAIRYLZFCABPNM-STQMWFEESA-N 2 0 314.389 3.251 20 5 DGBDRP Cc1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)cc1[N+](=O)[O-] ZINC001352111435 1180297420 /nfs/dbraw/zinc/29/74/20/1180297420.db2.gz GIQWYUZLZPHGFK-BBWFWOEESA-N 2 0 317.433 3.065 20 5 DGBDRP Cc1ccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)cc1[N+](=O)[O-] ZINC001352111437 1180298090 /nfs/dbraw/zinc/29/80/90/1180298090.db2.gz GIQWYUZLZPHGFK-GVDBMIGSSA-N 2 0 317.433 3.065 20 5 DGBDRP C[C@H](C[NH+](C)C)[C@@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001183065895 1083873164 /nfs/dbraw/zinc/87/31/64/1083873164.db2.gz RDVOLVZAVZIKIE-QAPCUYQASA-N 2 0 319.449 3.190 20 5 DGBDRP C[C@H](C[N+](C)(C)C)OC[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001224826916 1096295207 /nfs/dbraw/zinc/29/52/07/1096295207.db2.gz STRKTNGDXSPNHC-MJGOQNOKSA-N 2 0 305.486 3.010 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCCCCCC[NH3+] ZINC001246082858 1104375970 /nfs/dbraw/zinc/37/59/70/1104375970.db2.gz YVLJZKZLFWSLCZ-HNNXBMFYSA-N 2 0 307.438 3.415 20 5 DGBDRP CC(C)[NH+]1CCC(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254534944 1106098078 /nfs/dbraw/zinc/09/80/78/1106098078.db2.gz FHHHWBBPSUZQDI-OAHLLOKOSA-N 2 0 319.449 3.236 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423244947 529534299 /nfs/dbraw/zinc/53/42/99/529534299.db2.gz ICBRWQAGGWQCGV-KGLIPLIRSA-N 2 0 323.462 3.055 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414908268 236941124 /nfs/dbraw/zinc/94/11/24/236941124.db2.gz RLZNYZIDBDKXNV-DJIMGWMZSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000415010788 237001304 /nfs/dbraw/zinc/00/13/04/237001304.db2.gz GTEAHFHRENJGJG-ZDUSSCGKSA-N 2 0 317.389 3.462 20 5 DGBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000415042855 237027212 /nfs/dbraw/zinc/02/72/12/237027212.db2.gz RIOOQNYKRGMOHD-OLZOCXBDSA-N 2 0 315.373 3.072 20 5 DGBDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000449130737 240030470 /nfs/dbraw/zinc/03/04/70/240030470.db2.gz HOWRWEOZUUSZKD-CVEARBPZSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000449204130 240067010 /nfs/dbraw/zinc/06/70/10/240067010.db2.gz MEMHJPUNGQDJND-HPUBIQBYSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000449243820 240087418 /nfs/dbraw/zinc/08/74/18/240087418.db2.gz NQCYQEOEQXPFDO-HNNXBMFYSA-N 2 0 319.449 3.237 20 5 DGBDRP O=[N+]([O-])c1ccc(CC[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000123281880 285111243 /nfs/dbraw/zinc/11/12/43/285111243.db2.gz MXYPPMHRWRHNGW-UHFFFAOYSA-N 2 0 317.433 3.134 20 5 DGBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000595900366 400290480 /nfs/dbraw/zinc/29/04/80/400290480.db2.gz DHBBOCMLZPQGCV-WMLDXEAASA-N 2 0 317.433 3.367 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000595900989 400290882 /nfs/dbraw/zinc/29/08/82/400290882.db2.gz RGVKHGGGHGEHDN-ZBFHGGJFSA-N 2 0 317.433 3.367 20 5 DGBDRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000602575627 400501745 /nfs/dbraw/zinc/50/17/45/400501745.db2.gz TWFGCRRXQIXNCQ-KRWDZBQOSA-N 2 0 319.449 3.095 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000591282647 400506521 /nfs/dbraw/zinc/50/65/21/400506521.db2.gz JURCBXJFUKOCHM-HOCLYGCPSA-N 2 0 317.433 3.180 20 5 DGBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000596653816 400473606 /nfs/dbraw/zinc/47/36/06/400473606.db2.gz LSFHRKKCTGYBKT-HZPDHXFCSA-N 2 0 305.422 3.280 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@H]2CC23CC[NH2+]CC3)c2cc([N+](=O)[O-])ccc21 ZINC000591581816 400543141 /nfs/dbraw/zinc/54/31/41/400543141.db2.gz WUCWPSFBCJBZMS-HOTGVXAUSA-N 2 0 315.417 3.049 20 5 DGBDRP CC[NH+](CC)CC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000047973715 400637252 /nfs/dbraw/zinc/63/72/52/400637252.db2.gz OINWLYYSJHDMHK-UHFFFAOYSA-N 2 0 305.422 3.149 20 5 DGBDRP Cc1c(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000592492864 400658318 /nfs/dbraw/zinc/65/83/18/400658318.db2.gz FCQGMTXYBLWDQK-DOTOQJQBSA-N 2 0 317.433 3.115 20 5 DGBDRP C[NH+](C)C1(CNc2ccc3cnccc3c2[N+](=O)[O-])CCC1 ZINC000599073733 400952008 /nfs/dbraw/zinc/95/20/08/400952008.db2.gz QDOSGBHPVGCZMR-UHFFFAOYSA-N 2 0 300.362 3.039 20 5 DGBDRP Cc1cc(NC[C@H]2CCC[N@@H+](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302196063 230154692 /nfs/dbraw/zinc/15/46/92/230154692.db2.gz SRVMAGFKSYCHSB-CYBMUJFWSA-N 2 0 314.389 3.205 20 5 DGBDRP Cc1nccn1CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000346275367 264000709 /nfs/dbraw/zinc/00/07/09/264000709.db2.gz JTDHLSUEHOSCNK-UHFFFAOYSA-N 2 0 302.378 3.010 20 5 DGBDRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346655332 264073550 /nfs/dbraw/zinc/07/35/50/264073550.db2.gz FZHZFZKHIAWYTO-QWHCGFSZSA-N 2 0 315.373 3.024 20 5 DGBDRP O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000347168298 264169147 /nfs/dbraw/zinc/16/91/47/264169147.db2.gz MINSGPNPQQKNTI-YXMMZVCTSA-N 2 0 315.417 3.072 20 5 DGBDRP CC1(C)C[C@H]([NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000423478147 276148682 /nfs/dbraw/zinc/14/86/82/276148682.db2.gz TXDYPIXJJAJXTD-AHIWAGSCSA-N 2 0 317.433 3.424 20 5 DGBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417331977 276221717 /nfs/dbraw/zinc/22/17/17/276221717.db2.gz WSFYCZAKVHKGCX-RDTXWAMCSA-N 2 0 317.433 3.294 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000414812959 278037574 /nfs/dbraw/zinc/03/75/74/278037574.db2.gz XUCRWNYVNXZMSZ-GOEBONIOSA-N 2 0 305.422 3.325 20 5 DGBDRP C[NH+]1CCC(C)(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000227329779 432711168 /nfs/dbraw/zinc/71/11/68/432711168.db2.gz UWRCMNBNFFVRBG-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000420314454 433160196 /nfs/dbraw/zinc/16/01/96/433160196.db2.gz KXPMRBPXBVTJOE-ZBFHGGJFSA-N 2 0 317.433 3.286 20 5 DGBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CC[NH2+]CC3)s2)cc1 ZINC000414781305 433831324 /nfs/dbraw/zinc/83/13/24/433831324.db2.gz CEYWRADELSOPMC-UHFFFAOYSA-N 2 0 317.414 3.165 20 5 DGBDRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414884771 433900837 /nfs/dbraw/zinc/90/08/37/433900837.db2.gz BEOJEQOQDMGOBQ-LLVKDONJSA-N 2 0 305.403 3.150 20 5 DGBDRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000414932218 433921834 /nfs/dbraw/zinc/92/18/34/433921834.db2.gz VNTYMHFAJNYSHQ-MXASKKJJSA-N 2 0 317.433 3.166 20 5 DGBDRP CCC[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423257823 434317175 /nfs/dbraw/zinc/31/71/75/434317175.db2.gz KZAVLTXCEHRWEY-WMLDXEAASA-N 2 0 305.422 3.415 20 5 DGBDRP CCC[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423257822 434317549 /nfs/dbraw/zinc/31/75/49/434317549.db2.gz KZAVLTXCEHRWEY-RHSMWYFYSA-N 2 0 305.422 3.415 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+]CC2(C)CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000423339534 434372337 /nfs/dbraw/zinc/37/23/37/434372337.db2.gz VHCZYSMYYJLNBD-ZDUSSCGKSA-N 2 0 321.421 3.034 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000423479241 434445786 /nfs/dbraw/zinc/44/57/86/434445786.db2.gz UUCOEOJGIMTAGP-GUTXKFCHSA-N 2 0 321.421 3.162 20 5 DGBDRP CC[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000423422401 434414290 /nfs/dbraw/zinc/41/42/90/434414290.db2.gz LAZYQJAKWUYJEX-CKEIUWERSA-N 2 0 305.422 3.401 20 5 DGBDRP Cc1ccc([C@@H](C)NCC[C@@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000538278051 435489520 /nfs/dbraw/zinc/48/95/20/435489520.db2.gz JGEWMASVDSHLAB-ZBFHGGJFSA-N 2 0 305.422 3.428 20 5 DGBDRP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000566473733 315350717 /nfs/dbraw/zinc/35/07/17/315350717.db2.gz CNAHUVBJSNUBRN-QGZVFWFLSA-N 2 0 315.417 3.046 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000574899338 316013619 /nfs/dbraw/zinc/01/36/19/316013619.db2.gz HPTAYGKZNKSGQH-AWEZNQCLSA-N 2 0 305.422 3.428 20 5 DGBDRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000415018101 533873405 /nfs/dbraw/zinc/87/34/05/533873405.db2.gz GJLGRHOFMOLDOU-FMKPAKJESA-N 2 0 305.422 3.023 20 5 DGBDRP [NH3+]C[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435390399 534691375 /nfs/dbraw/zinc/69/13/75/534691375.db2.gz OYYGKZIBHLXSCZ-GFCCVEGCSA-N 2 0 317.414 3.104 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)cc1[N+](=O)[O-] ZINC000423491514 528594826 /nfs/dbraw/zinc/59/48/26/528594826.db2.gz ZHLBOEFPHCZYBS-HIFRSBDPSA-N 2 0 321.421 3.176 20 5 DGBDRP [NH3+]CCc1ccc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000841032760 619166950 /nfs/dbraw/zinc/16/69/50/619166950.db2.gz WZLRUTDXXOHHBY-UHFFFAOYSA-N 2 0 319.792 3.039 20 5 DGBDRP C[C@@H](C[NH2+][C@@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C)c1ccccc1[N+](=O)[O-] ZINC000902432712 619634970 /nfs/dbraw/zinc/63/49/70/619634970.db2.gz WTLAEPDRIMNFAE-JSQNDZKTSA-N 2 0 317.433 3.065 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CCCN2CCCC[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000903245470 619743651 /nfs/dbraw/zinc/74/36/51/619743651.db2.gz MIUIXSIOAVFBHA-KYJSFNMBSA-N 2 0 317.433 3.305 20 5 DGBDRP [NH3+]CC1([C@@H]2CCCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)CCC1 ZINC000903814179 619814499 /nfs/dbraw/zinc/81/44/99/619814499.db2.gz LAEOLIMKJJAIEL-INIZCTEOSA-N 2 0 303.406 3.078 20 5 DGBDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000839180083 621343434 /nfs/dbraw/zinc/34/34/34/621343434.db2.gz CFKOWEOHYYOZON-GFCCVEGCSA-N 2 0 311.813 3.070 20 5 DGBDRP CCC[NH+]1CCC(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000873042381 623023962 /nfs/dbraw/zinc/02/39/62/623023962.db2.gz GKELWSKIHKGECL-UHFFFAOYSA-N 2 0 305.422 3.115 20 5 DGBDRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1[N+](=O)[O-] ZINC000873249917 623091007 /nfs/dbraw/zinc/09/10/07/623091007.db2.gz DFBLJHWBJURRPY-YESZJQIVSA-N 2 0 317.433 3.304 20 5 DGBDRP C[N@H+](CCCC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000835062492 629841500 /nfs/dbraw/zinc/84/15/00/629841500.db2.gz OXFXOPYVTSBXBM-UHFFFAOYSA-N 2 0 311.813 3.212 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc1Cl ZINC000843124847 630616485 /nfs/dbraw/zinc/61/64/85/630616485.db2.gz JGVOZCFRLPVTBF-KBPBESRZSA-N 2 0 323.824 3.070 20 5 DGBDRP [NH3+]C[C@@H]1CCCC12CC[NH+](Cc1c(F)cccc1[N+](=O)[O-])CC2 ZINC001580260313 1192017033 /nfs/dbraw/zinc/01/70/33/1192017033.db2.gz NHRCFMUAZCNFBH-ZDUSSCGKSA-N 2 0 321.396 3.075 20 5 DGBDRP C[C@]1([NH3+])CCC[N@H+](Cc2ccc3ccc4cccnc4c3n2)CC1 ZINC001205281357 1091163536 /nfs/dbraw/zinc/16/35/36/1091163536.db2.gz SZLAANWWSYMQLR-FQEVSTJZSA-N 2 0 320.440 3.486 20 5 DGBDRP [NH3+][C@@H]1CC[N@H+](Cc2ccc3ccc4cccnc4c3n2)CC[C@@H]1F ZINC001206188212 1091526636 /nfs/dbraw/zinc/52/66/36/1091526636.db2.gz UUQGDYPODMOERF-DLBZAZTESA-N 2 0 324.403 3.044 20 5 DGBDRP [NH3+]CCCCCCCCCCC[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168985067 1092462860 /nfs/dbraw/zinc/46/28/60/1092462860.db2.gz CPYAOSKCTWZKQW-DLBZAZTESA-N 2 0 313.486 3.491 20 5 DGBDRP C[N+](C)(C)CCCO[C@H]1CC[N@H+](Cc2ccc(Cl)cc2)C1 ZINC001224621694 1096248407 /nfs/dbraw/zinc/24/84/07/1096248407.db2.gz ZNKRGKJWEXFJIU-KRWDZBQOSA-N 2 0 311.877 3.027 20 5 DGBDRP C[N+](C)(C)CCCO[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC001224621056 1096248762 /nfs/dbraw/zinc/24/87/62/1096248762.db2.gz JNQIJZZQABVNSN-VAMGGRTRSA-N 2 0 317.497 3.010 20 5 DGBDRP CC(C)[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[NH2+]CC1 ZINC001246581843 1104603627 /nfs/dbraw/zinc/60/36/27/1104603627.db2.gz BGHUUJSGXJGJRG-NVXWUHKLSA-N 2 0 319.449 3.378 20 5 DGBDRP CC(C)[NH+]1CCC(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254534943 1106097741 /nfs/dbraw/zinc/09/77/41/1106097741.db2.gz FHHHWBBPSUZQDI-HNNXBMFYSA-N 2 0 319.449 3.236 20 5 DGBDRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000437799232 283412731 /nfs/dbraw/zinc/41/27/31/283412731.db2.gz LITAYYSAKDHIBF-YJNKEBTESA-N 2 0 317.433 3.166 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000415025306 237016791 /nfs/dbraw/zinc/01/67/91/237016791.db2.gz PQEDLDKUEPUGFV-BZUAXINKSA-N 2 0 319.449 3.271 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000415042859 237027059 /nfs/dbraw/zinc/02/70/59/237027059.db2.gz RIOOQNYKRGMOHD-STQMWFEESA-N 2 0 315.373 3.072 20 5 DGBDRP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000193507156 201065748 /nfs/dbraw/zinc/06/57/48/201065748.db2.gz HAAIYCMPDPDLNL-SUMWQHHRSA-N 2 0 303.406 3.120 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000449138093 240035255 /nfs/dbraw/zinc/03/52/55/240035255.db2.gz AUACWUULSCOECB-WMLDXEAASA-N 2 0 321.465 3.482 20 5 DGBDRP CCC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000121212035 284191318 /nfs/dbraw/zinc/19/13/18/284191318.db2.gz IUWMMRAFSUEMDI-PBHICJAKSA-N 2 0 305.422 3.367 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000470169721 533407135 /nfs/dbraw/zinc/40/71/35/533407135.db2.gz IFJGDWHLZYVMCZ-OBHPCNEJSA-N 2 0 317.433 3.272 20 5 DGBDRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000595105031 400107595 /nfs/dbraw/zinc/10/75/95/400107595.db2.gz VRDRIPRPJFGLEJ-AWEZNQCLSA-N 2 0 317.433 3.367 20 5 DGBDRP C[NH+](C)CC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000611521955 400415197 /nfs/dbraw/zinc/41/51/97/400415197.db2.gz CYDDPPVAPLRMLT-INIZCTEOSA-N 2 0 307.438 3.093 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000602020527 400405564 /nfs/dbraw/zinc/40/55/64/400405564.db2.gz LHPKIZFKSJPLOZ-DZKIICNBSA-N 2 0 305.422 3.023 20 5 DGBDRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc([N+](=O)[O-])cc1 ZINC000602022258 400406646 /nfs/dbraw/zinc/40/66/46/400406646.db2.gz SNBSXVFSZHNFSB-CYBMUJFWSA-N 2 0 311.385 3.091 20 5 DGBDRP C[C@@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@H]1CC[NH3+] ZINC000593316288 400817477 /nfs/dbraw/zinc/81/74/77/400817477.db2.gz OROGWYVSHCXZBH-IRHPPKKSSA-N 2 0 303.406 3.057 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cc1[N+](=O)[O-] ZINC000593321016 400818340 /nfs/dbraw/zinc/81/83/40/400818340.db2.gz WMAKANFPKAGLEN-LBPRGKRZSA-N 2 0 317.364 3.352 20 5 DGBDRP C[N@@H+]1CC[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC000598965844 400915353 /nfs/dbraw/zinc/91/53/53/400915353.db2.gz NVDFVVQEPBAWNO-INIZCTEOSA-N 2 0 319.449 3.380 20 5 DGBDRP C[N@@H+]1CCCC[C@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599142300 400974418 /nfs/dbraw/zinc/97/44/18/400974418.db2.gz SVWQUNQMHVPXGX-CYBMUJFWSA-N 2 0 314.389 3.287 20 5 DGBDRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCCC1 ZINC000594738033 401166079 /nfs/dbraw/zinc/16/60/79/401166079.db2.gz ATGZTKQSGUJSJX-GOEBONIOSA-N 2 0 317.433 3.167 20 5 DGBDRP Cc1c(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000261812628 165752367 /nfs/dbraw/zinc/75/23/67/165752367.db2.gz GPGASGMXXKKPDE-BRWVUGGUSA-N 2 0 317.433 3.304 20 5 DGBDRP CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC[NH2+]CC1 ZINC000347106405 264157556 /nfs/dbraw/zinc/15/75/56/264157556.db2.gz LSHRXIJKLWIQEO-UHFFFAOYSA-N 2 0 315.373 3.039 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000192698705 274491157 /nfs/dbraw/zinc/49/11/57/274491157.db2.gz MVIXSWZQSGJTNX-RDTXWAMCSA-N 2 0 317.433 3.294 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000332026987 275868769 /nfs/dbraw/zinc/86/87/69/275868769.db2.gz RYRGOXCHQUGWRS-OZVIIMIRSA-N 2 0 303.406 3.177 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000414812958 276053514 /nfs/dbraw/zinc/05/35/14/276053514.db2.gz XUCRWNYVNXZMSZ-GDBMZVCRSA-N 2 0 305.422 3.325 20 5 DGBDRP C[NH+](C)CCCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000123330656 431861291 /nfs/dbraw/zinc/86/12/91/431861291.db2.gz BTVOUAREEJBRGF-UHFFFAOYSA-N 2 0 305.422 3.149 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]CCC2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000125351307 431921975 /nfs/dbraw/zinc/92/19/75/431921975.db2.gz IYQIGJXFSXBXQD-AWEZNQCLSA-N 2 0 305.422 3.286 20 5 DGBDRP CC[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000414188359 433450205 /nfs/dbraw/zinc/45/02/05/433450205.db2.gz QPAAMTNWANWQAR-RHSMWYFYSA-N 2 0 305.422 3.367 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000449063938 433718565 /nfs/dbraw/zinc/71/85/65/433718565.db2.gz RZZYNCDMMXLGKR-HOTGVXAUSA-N 2 0 319.449 3.380 20 5 DGBDRP C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[NH2+]1 ZINC000422918012 434109845 /nfs/dbraw/zinc/10/98/45/434109845.db2.gz HCNOSKFDVZHYGN-WMLDXEAASA-N 2 0 305.422 3.038 20 5 DGBDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000423084118 434206380 /nfs/dbraw/zinc/20/63/80/434206380.db2.gz HIZKHGPNBHBZSZ-JTQLQIEISA-N 2 0 319.327 3.221 20 5 DGBDRP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000322820728 434263535 /nfs/dbraw/zinc/26/35/35/434263535.db2.gz CEKNZHNLJBETCJ-BTFYYFJDSA-N 2 0 303.406 3.261 20 5 DGBDRP CSC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC[NH+](C)CC1 ZINC000353606943 434267943 /nfs/dbraw/zinc/26/79/43/434267943.db2.gz FQUPQZUIZHWWAR-CYBMUJFWSA-N 2 0 323.462 3.073 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]([NH3+])C(C)C ZINC000423279211 434334103 /nfs/dbraw/zinc/33/41/03/434334103.db2.gz RUCVKHSNOHUTAX-QWHCGFSZSA-N 2 0 311.451 3.038 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000423380717 434389428 /nfs/dbraw/zinc/38/94/28/434389428.db2.gz NUMKHPNIYKFYIM-MGPQQGTHSA-N 2 0 323.462 3.196 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000423376929 434389989 /nfs/dbraw/zinc/38/99/89/434389989.db2.gz JKHOSZSAXJREKB-MCIONIFRSA-N 2 0 323.462 3.325 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]([NH3+])C(C)C ZINC000423279209 434335737 /nfs/dbraw/zinc/33/57/37/434335737.db2.gz RUCVKHSNOHUTAX-CHWSQXEVSA-N 2 0 311.451 3.038 20 5 DGBDRP C[NH+](C)CCCC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417340391 434360922 /nfs/dbraw/zinc/36/09/22/434360922.db2.gz MFXZICQFLHEFMP-KRWDZBQOSA-N 2 0 305.422 3.294 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])cc1[N+](=O)[O-] ZINC000423418808 434417314 /nfs/dbraw/zinc/41/73/14/434417314.db2.gz AFUQGUIJNNKLIQ-CHWSQXEVSA-N 2 0 309.410 3.162 20 5 DGBDRP CCC[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423452623 434433565 /nfs/dbraw/zinc/43/35/65/434433565.db2.gz ZIMAKTJDVZCCSE-OKZBNKHCSA-N 2 0 317.433 3.414 20 5 DGBDRP CCC[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423572063 434490089 /nfs/dbraw/zinc/49/00/89/434490089.db2.gz YFNYVIQITCUUQE-KRWDZBQOSA-N 2 0 303.406 3.335 20 5 DGBDRP CC[N@@H+]1CC[C@H](N(C)Cc2cccc([N+](=O)[O-])c2C)C[C@H]1C ZINC000354219258 434674207 /nfs/dbraw/zinc/67/42/07/434674207.db2.gz DJBYXVRCGKFCQT-CJNGLKHVSA-N 2 0 305.422 3.208 20 5 DGBDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000459789226 434720917 /nfs/dbraw/zinc/72/09/17/434720917.db2.gz QNFHTMJZDSIAQY-LBPRGKRZSA-N 2 0 311.813 3.070 20 5 DGBDRP C[C@@H](CCN[C@H]1CCc2c1cccc2[N+](=O)[O-])[NH+]1CCCCC1 ZINC000576359694 316122125 /nfs/dbraw/zinc/12/21/25/316122125.db2.gz JUGWVVCOFXXTSV-YOEHRIQHSA-N 2 0 317.433 3.436 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000576742578 316162133 /nfs/dbraw/zinc/16/21/33/316162133.db2.gz VKUCKXQHLJBEFH-KAKTVLCNSA-N 2 0 317.433 3.318 20 5 DGBDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000581978658 324174544 /nfs/dbraw/zinc/17/45/44/324174544.db2.gz HRCPAXLMSABYDE-AWEZNQCLSA-N 2 0 305.422 3.286 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CCCN2CCCC[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000903245472 619743728 /nfs/dbraw/zinc/74/37/28/619743728.db2.gz MIUIXSIOAVFBHA-QGPMSJSTSA-N 2 0 317.433 3.305 20 5 DGBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000903789102 619813794 /nfs/dbraw/zinc/81/37/94/619813794.db2.gz OFMHUPJQRYAVNP-CYBMUJFWSA-N 2 0 305.422 3.353 20 5 DGBDRP CC(C)c1ccc(C[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)cc1[N+](=O)[O-] ZINC000903973457 619847460 /nfs/dbraw/zinc/84/74/60/619847460.db2.gz DRMCJFSXTMGTEX-UKRRQHHQSA-N 2 0 305.422 3.053 20 5 DGBDRP Cc1c(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cccc1[N+](=O)[O-] ZINC000757645072 621730759 /nfs/dbraw/zinc/73/07/59/621730759.db2.gz YUQMELIDHKHGJW-KRWDZBQOSA-N 2 0 317.433 3.067 20 5 DGBDRP CCC[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866218809 622068288 /nfs/dbraw/zinc/06/82/88/622068288.db2.gz YLZBPAJYVNKEMW-ZDUSSCGKSA-N 2 0 323.412 3.129 20 5 DGBDRP C[NH+](C)C1(C)CCC([NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000866518041 622131578 /nfs/dbraw/zinc/13/15/78/622131578.db2.gz RMZBOJPJTSAZQF-CRPOECCBSA-N 2 0 317.433 3.435 20 5 DGBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000872033779 622764757 /nfs/dbraw/zinc/76/47/57/622764757.db2.gz JIRSKBKULCIGJB-GFCCVEGCSA-N 2 0 323.462 3.309 20 5 DGBDRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872060165 622782322 /nfs/dbraw/zinc/78/23/22/622782322.db2.gz NGSIRHCBUZWZIJ-GFCCVEGCSA-N 2 0 309.385 3.116 20 5 DGBDRP C[C@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC[NH2+]CC1 ZINC000873272644 623100309 /nfs/dbraw/zinc/10/03/09/623100309.db2.gz VSLYIXJKAJZULF-YVEFUNNKSA-N 2 0 317.433 3.295 20 5 DGBDRP C[NH+]1CCC2(CC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)CC1 ZINC000878864525 624375602 /nfs/dbraw/zinc/37/56/02/624375602.db2.gz FOPPQBIWJWGUEX-UHFFFAOYSA-N 2 0 323.824 3.166 20 5 DGBDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc([N+](=O)[O-])c(F)c1)CC2 ZINC000879250175 624464051 /nfs/dbraw/zinc/46/40/51/624464051.db2.gz OVSKAYACGHRQNR-UHFFFAOYSA-N 2 0 321.396 3.042 20 5 DGBDRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C[C@H]2C2CCCC2)cc1[N+](=O)[O-] ZINC000925733719 627784322 /nfs/dbraw/zinc/78/43/22/627784322.db2.gz LULIQTVBUBFVKE-DLBZAZTESA-N 2 0 317.433 3.161 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925844236 627804965 /nfs/dbraw/zinc/80/49/65/627804965.db2.gz RVLGDTFUFUZYIV-BMGDILEWSA-N 2 0 317.433 3.038 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c1 ZINC000843125825 630616393 /nfs/dbraw/zinc/61/63/93/630616393.db2.gz JHOFBBMNXKYEDL-QWHCGFSZSA-N 2 0 323.824 3.070 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000261996594 657276292 /nfs/dbraw/zinc/27/62/92/657276292.db2.gz UPBDXRMJRFINNP-BBRMVZONSA-N 2 0 303.406 3.120 20 5 DGBDRP [NH3+]C[C@H]1CCCC12CC[NH+](Cc1c(F)cccc1[N+](=O)[O-])CC2 ZINC001580260312 1192017262 /nfs/dbraw/zinc/01/72/62/1192017262.db2.gz NHRCFMUAZCNFBH-CYBMUJFWSA-N 2 0 321.396 3.075 20 5 DGBDRP Cc1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)cc1[N+](=O)[O-] ZINC001352111439 1180297733 /nfs/dbraw/zinc/29/77/33/1180297733.db2.gz GIQWYUZLZPHGFK-ULQDDVLXSA-N 2 0 317.433 3.065 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1CN1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC001658192966 1196223198 /nfs/dbraw/zinc/22/31/98/1196223198.db2.gz IATYEFVNZRNPGI-GOSISDBHSA-N 2 0 317.433 3.129 20 5 DGBDRP C[C@H](CC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])[NH+](C)C ZINC001658642128 1196283262 /nfs/dbraw/zinc/28/32/62/1196283262.db2.gz PWTYLCKZSXRBFJ-VYDXJSESSA-N 2 0 319.449 3.236 20 5 DGBDRP CC[NH+]1CCC(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC001660095937 1196445309 /nfs/dbraw/zinc/44/53/09/1196445309.db2.gz BFEIGTLWVZRINB-CQSZACIVSA-N 2 0 305.422 3.020 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168998299 1092479667 /nfs/dbraw/zinc/47/96/67/1092479667.db2.gz LBXNWYXCEWCRMJ-BRSBDYLESA-N 2 0 323.481 3.194 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H](C)[NH2+]C ZINC001326034837 1103188713 /nfs/dbraw/zinc/18/87/13/1103188713.db2.gz APCFVEHMRUAEQQ-QWHCGFSZSA-N 2 0 311.451 3.053 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246138334 1104400920 /nfs/dbraw/zinc/40/09/20/1104400920.db2.gz YOGQDCOXAQSNCI-GDBMZVCRSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246604616 1104619612 /nfs/dbraw/zinc/61/96/12/1104619612.db2.gz HEMIFNNKUBMUFM-QAPCUYQASA-N 2 0 317.433 3.134 20 5 DGBDRP [NH3+]CCC[N@H+]([C@@H]1Cc2ccc([N+](=O)[O-])cc2C1)C1CCCCC1 ZINC001254571671 1106106281 /nfs/dbraw/zinc/10/62/81/1106106281.db2.gz ADENEOGGXUMGOQ-GOSISDBHSA-N 2 0 317.433 3.046 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423244948 529418108 /nfs/dbraw/zinc/41/81/08/529418108.db2.gz ICBRWQAGGWQCGV-UONOGXRCSA-N 2 0 323.462 3.055 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000152427767 186071584 /nfs/dbraw/zinc/07/15/84/186071584.db2.gz CRBMGMQMYRQPCZ-KGLIPLIRSA-N 2 0 303.406 3.038 20 5 DGBDRP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000193507181 201066706 /nfs/dbraw/zinc/06/67/06/201066706.db2.gz HAAIYCMPDPDLNL-CXAGYDPISA-N 2 0 303.406 3.120 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000449282141 240109025 /nfs/dbraw/zinc/10/90/25/240109025.db2.gz FVSSQOFIRUWERO-OAHLLOKOSA-N 2 0 319.449 3.237 20 5 DGBDRP CC[C@@H]([NH2+]C[C@@H](C)C[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000171141311 432106493 /nfs/dbraw/zinc/10/64/93/432106493.db2.gz WMNQGWBTSAMJIQ-RHSMWYFYSA-N 2 0 305.422 3.367 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)cc1[N+](=O)[O-] ZINC000596654898 400473573 /nfs/dbraw/zinc/47/35/73/400473573.db2.gz RBONJCPYSJOFEG-TZMCWYRMSA-N 2 0 309.410 3.018 20 5 DGBDRP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cccc([N+](=O)[O-])c1 ZINC000593318582 400817457 /nfs/dbraw/zinc/81/74/57/400817457.db2.gz FDJQBOBXHATMIE-QGZVFWFLSA-N 2 0 317.364 3.434 20 5 DGBDRP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599072065 400950227 /nfs/dbraw/zinc/95/02/27/400950227.db2.gz XHNSTWHFDYCBIG-WMLDXEAASA-N 2 0 305.422 3.367 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+][C@H](C)C2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000090217592 401263334 /nfs/dbraw/zinc/26/33/34/401263334.db2.gz WTPMAQQCQITYID-ZIAGYGMSSA-N 2 0 305.422 3.284 20 5 DGBDRP Cc1cc(NCC2CC[NH+](C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302091668 230090022 /nfs/dbraw/zinc/09/00/22/230090022.db2.gz PUYVWICFSCKZRI-UHFFFAOYSA-N 2 0 314.389 3.205 20 5 DGBDRP Cc1cc(NCC[NH+]2CCCCC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302138048 230116153 /nfs/dbraw/zinc/11/61/53/230116153.db2.gz DPVBAIVGOVTXMC-UHFFFAOYSA-N 2 0 314.389 3.349 20 5 DGBDRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000346678640 264078792 /nfs/dbraw/zinc/07/87/92/264078792.db2.gz MKOAXQBODSROGM-OLZOCXBDSA-N 2 0 315.373 3.024 20 5 DGBDRP CCC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CC[NH2+]CC1 ZINC000347017045 264141167 /nfs/dbraw/zinc/14/11/67/264141167.db2.gz DGPKIYOTFJMDON-ALCCZGGFSA-N 2 0 303.406 3.072 20 5 DGBDRP [NH3+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000347113228 264158997 /nfs/dbraw/zinc/15/89/97/264158997.db2.gz QZPMPJGLYFBQCK-ZDUSSCGKSA-N 2 0 315.373 3.026 20 5 DGBDRP CSC1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC[NH+](C)CC1 ZINC000353630312 265492969 /nfs/dbraw/zinc/49/29/69/265492969.db2.gz MOSFTARWXKMTKM-ZDUSSCGKSA-N 2 0 323.462 3.073 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000423514477 273589589 /nfs/dbraw/zinc/58/95/89/273589589.db2.gz SGGWCYZEVHZDKA-HSMVNMDESA-N 2 0 303.406 3.034 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000449091277 274231401 /nfs/dbraw/zinc/23/14/01/274231401.db2.gz POVQOOQRWSLEAG-AWEZNQCLSA-N 2 0 319.449 3.378 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCC2 ZINC000423383699 275037964 /nfs/dbraw/zinc/03/79/64/275037964.db2.gz KPYDXLSFJMNZLZ-IBGZPJMESA-N 2 0 323.396 3.365 20 5 DGBDRP CC(C)c1ccc(C[NH+]2CCC3(CC[NH2+]C3)CC2)cc1[N+](=O)[O-] ZINC000430938322 276052646 /nfs/dbraw/zinc/05/26/46/276052646.db2.gz BBPPPRHIHWZRCC-UHFFFAOYSA-N 2 0 317.433 3.294 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH+](C)C ZINC000271106619 432330380 /nfs/dbraw/zinc/33/03/80/432330380.db2.gz GHGORYSYAOAHJE-CYBMUJFWSA-N 2 0 311.451 3.007 20 5 DGBDRP Cc1nccn1C[C@H](C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000178701358 432768096 /nfs/dbraw/zinc/76/80/96/432768096.db2.gz LSPCPDLRUGYTAX-TZMCWYRMSA-N 2 0 316.405 3.395 20 5 DGBDRP Cc1ccc(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1[N+](=O)[O-] ZINC000290525304 433078549 /nfs/dbraw/zinc/07/85/49/433078549.db2.gz QGFFLMLQKRUYCE-KRWDZBQOSA-N 2 0 317.433 3.067 20 5 DGBDRP CC[NH+](CC)CCCCNc1nccc2ccc([N+](=O)[O-])cc21 ZINC000413102188 433259634 /nfs/dbraw/zinc/25/96/34/433259634.db2.gz VFQILBGNURMWQM-UHFFFAOYSA-N 2 0 316.405 3.677 20 5 DGBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000414359602 433567711 /nfs/dbraw/zinc/56/77/11/433567711.db2.gz OULIKTREHWIYIA-WMZOPIPTSA-N 2 0 317.433 3.134 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000449059921 433714995 /nfs/dbraw/zinc/71/49/95/433714995.db2.gz DDUBCZSXFGMUDV-INIZCTEOSA-N 2 0 319.449 3.237 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000449063937 433718809 /nfs/dbraw/zinc/71/88/09/433718809.db2.gz RZZYNCDMMXLGKR-CVEARBPZSA-N 2 0 319.449 3.380 20 5 DGBDRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414888865 433902831 /nfs/dbraw/zinc/90/28/31/433902831.db2.gz FRJKOLGFOPYKRL-JTQLQIEISA-N 2 0 323.780 3.335 20 5 DGBDRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414841380 433879976 /nfs/dbraw/zinc/87/99/76/433879976.db2.gz NUDMKBGDCLPALT-LBPRGKRZSA-N 2 0 319.430 3.268 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423213890 434291607 /nfs/dbraw/zinc/29/16/07/434291607.db2.gz KMGDNEBAAAPCHI-KCQAQPDRSA-N 2 0 321.421 3.032 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000423479243 434444986 /nfs/dbraw/zinc/44/49/86/434444986.db2.gz UUCOEOJGIMTAGP-KCQAQPDRSA-N 2 0 321.421 3.162 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CCC[NH3+] ZINC000423466221 434435359 /nfs/dbraw/zinc/43/53/59/434435359.db2.gz WVHGLXWCTJGOSJ-QWHCGFSZSA-N 2 0 311.451 3.183 20 5 DGBDRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423039438 295332833 /nfs/dbraw/zinc/33/28/33/295332833.db2.gz FLJUYYQRFJZIPK-KBPBESRZSA-N 2 0 311.813 3.040 20 5 DGBDRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000536867844 435416995 /nfs/dbraw/zinc/41/69/95/435416995.db2.gz FJIOSDRFIUNMBH-RVKKMQEKSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000564973730 315216167 /nfs/dbraw/zinc/21/61/67/315216167.db2.gz PUBLCMIQVWXOIN-NWDGAFQWSA-N 2 0 303.362 3.070 20 5 DGBDRP C[C@@H](CCN[C@@H]1CCc2c1cccc2[N+](=O)[O-])[NH+]1CCCCC1 ZINC000576359693 316122100 /nfs/dbraw/zinc/12/21/00/316122100.db2.gz JUGWVVCOFXXTSV-WMLDXEAASA-N 2 0 317.433 3.436 20 5 DGBDRP C[NH+](C)C1CCC([NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000583092839 324312762 /nfs/dbraw/zinc/31/27/62/324312762.db2.gz ALIIVCITVGCGCK-ZUEPYMLJSA-N 2 0 303.406 3.045 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000423479242 528607157 /nfs/dbraw/zinc/60/71/57/528607157.db2.gz UUCOEOJGIMTAGP-GZBFAFLISA-N 2 0 321.421 3.162 20 5 DGBDRP O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000894066456 618703319 /nfs/dbraw/zinc/70/33/19/618703319.db2.gz BYBOKJMIFJNSIP-UHFFFAOYSA-N 2 0 323.824 3.212 20 5 DGBDRP C[C@@H](C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000897461112 619130237 /nfs/dbraw/zinc/13/02/37/619130237.db2.gz LKLAAONDUYWXBY-KBPBESRZSA-N 2 0 305.422 3.161 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000897461115 619130245 /nfs/dbraw/zinc/13/02/45/619130245.db2.gz LKLAAONDUYWXBY-ZIAGYGMSSA-N 2 0 305.422 3.161 20 5 DGBDRP CCC[NH+]1CCC([NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897463914 619130588 /nfs/dbraw/zinc/13/05/88/619130588.db2.gz CGGDOIVDNFDVCW-CQSZACIVSA-N 2 0 305.422 3.162 20 5 DGBDRP CC(C)([NH3+])CC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000903940005 619841155 /nfs/dbraw/zinc/84/11/55/619841155.db2.gz SRVOBHKBKYNPOK-UKRRQHHQSA-N 2 0 305.422 3.023 20 5 DGBDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000839182585 621344063 /nfs/dbraw/zinc/34/40/63/621344063.db2.gz NUGFPGFPOBGWPU-GFCCVEGCSA-N 2 0 311.813 3.070 20 5 DGBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000866282712 622084745 /nfs/dbraw/zinc/08/47/45/622084745.db2.gz PQYPIWNZIKKCBX-UHOFOFEASA-N 2 0 323.412 3.127 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000873096706 623035078 /nfs/dbraw/zinc/03/50/78/623035078.db2.gz VNIHIDWFPSDINX-UHFFFAOYSA-N 2 0 319.449 3.422 20 5 DGBDRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000873258636 623094739 /nfs/dbraw/zinc/09/47/39/623094739.db2.gz SYIKGZRGEGKIEF-OWQGQXMQSA-N 2 0 311.385 3.011 20 5 DGBDRP CC[NH+](CC)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000801510199 626406507 /nfs/dbraw/zinc/40/65/07/626406507.db2.gz INXIENJXCGIAJJ-UHFFFAOYSA-N 2 0 323.412 3.288 20 5 DGBDRP C[C@H](NCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815554794 627683982 /nfs/dbraw/zinc/68/39/82/627683982.db2.gz IZESTIDXCLBAJB-KBPBESRZSA-N 2 0 320.437 3.092 20 5 DGBDRP [NH3+]CCC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000925632106 627765697 /nfs/dbraw/zinc/76/56/97/627765697.db2.gz ZXGSJVHUWYTBNB-GOSISDBHSA-N 2 0 313.401 3.207 20 5 DGBDRP Cc1cc(N[C@H](C)[C@H]2CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261845783 655653978 /nfs/dbraw/zinc/65/39/78/655653978.db2.gz JAIRYLZFCABPNM-OLZOCXBDSA-N 2 0 314.389 3.251 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)c(Cl)c1 ZINC000261947882 657237289 /nfs/dbraw/zinc/23/72/89/657237289.db2.gz MOROEGJTLDIWQL-INIZCTEOSA-N 2 0 323.824 3.212 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)cc1Cl ZINC000261962665 657265393 /nfs/dbraw/zinc/26/53/93/657265393.db2.gz PKYRXXQHDIGNEG-OAHLLOKOSA-N 2 0 323.824 3.212 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000262134592 657393323 /nfs/dbraw/zinc/39/33/23/657393323.db2.gz YOHMGZGEIWQGOF-UHFFFAOYSA-N 2 0 317.433 3.294 20 5 DGBDRP Cc1ccc(C[NH+]2CCC3(CCC[C@H]3C[NH3+])CC2)cc1[N+](=O)[O-] ZINC001579692286 1191987244 /nfs/dbraw/zinc/98/72/44/1191987244.db2.gz XNDNFZWPZFOAON-INIZCTEOSA-N 2 0 317.433 3.244 20 5 DGBDRP Cc1c(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC001335584994 1178933857 /nfs/dbraw/zinc/93/38/57/1178933857.db2.gz ZMKWKKKEASCJLL-GVDBMIGSSA-N 2 0 317.433 3.065 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCCC[C@]2(C[NH3+])C1 ZINC001576315830 1191560469 /nfs/dbraw/zinc/56/04/69/1191560469.db2.gz MWJCPQVUPAKYSK-KEYYUXOJSA-N 2 0 303.406 3.107 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1NC[C@@H]1CCC[NH2+]C[C@@H]1C ZINC001162456339 1089741465 /nfs/dbraw/zinc/74/14/65/1089741465.db2.gz HWDJDUXFRFHXBP-IRXDYDNUSA-N 2 0 304.502 3.331 20 5 DGBDRP CCC[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001204421065 1090965518 /nfs/dbraw/zinc/96/55/18/1090965518.db2.gz BKNUPKIHILUWBI-UHFFFAOYSA-N 2 0 319.449 3.191 20 5 DGBDRP C[C@@H](CCNCc1ccc([N+](=O)[O-])cc1F)[NH+]1CCCCC1 ZINC001205390588 1091208916 /nfs/dbraw/zinc/20/89/16/1091208916.db2.gz BHPWJKSZNXPLMQ-ZDUSSCGKSA-N 2 0 309.385 3.088 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168998301 1092478479 /nfs/dbraw/zinc/47/84/79/1092478479.db2.gz LBXNWYXCEWCRMJ-XLAORIBOSA-N 2 0 323.481 3.194 20 5 DGBDRP CCC(CC)[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169000826 1092480265 /nfs/dbraw/zinc/48/02/65/1092480265.db2.gz YTZXZNVCXWKSHP-MUIFIZLQSA-N 2 0 311.470 3.192 20 5 DGBDRP [NH3+]C[C@H]1CCCC[N@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001206633116 1092765476 /nfs/dbraw/zinc/76/54/76/1092765476.db2.gz TVVKBDNGOWTWKB-OAHLLOKOSA-N 2 0 320.440 3.344 20 5 DGBDRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1OCC[N+](C)(C)C ZINC001224771287 1096282729 /nfs/dbraw/zinc/28/27/29/1096282729.db2.gz ILEDDAPFBUSQOZ-GOSISDBHSA-N 2 0 305.486 3.010 20 5 DGBDRP C[C@H](C[N+](C)(C)C)OC[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001224826915 1096295038 /nfs/dbraw/zinc/29/50/38/1096295038.db2.gz STRKTNGDXSPNHC-IEBWSBKVSA-N 2 0 305.486 3.010 20 5 DGBDRP CC[NH+](CC)CCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899261 1097267134 /nfs/dbraw/zinc/26/71/34/1097267134.db2.gz VVJSXGRWVWZJSZ-QGZVFWFLSA-N 2 0 319.449 3.164 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1cc(CC[NH3+])c2c[nH+]ccc21 ZINC001173221973 1097373200 /nfs/dbraw/zinc/37/32/00/1097373200.db2.gz RNNSYCIHAGNZQW-ZDUSSCGKSA-N 2 0 324.384 3.249 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC001173213929 1097381581 /nfs/dbraw/zinc/38/15/81/1097381581.db2.gz MDKGKPGNHPQGHT-MRXNPFEDSA-N 2 0 319.449 3.237 20 5 DGBDRP CC[C@@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC001178204624 1098745772 /nfs/dbraw/zinc/74/57/72/1098745772.db2.gz KUWSZCGKNSCPLJ-YQQAZPJKSA-N 2 0 303.406 3.262 20 5 DGBDRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC001325627235 1103085532 /nfs/dbraw/zinc/08/55/32/1103085532.db2.gz URGKJUIEKHSKNM-LBPRGKRZSA-N 2 0 319.430 3.411 20 5 DGBDRP O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001328411686 1103937270 /nfs/dbraw/zinc/93/72/70/1103937270.db2.gz HLIDGXQYIDZBPV-UTCJRWHESA-N 2 0 315.417 3.074 20 5 DGBDRP C[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423305295 237840325 /nfs/dbraw/zinc/84/03/25/237840325.db2.gz QLDYFIRKUVHKBF-NSHDSACASA-N 2 0 317.414 3.193 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000449089742 240012327 /nfs/dbraw/zinc/01/23/27/240012327.db2.gz LDXKKEVRNSQKOH-JKSUJKDBSA-N 2 0 319.449 3.237 20 5 DGBDRP Cc1c(C[NH+]2CCC(CCC[NH+](C)C)CC2)cccc1[N+](=O)[O-] ZINC000123129910 284232906 /nfs/dbraw/zinc/23/29/06/284232906.db2.gz YZDYXSDEJNRYDY-UHFFFAOYSA-N 2 0 319.449 3.457 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000125376286 284274707 /nfs/dbraw/zinc/27/47/07/284274707.db2.gz RSNPGEUHYGZITC-AWEZNQCLSA-N 2 0 305.422 3.286 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000470176144 533407824 /nfs/dbraw/zinc/40/78/24/533407824.db2.gz UVPVMDMGORHCIQ-RVDMUPIBSA-N 2 0 317.433 3.272 20 5 DGBDRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000415024555 533553594 /nfs/dbraw/zinc/55/35/94/533553594.db2.gz PAWLVSGVKJEEBD-LBPRGKRZSA-N 2 0 303.362 3.072 20 5 DGBDRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000595101419 400106930 /nfs/dbraw/zinc/10/69/30/400106930.db2.gz FLFCOYHRNOQILS-CQSZACIVSA-N 2 0 317.433 3.367 20 5 DGBDRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000589195032 400273243 /nfs/dbraw/zinc/27/32/43/400273243.db2.gz BZLDSUGYAGBBHO-JKSUJKDBSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595901498 400290947 /nfs/dbraw/zinc/29/09/47/400290947.db2.gz XKQKUYRQZXEQIP-PBHICJAKSA-N 2 0 317.433 3.367 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCC[NH2+]1 ZINC000591578079 400541596 /nfs/dbraw/zinc/54/15/96/400541596.db2.gz WFMMNBHJMVUHAO-KBPBESRZSA-N 2 0 323.462 3.197 20 5 DGBDRP C[C@H]1C[C@@H](Nc2ccc3cnccc3c2[N+](=O)[O-])CC[N@@H+]1C ZINC000599051690 400939291 /nfs/dbraw/zinc/93/92/91/400939291.db2.gz WAVUAUSDNUWFDH-AAEUAGOBSA-N 2 0 300.362 3.038 20 5 DGBDRP CC[NH+]1CCC(CC[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000594496884 401079897 /nfs/dbraw/zinc/07/98/97/401079897.db2.gz YMENDKWQOTVAMS-KRWDZBQOSA-N 2 0 317.433 3.294 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000364448481 287027841 /nfs/dbraw/zinc/02/78/41/287027841.db2.gz QKWZQFOJOPZPDI-PVAVHDDUSA-N 2 0 317.433 3.132 20 5 DGBDRP C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000346665667 264076756 /nfs/dbraw/zinc/07/67/56/264076756.db2.gz DGDVSDZDPSOOOE-STQMWFEESA-N 2 0 315.373 3.024 20 5 DGBDRP C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000346692952 264080420 /nfs/dbraw/zinc/08/04/20/264080420.db2.gz KACPPNIGXFBDAO-GXTWGEPZSA-N 2 0 315.373 3.024 20 5 DGBDRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000346693036 264080449 /nfs/dbraw/zinc/08/04/49/264080449.db2.gz KMGIFNUEYPWQTO-QWHCGFSZSA-N 2 0 315.373 3.024 20 5 DGBDRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000346693034 264080572 /nfs/dbraw/zinc/08/05/72/264080572.db2.gz KMGIFNUEYPWQTO-CHWSQXEVSA-N 2 0 315.373 3.024 20 5 DGBDRP C[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@@H]1[NH3+] ZINC000347106902 264157110 /nfs/dbraw/zinc/15/71/10/264157110.db2.gz MCOLTRHKXYRZEM-WBMJQRKESA-N 2 0 315.373 3.024 20 5 DGBDRP [NH3+]C[C@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000347113227 264158908 /nfs/dbraw/zinc/15/89/08/264158908.db2.gz QZPMPJGLYFBQCK-CYBMUJFWSA-N 2 0 315.373 3.026 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000124362617 431892233 /nfs/dbraw/zinc/89/22/33/431892233.db2.gz LPVRNZOOMZMZJX-UONOGXRCSA-N 2 0 303.406 3.038 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000271353481 432379634 /nfs/dbraw/zinc/37/96/34/432379634.db2.gz YUSOYPDUHVAJPW-CKEIUWERSA-N 2 0 314.389 3.435 20 5 DGBDRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192932801 432429869 /nfs/dbraw/zinc/42/98/69/432429869.db2.gz LFZVMUDPNBYCSS-HDMKZQKVSA-N 2 0 317.433 3.435 20 5 DGBDRP C[C@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000261609928 432433815 /nfs/dbraw/zinc/43/38/15/432433815.db2.gz BUWNJOAISCJANF-QGZVFWFLSA-N 2 0 315.373 3.026 20 5 DGBDRP Cc1c([C@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000272560757 432524076 /nfs/dbraw/zinc/52/40/76/432524076.db2.gz NRTIFGJLPBFLMN-AWEZNQCLSA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1nccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178699977 432768722 /nfs/dbraw/zinc/76/87/22/432768722.db2.gz HAJROBNWSQHFTR-TZMCWYRMSA-N 2 0 316.405 3.395 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421365815 433509895 /nfs/dbraw/zinc/50/98/95/433509895.db2.gz BHNFRNBFUZPZAW-ODIFPOPNSA-N 2 0 319.449 3.378 20 5 DGBDRP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CCCCC[NH+]1CCCC1 ZINC000339499792 433620660 /nfs/dbraw/zinc/62/06/60/433620660.db2.gz UEXBCWHOKBCHST-NTMALXAHSA-N 2 0 317.433 3.464 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000449059922 433716523 /nfs/dbraw/zinc/71/65/23/433716523.db2.gz DDUBCZSXFGMUDV-MRXNPFEDSA-N 2 0 319.449 3.237 20 5 DGBDRP CC(C)c1ccc(C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000414989498 433956510 /nfs/dbraw/zinc/95/65/10/433956510.db2.gz HFHYWUAPVUURJS-DZGCQCFKSA-N 2 0 305.422 3.325 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]([NH3+])C(C)C ZINC000423279212 434334785 /nfs/dbraw/zinc/33/47/85/434334785.db2.gz RUCVKHSNOHUTAX-STQMWFEESA-N 2 0 311.451 3.038 20 5 DGBDRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423305294 434354616 /nfs/dbraw/zinc/35/46/16/434354616.db2.gz QLDYFIRKUVHKBF-LLVKDONJSA-N 2 0 317.414 3.193 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)C1CC1 ZINC000423484468 434444198 /nfs/dbraw/zinc/44/41/98/434444198.db2.gz REPOROWSTZMMHO-DLBZAZTESA-N 2 0 317.433 3.038 20 5 DGBDRP O=[N+]([O-])c1cccc(Cl)c1CN1CCC(c2c[nH]cn2)CC1 ZINC000491928395 434884179 /nfs/dbraw/zinc/88/41/79/434884179.db2.gz FOKZNJXVHXGXHB-UHFFFAOYSA-N 2 0 320.780 3.351 20 5 DGBDRP Cc1ccc([C@@H](C)NCC[C@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000538278048 435490759 /nfs/dbraw/zinc/49/07/59/435490759.db2.gz JGEWMASVDSHLAB-GDBMZVCRSA-N 2 0 305.422 3.428 20 5 DGBDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000519155154 435670797 /nfs/dbraw/zinc/67/07/97/435670797.db2.gz AICLJCRQGBNUMJ-NEPJUHHUSA-N 2 0 303.362 3.070 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000571193140 315703441 /nfs/dbraw/zinc/70/34/41/315703441.db2.gz BTOXORSIXIHLMK-WLYUNCDWSA-N 2 0 305.422 3.427 20 5 DGBDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000449130739 535176296 /nfs/dbraw/zinc/17/62/96/535176296.db2.gz HOWRWEOZUUSZKD-HZPDHXFCSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000902432707 619635041 /nfs/dbraw/zinc/63/50/41/619635041.db2.gz WSRXGWAPKIXHJV-HZSPNIEDSA-N 2 0 305.422 3.194 20 5 DGBDRP [NH3+]C[C@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000902487329 619646255 /nfs/dbraw/zinc/64/62/55/619646255.db2.gz SXVQHXZQLXXYSO-OWQGQXMQSA-N 2 0 311.385 3.011 20 5 DGBDRP C[N@@H+]1CCCC[C@@H](CNCc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000858246073 621167815 /nfs/dbraw/zinc/16/78/15/621167815.db2.gz TXMDBOPHERMDTQ-LBPRGKRZSA-N 2 0 311.813 3.070 20 5 DGBDRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872068626 622787790 /nfs/dbraw/zinc/78/77/90/622787790.db2.gz YAZOMJLHYFVQDU-LBPRGKRZSA-N 2 0 321.396 3.259 20 5 DGBDRP Cc1c(C[NH2+]CCCCC[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000873128230 623042029 /nfs/dbraw/zinc/04/20/29/623042029.db2.gz HZHJVIVFLOYBJK-UHFFFAOYSA-N 2 0 305.422 3.259 20 5 DGBDRP CCC[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000873264930 623097014 /nfs/dbraw/zinc/09/70/14/623097014.db2.gz JLZKJAHGSRYSOE-DYVFJYSZSA-N 2 0 305.422 3.414 20 5 DGBDRP [NH3+]CCC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000925514036 627744938 /nfs/dbraw/zinc/74/49/38/627744938.db2.gz MHWYZXPMBDIQRX-QGZVFWFLSA-N 2 0 313.401 3.207 20 5 DGBDRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000925881444 627811258 /nfs/dbraw/zinc/81/12/58/627811258.db2.gz BCFJDDKACJNRNP-ABFRBSLYSA-N 2 0 317.433 3.023 20 5 DGBDRP C[C@@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000261678282 656962012 /nfs/dbraw/zinc/96/20/12/656962012.db2.gz GTMVYLHTMUXEAH-KRWDZBQOSA-N 2 0 315.373 3.026 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H](C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC001580331570 1192021623 /nfs/dbraw/zinc/02/16/23/1192021623.db2.gz RTGLJIKYWXVTDN-SHTZXODSSA-N 2 0 317.433 3.324 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)c(Cl)c1 ZINC001345955112 1179629319 /nfs/dbraw/zinc/62/93/19/1179629319.db2.gz BJTQZEKWBNIICQ-UHFFFAOYSA-N 2 0 323.824 3.214 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1N1C[C@@H]([NH3+])Cc2ccccc21 ZINC001162851113 1089992843 /nfs/dbraw/zinc/99/28/43/1089992843.db2.gz WRBIFZJNBOLIPL-SFHVURJKSA-N 2 0 310.465 3.304 20 5 DGBDRP C[C@@]1([NH3+])CCC[N@H+](Cc2ccc3ccc4cccnc4c3n2)CC1 ZINC001205281358 1091164343 /nfs/dbraw/zinc/16/43/43/1091164343.db2.gz SZLAANWWSYMQLR-HXUWFJFHSA-N 2 0 320.440 3.486 20 5 DGBDRP C[N+](C)(C)CCCO[C@H]1CC[N@H+](Cc2ccccc2Cl)C1 ZINC001224620733 1096248529 /nfs/dbraw/zinc/24/85/29/1096248529.db2.gz CGBRQKXQYDCIRH-INIZCTEOSA-N 2 0 311.877 3.027 20 5 DGBDRP CC[N@H+](CCC[NH+](C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912636 1097292247 /nfs/dbraw/zinc/29/22/47/1097292247.db2.gz KWCABTYZBIAVHN-KRWDZBQOSA-N 2 0 319.449 3.116 20 5 DGBDRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC001173228913 1097376299 /nfs/dbraw/zinc/37/62/99/1097376299.db2.gz NNCFITSFAZLLBD-RKVPGOIHSA-N 2 0 319.449 3.234 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001173228677 1097376494 /nfs/dbraw/zinc/37/64/94/1097376494.db2.gz JMYPERSJPGVDEX-RDJZCZTQSA-N 2 0 319.449 3.367 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCCC[NH+]1CCCC1 ZINC001173235808 1097379116 /nfs/dbraw/zinc/37/91/16/1097379116.db2.gz VAUIAPIWKNEGDL-INIZCTEOSA-N 2 0 319.449 3.382 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCC(CC[NH3+])CC1 ZINC001254549741 1106101534 /nfs/dbraw/zinc/10/15/34/1106101534.db2.gz YNSKYKOSBJOXHG-HLIUYOAVSA-N 2 0 305.422 3.023 20 5 DGBDRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC001319382648 1108438225 /nfs/dbraw/zinc/43/82/25/1108438225.db2.gz HYMHNUGTKQKADK-YOEHRIQHSA-N 2 0 305.422 3.367 20 5 DGBDRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000415050324 237032420 /nfs/dbraw/zinc/03/24/20/237032420.db2.gz YMMFDNVMESXOSF-GXTWGEPZSA-N 2 0 315.373 3.072 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000449237112 240084127 /nfs/dbraw/zinc/08/41/27/240084127.db2.gz AQXGCJXFWLCRTP-CVEARBPZSA-N 2 0 319.449 3.380 20 5 DGBDRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543773 241165562 /nfs/dbraw/zinc/16/55/62/241165562.db2.gz CRQLBOKWMBNBTN-IAGOWNOFSA-N 2 0 317.433 3.259 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000468648022 533385409 /nfs/dbraw/zinc/38/54/09/533385409.db2.gz MWOPCPYEUYZAIG-YWALDVPYSA-N 2 0 315.417 3.215 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000468731990 533408565 /nfs/dbraw/zinc/40/85/65/533408565.db2.gz DVJBFVWLJHMOJO-PNUWANSTSA-N 2 0 317.433 3.461 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000468650667 533410219 /nfs/dbraw/zinc/41/02/19/533410219.db2.gz VFKCSVCJGLXUJR-YUOYJMCBSA-N 2 0 303.406 3.070 20 5 DGBDRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000596101337 400318091 /nfs/dbraw/zinc/31/80/91/400318091.db2.gz GBQFKUBBFQNBAX-MRXNPFEDSA-N 2 0 317.389 3.318 20 5 DGBDRP O=[N+]([O-])c1ccc(CN2CCC[C@H](n3ccnc3)C2)c(Cl)c1 ZINC000611782103 400452804 /nfs/dbraw/zinc/45/28/04/400452804.db2.gz MRFRTEJYSZXJPL-AWEZNQCLSA-N 2 0 320.780 3.282 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]CCCC2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000592470659 400656262 /nfs/dbraw/zinc/65/62/62/400656262.db2.gz AZKCSLSGLGYKHV-CQSZACIVSA-N 2 0 305.422 3.334 20 5 DGBDRP C[C@@H]1C[C@@H](Nc2ccc3cnccc3c2[N+](=O)[O-])CC[N@@H+]1C ZINC000599051693 400940297 /nfs/dbraw/zinc/94/02/97/400940297.db2.gz WAVUAUSDNUWFDH-YPMHNXCESA-N 2 0 300.362 3.038 20 5 DGBDRP CCC[N@@H+]1CC[C@@H](Nc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599110231 400961756 /nfs/dbraw/zinc/96/17/56/400961756.db2.gz MGLQDKJCIINEAR-CYBMUJFWSA-N 2 0 300.362 3.039 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000420311376 292294945 /nfs/dbraw/zinc/29/49/45/292294945.db2.gz QZASBHDZOLQNEK-CQSZACIVSA-N 2 0 303.406 3.040 20 5 DGBDRP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC(C)(C)C[NH3+] ZINC000346649173 264072757 /nfs/dbraw/zinc/07/27/57/264072757.db2.gz GMSCMLICBPGQAY-UHFFFAOYSA-N 2 0 317.389 3.272 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)cc1[N+](=O)[O-] ZINC000346827201 264104718 /nfs/dbraw/zinc/10/47/18/264104718.db2.gz HTRVSFTWZIJDKO-USXIJHARSA-N 2 0 317.433 3.277 20 5 DGBDRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000423453858 274944087 /nfs/dbraw/zinc/94/40/87/274944087.db2.gz BDSJQJSMTFTSJG-INWSAYAOSA-N 2 0 315.417 3.078 20 5 DGBDRP C[NH+](C)CCCC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000123130175 431855782 /nfs/dbraw/zinc/85/57/82/431855782.db2.gz PKTYGZFCGDSSDG-UHFFFAOYSA-N 2 0 305.422 3.149 20 5 DGBDRP C[NH+](C)CCCC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000123530300 431867590 /nfs/dbraw/zinc/86/75/90/431867590.db2.gz WJCTWBLCQCLKAC-UHFFFAOYSA-N 2 0 305.422 3.149 20 5 DGBDRP CC[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000125420146 431924934 /nfs/dbraw/zinc/92/49/34/431924934.db2.gz NRCHGRDKGMRRHK-KRWDZBQOSA-N 2 0 305.422 3.367 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCC[NH+]1CCCC1)CCC2 ZINC000192618793 432393868 /nfs/dbraw/zinc/39/38/68/432393868.db2.gz NKSPEGIBMPTBFG-KRWDZBQOSA-N 2 0 303.406 3.048 20 5 DGBDRP Cc1nccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178699987 432768391 /nfs/dbraw/zinc/76/83/91/432768391.db2.gz HAJROBNWSQHFTR-OCCSQVGLSA-N 2 0 316.405 3.395 20 5 DGBDRP C[NH2+]CCC1CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000420314605 433158526 /nfs/dbraw/zinc/15/85/26/433158526.db2.gz VXIDSOSZVCBJAP-AWEZNQCLSA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]CCCC[N@H+](C)C2CC2)cc1[N+](=O)[O-] ZINC000453408595 433163987 /nfs/dbraw/zinc/16/39/87/433163987.db2.gz FLEHCGBVJLMVQL-CQSZACIVSA-N 2 0 305.422 3.428 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000414173008 433436763 /nfs/dbraw/zinc/43/67/63/433436763.db2.gz FYBGVDHPXFQLGT-LSDHHAIUSA-N 2 0 305.422 3.286 20 5 DGBDRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000414187220 433449103 /nfs/dbraw/zinc/44/91/03/433449103.db2.gz PRELIFLWUBFSJZ-KSSFIOAISA-N 2 0 317.433 3.294 20 5 DGBDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000414187216 433451625 /nfs/dbraw/zinc/45/16/25/433451625.db2.gz PRELIFLWUBFSJZ-KDOFPFPSSA-N 2 0 317.433 3.294 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@H]3C1)CCC2 ZINC000373024958 293252234 /nfs/dbraw/zinc/25/22/34/293252234.db2.gz ONHSDCXUXKYANI-RVKKMQEKSA-N 2 0 315.417 3.189 20 5 DGBDRP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC([NH3+])C1 ZINC000414780368 433830201 /nfs/dbraw/zinc/83/02/01/433830201.db2.gz TULPOOHBWOOSJC-UHFFFAOYSA-N 2 0 317.414 3.245 20 5 DGBDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000414910444 433912272 /nfs/dbraw/zinc/91/22/72/433912272.db2.gz CVDZWDHZEPFCKU-UONOGXRCSA-N 2 0 315.373 3.214 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000414864454 433892456 /nfs/dbraw/zinc/89/24/56/433892456.db2.gz YPVMELXUKJJOOX-DZGCQCFKSA-N 2 0 305.422 3.196 20 5 DGBDRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000422792659 434007384 /nfs/dbraw/zinc/00/73/84/434007384.db2.gz RHFVCGXTEZCQQK-HOCLYGCPSA-N 2 0 305.422 3.038 20 5 DGBDRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC[NH2+]1 ZINC000414955895 293893457 /nfs/dbraw/zinc/89/34/57/293893457.db2.gz UWVSFLXZNJNNIH-SRABZTEZSA-N 2 0 317.433 3.036 20 5 DGBDRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422918505 434106111 /nfs/dbraw/zinc/10/61/11/434106111.db2.gz IJPOJLRWFHNFPY-DLBZAZTESA-N 2 0 305.422 3.167 20 5 DGBDRP C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[NH2+]1 ZINC000422918013 434109711 /nfs/dbraw/zinc/10/97/11/434109711.db2.gz HCNOSKFDVZHYGN-YOEHRIQHSA-N 2 0 305.422 3.038 20 5 DGBDRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000423011963 434166192 /nfs/dbraw/zinc/16/61/92/434166192.db2.gz JUDSLEJFIPLHEI-ZBFHGGJFSA-N 2 0 305.422 3.038 20 5 DGBDRP CCC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423206387 434286494 /nfs/dbraw/zinc/28/64/94/434286494.db2.gz BYAURTLOWPIYOI-LXZKKBNFSA-N 2 0 305.422 3.414 20 5 DGBDRP C[NH+](C)CCCC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417340402 434361667 /nfs/dbraw/zinc/36/16/67/434361667.db2.gz MFXZICQFLHEFMP-QGZVFWFLSA-N 2 0 305.422 3.294 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1[N+](=O)[O-] ZINC000423362324 434380743 /nfs/dbraw/zinc/38/07/43/434380743.db2.gz SQZPPEPDAAIWDT-CYBMUJFWSA-N 2 0 311.385 3.357 20 5 DGBDRP C[NH+]1CCC(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417312161 434350065 /nfs/dbraw/zinc/35/00/65/434350065.db2.gz NEFRKNUIVZDESU-GOSISDBHSA-N 2 0 317.433 3.294 20 5 DGBDRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000353750333 434393673 /nfs/dbraw/zinc/39/36/73/434393673.db2.gz HRJYMOLRGBTPNQ-HOCLYGCPSA-N 2 0 305.422 3.208 20 5 DGBDRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423471993 434441665 /nfs/dbraw/zinc/44/16/65/434441665.db2.gz ZZOUYCFFUIAGCT-KSSFIOAISA-N 2 0 313.401 3.401 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000423499120 434461247 /nfs/dbraw/zinc/46/12/47/434461247.db2.gz HHGFCDCGHPPXCM-BFHYXJOUSA-N 2 0 323.462 3.183 20 5 DGBDRP Cc1ccc([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-] ZINC000296059270 434494088 /nfs/dbraw/zinc/49/40/88/434494088.db2.gz VSPJKDPFXPJMBN-WWTUQBGBSA-N 2 0 303.406 3.179 20 5 DGBDRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000424380352 434716873 /nfs/dbraw/zinc/71/68/73/434716873.db2.gz WXRKTGWGRCQRDZ-PQEBFOHHSA-N 2 0 317.433 3.166 20 5 DGBDRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000424380350 434717189 /nfs/dbraw/zinc/71/71/89/434717189.db2.gz WXRKTGWGRCQRDZ-MWQQHZPXSA-N 2 0 317.433 3.166 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459784781 434719831 /nfs/dbraw/zinc/71/98/31/434719831.db2.gz OORKCHZTHVMGHE-RBFDBLARSA-N 2 0 317.433 3.320 20 5 DGBDRP CC(C)[NH2+]CCC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000568381419 435428031 /nfs/dbraw/zinc/42/80/31/435428031.db2.gz LBVJATLKYWNPSO-NVXWUHKLSA-N 2 0 319.449 3.284 20 5 DGBDRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000414932343 303465665 /nfs/dbraw/zinc/46/56/65/303465665.db2.gz VNTYMHFAJNYSHQ-PQEBFOHHSA-N 2 0 317.433 3.166 20 5 DGBDRP C[NH+](C)CC(C)(C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000132107474 312635144 /nfs/dbraw/zinc/63/51/44/312635144.db2.gz ZEVAPKDDZCCLOC-MRXNPFEDSA-N 2 0 319.449 3.093 20 5 DGBDRP CC[NH+]1CCC(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000565474815 315264077 /nfs/dbraw/zinc/26/40/77/315264077.db2.gz KVTPZBNRJFRRPB-SFHVURJKSA-N 2 0 317.433 3.294 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000415014444 533852649 /nfs/dbraw/zinc/85/26/49/533852649.db2.gz MFNDUTHTUIUETI-VYDXJSESSA-N 2 0 319.449 3.413 20 5 DGBDRP [NH3+]C1CCC([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000437799230 534561014 /nfs/dbraw/zinc/56/10/14/534561014.db2.gz LITAYYSAKDHIBF-LYAPFXNSSA-N 2 0 317.433 3.166 20 5 DGBDRP CCC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000468627733 534955776 /nfs/dbraw/zinc/95/57/76/534955776.db2.gz ODYUWUDGEZMBSS-IUYQLWOBSA-N 2 0 317.433 3.320 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)cc1[N+](=O)[O-] ZINC000925840731 618643334 /nfs/dbraw/zinc/64/33/34/618643334.db2.gz KOHMXVLSNDQVQX-IAOVAPTHSA-N 2 0 303.406 3.086 20 5 DGBDRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000897461113 619130375 /nfs/dbraw/zinc/13/03/75/619130375.db2.gz LKLAAONDUYWXBY-KGLIPLIRSA-N 2 0 305.422 3.161 20 5 DGBDRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000902428059 619634207 /nfs/dbraw/zinc/63/42/07/619634207.db2.gz AQVMTLDZKAEMCT-KGLIPLIRSA-N 2 0 305.422 3.066 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@H+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CC2)cc1 ZINC000903883490 619827980 /nfs/dbraw/zinc/82/79/80/619827980.db2.gz IFYBBDVAXNOPCF-MQVJKMGUSA-N 2 0 315.417 3.090 20 5 DGBDRP C[N@@H+]1CCCC[C@@H](CNCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000858245731 621167535 /nfs/dbraw/zinc/16/75/35/621167535.db2.gz WPUYMJGAWCDPRR-LBPRGKRZSA-N 2 0 311.813 3.070 20 5 DGBDRP CC[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc([N+](=O)[O-])c1 ZINC000873260314 623095406 /nfs/dbraw/zinc/09/54/06/623095406.db2.gz YISAONGWTWQOPM-DUFGSWQCSA-N 2 0 303.406 3.166 20 5 DGBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000879248922 624463357 /nfs/dbraw/zinc/46/33/57/624463357.db2.gz YWPHDQBQDJQIGR-HNNXBMFYSA-N 2 0 317.433 3.464 20 5 DGBDRP Cc1c([C@H](C)[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000925842432 627804535 /nfs/dbraw/zinc/80/45/35/627804535.db2.gz JRLZEWFPPXMOLE-IAOVAPTHSA-N 2 0 303.406 3.086 20 5 DGBDRP CC1(C)C[C@H]([NH2+]C[C@@H]2CC[C@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000925879733 627810904 /nfs/dbraw/zinc/81/09/04/627810904.db2.gz JHMSPKWCJONSQV-WQGACYEGSA-N 2 0 303.406 3.034 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000841082844 630405322 /nfs/dbraw/zinc/40/53/22/630405322.db2.gz NGTMWXNMFARSGQ-HAQNSBGRSA-N 2 0 311.813 3.103 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)cc1Cl ZINC000843124849 630616232 /nfs/dbraw/zinc/61/62/32/630616232.db2.gz JGVOZCFRLPVTBF-UONOGXRCSA-N 2 0 323.824 3.070 20 5 DGBDRP C[C@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1CC[NH3+] ZINC000844902883 630972864 /nfs/dbraw/zinc/97/28/64/630972864.db2.gz WEIZXEJAINZOLD-XHDPSFHLSA-N 2 0 311.813 3.198 20 5 DGBDRP CN(CCc1ccccc1[N+](=O)[O-])C[C@H]([NH3+])CCC(C)(C)C ZINC001578481454 1191945661 /nfs/dbraw/zinc/94/56/61/1191945661.db2.gz VNXRUWIJRSNJSA-OAHLLOKOSA-N 2 0 307.438 3.223 20 5 DGBDRP [NH3+]C[C@@H]1CCCC12CC[NH+](Cc1ccc([N+](=O)[O-])cc1F)CC2 ZINC001580260347 1192017310 /nfs/dbraw/zinc/01/73/10/1192017310.db2.gz OBWHSHHVNMRAKT-AWEZNQCLSA-N 2 0 321.396 3.075 20 5 DGBDRP CC(C)c1ccc(C[NH2+]CCC2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC001575854889 1191512498 /nfs/dbraw/zinc/51/24/98/1191512498.db2.gz ZGTYPCONDAEWQA-UHFFFAOYSA-N 2 0 305.422 3.198 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1CN1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC001658192967 1196223437 /nfs/dbraw/zinc/22/34/37/1196223437.db2.gz IATYEFVNZRNPGI-SFHVURJKSA-N 2 0 317.433 3.129 20 5 DGBDRP [NH2+]=C(NCCCC[NH3+])Nc1nc2ccccc2c2ccccc21 ZINC001167884348 1084386081 /nfs/dbraw/zinc/38/60/81/1084386081.db2.gz VMYRMADGPHDETC-UHFFFAOYSA-N 2 0 307.401 3.063 20 5 DGBDRP O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]C2CC[NH+](CC3CCCCC3)CC2)C1 ZINC001168993420 1092477536 /nfs/dbraw/zinc/47/75/36/1092477536.db2.gz MXLNPJSMYBTONW-WMZOPIPTSA-N 2 0 323.481 3.066 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001173224121 1097374261 /nfs/dbraw/zinc/37/42/61/1097374261.db2.gz MFAFVCRKYHDHEA-AWEZNQCLSA-N 2 0 317.433 3.119 20 5 DGBDRP CC(C)[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[NH2+]CC1 ZINC001246581844 1104604513 /nfs/dbraw/zinc/60/45/13/1104604513.db2.gz BGHUUJSGXJGJRG-RDJZCZTQSA-N 2 0 319.449 3.378 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001254548693 1106101860 /nfs/dbraw/zinc/10/18/60/1106101860.db2.gz KOEKONDCBPWAID-JKSUJKDBSA-N 2 0 319.449 3.367 20 5 DGBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254580244 1106108607 /nfs/dbraw/zinc/10/86/07/1106108607.db2.gz BPRVZIOJDPMDKP-RHSMWYFYSA-N 2 0 319.449 3.162 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000415013569 237006363 /nfs/dbraw/zinc/00/63/63/237006363.db2.gz YLTMKLLNBRLIKN-IJEWVQPXSA-N 2 0 305.422 3.023 20 5 DGBDRP CCC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000591579379 400542986 /nfs/dbraw/zinc/54/29/86/400542986.db2.gz UNKLRDSENACBNU-JKSUJKDBSA-N 2 0 303.406 3.168 20 5 DGBDRP CC1(C)C[C@@H]([NH2+][C@H]2CC23CC[NH2+]CC3)c2cc([N+](=O)[O-])ccc21 ZINC000591581815 400543136 /nfs/dbraw/zinc/54/31/36/400543136.db2.gz WUCWPSFBCJBZMS-CVEARBPZSA-N 2 0 315.417 3.049 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592493984 400658288 /nfs/dbraw/zinc/65/82/88/400658288.db2.gz YFEQXCANLCHRIM-OWCLPIDISA-N 2 0 317.433 3.367 20 5 DGBDRP C[C@@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@@H]1CC[NH3+] ZINC000593316292 400817394 /nfs/dbraw/zinc/81/73/94/400817394.db2.gz OROGWYVSHCXZBH-YOPWKTHZSA-N 2 0 303.406 3.057 20 5 DGBDRP Cc1cc(NC[C@H](C2CC2)[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302147772 230123891 /nfs/dbraw/zinc/12/38/91/230123891.db2.gz GZZYRHIDIBUZJY-QGZVFWFLSA-N 2 0 314.389 3.204 20 5 DGBDRP C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC(C)(C)C[NH3+] ZINC000346636807 264070316 /nfs/dbraw/zinc/07/03/16/264070316.db2.gz HZNNRXRKOBLDQB-UHFFFAOYSA-N 2 0 317.389 3.272 20 5 DGBDRP CC1(C)C[C@H]([NH2+]C2CCC([NH3+])CC2)c2cc([N+](=O)[O-])ccc21 ZINC000331870916 273588822 /nfs/dbraw/zinc/58/88/22/273588822.db2.gz BBHITVZWPWPIJC-PPUFBPAQSA-N 2 0 303.406 3.177 20 5 DGBDRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000423284181 274948228 /nfs/dbraw/zinc/94/82/28/274948228.db2.gz WNHQDCPWHPUFMY-IAOVAPTHSA-N 2 0 303.406 3.079 20 5 DGBDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423444020 278227615 /nfs/dbraw/zinc/22/76/15/278227615.db2.gz WDGNOCDLONROID-BLLLJJGKSA-N 2 0 305.422 3.424 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423244946 280156315 /nfs/dbraw/zinc/15/63/15/280156315.db2.gz ICBRWQAGGWQCGV-KBPBESRZSA-N 2 0 323.462 3.055 20 5 DGBDRP CCC[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000121197771 431753789 /nfs/dbraw/zinc/75/37/89/431753789.db2.gz NANWOUVACBYKRQ-QGZVFWFLSA-N 2 0 305.422 3.367 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000124362132 431891736 /nfs/dbraw/zinc/89/17/36/431891736.db2.gz LPVRNZOOMZMZJX-KBPBESRZSA-N 2 0 303.406 3.038 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000420305407 281022685 /nfs/dbraw/zinc/02/26/85/281022685.db2.gz KDOVYMVVEDRNHP-CLROSIBMSA-N 2 0 303.406 3.023 20 5 DGBDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000249060410 432336128 /nfs/dbraw/zinc/33/61/28/432336128.db2.gz ZVVNQBWJLWCNMK-KSSFIOAISA-N 2 0 317.433 3.294 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000271353483 432379237 /nfs/dbraw/zinc/37/92/37/432379237.db2.gz YUSOYPDUHVAJPW-JKIFEVAISA-N 2 0 314.389 3.435 20 5 DGBDRP Cc1nccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178705238 432768377 /nfs/dbraw/zinc/76/83/77/432768377.db2.gz MDAKYXKFRUGPBD-QWHCGFSZSA-N 2 0 302.378 3.087 20 5 DGBDRP Cc1nccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178700091 432768560 /nfs/dbraw/zinc/76/85/60/432768560.db2.gz HAJROBNWSQHFTR-GXTWGEPZSA-N 2 0 316.405 3.395 20 5 DGBDRP CC(C)c1ccc(C[NH2+]CC2(C)CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000414904615 433908556 /nfs/dbraw/zinc/90/85/56/433908556.db2.gz NPFLBNYQVJZHLX-UHFFFAOYSA-N 2 0 305.422 3.198 20 5 DGBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000414909914 433913988 /nfs/dbraw/zinc/91/39/88/433913988.db2.gz CQRNGXFRQRSFAT-ZIAGYGMSSA-N 2 0 315.373 3.214 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000414864462 433890192 /nfs/dbraw/zinc/89/01/92/433890192.db2.gz YPVMELXUKJJOOX-UKRRQHHQSA-N 2 0 305.422 3.196 20 5 DGBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000415027550 433970225 /nfs/dbraw/zinc/97/02/25/433970225.db2.gz BBILSKHJTHIHNP-YQFWSFKMSA-N 2 0 317.433 3.023 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCCCC1 ZINC000423203301 434281758 /nfs/dbraw/zinc/28/17/58/434281758.db2.gz SJTRBWHDNMWSOI-AWEZNQCLSA-N 2 0 305.422 3.167 20 5 DGBDRP CC[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cccc([N+](=O)[O-])c1 ZINC000423372859 434390489 /nfs/dbraw/zinc/39/04/89/434390489.db2.gz HIFPMVKSAAQZAC-GOSISDBHSA-N 2 0 311.385 3.439 20 5 DGBDRP CCC([NH3+])(CC)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000423289058 434343079 /nfs/dbraw/zinc/34/30/79/434343079.db2.gz VYRCGZBYGOROFY-HNNXBMFYSA-N 2 0 305.422 3.023 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC000423380713 434392902 /nfs/dbraw/zinc/39/29/02/434392902.db2.gz NUMKHPNIYKFYIM-BFHYXJOUSA-N 2 0 323.462 3.196 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cccc1[N+](=O)[O-] ZINC000423372084 434393591 /nfs/dbraw/zinc/39/35/91/434393591.db2.gz GRLGMNXSXNSJJP-CYBMUJFWSA-N 2 0 311.385 3.357 20 5 DGBDRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000353750336 434395603 /nfs/dbraw/zinc/39/56/03/434395603.db2.gz HRJYMOLRGBTPNQ-ZBFHGGJFSA-N 2 0 305.422 3.208 20 5 DGBDRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000423472217 434442131 /nfs/dbraw/zinc/44/21/31/434442131.db2.gz MYXSFDXXAZLEMI-XYPHTWIQSA-N 2 0 317.433 3.023 20 5 DGBDRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000424380351 434715538 /nfs/dbraw/zinc/71/55/38/434715538.db2.gz WXRKTGWGRCQRDZ-MXASKKJJSA-N 2 0 317.433 3.166 20 5 DGBDRP CC[N@H+](CCC[NH+](C)C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000583962101 435260997 /nfs/dbraw/zinc/26/09/97/435260997.db2.gz DRHAZHPGUHWAFE-QINSGFPZSA-N 2 0 305.422 3.272 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000571193139 435686540 /nfs/dbraw/zinc/68/65/40/435686540.db2.gz BTOXORSIXIHLMK-NFOMZHRRSA-N 2 0 305.422 3.427 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000423084119 533846967 /nfs/dbraw/zinc/84/69/67/533846967.db2.gz HIZKHGPNBHBZSZ-SNVBAGLBSA-N 2 0 319.327 3.221 20 5 DGBDRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000415024554 533870250 /nfs/dbraw/zinc/87/02/50/533870250.db2.gz PAWLVSGVKJEEBD-GFCCVEGCSA-N 2 0 303.362 3.072 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)cc1[N+](=O)[O-] ZINC000442928108 528093284 /nfs/dbraw/zinc/09/32/84/528093284.db2.gz PIRHSKWNKXKWCW-CQSZACIVSA-N 2 0 305.422 3.279 20 5 DGBDRP C[NH+]1CCC(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000894717655 618434090 /nfs/dbraw/zinc/43/40/90/618434090.db2.gz FSWVSZOPCPJIAD-KRWDZBQOSA-N 2 0 317.433 3.116 20 5 DGBDRP C[C@@H](C[NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000897466497 619131003 /nfs/dbraw/zinc/13/10/03/619131003.db2.gz VXPQULGOYXHXEN-AWEZNQCLSA-N 2 0 317.433 3.162 20 5 DGBDRP C[C@H](C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C)c1ccccc1[N+](=O)[O-] ZINC000902432711 619634994 /nfs/dbraw/zinc/63/49/94/619634994.db2.gz WTLAEPDRIMNFAE-IRWJRLHMSA-N 2 0 317.433 3.065 20 5 DGBDRP C[C@@H](C[NH2+][C@H]1[C@@H]2CCC[NH2+][C@@H]2C1(C)C)c1ccccc1[N+](=O)[O-] ZINC000902432714 619635003 /nfs/dbraw/zinc/63/50/03/619635003.db2.gz WTLAEPDRIMNFAE-YVVXQTMVSA-N 2 0 317.433 3.065 20 5 DGBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000872054483 622779325 /nfs/dbraw/zinc/77/93/25/622779325.db2.gz XAHSVLDTVAHGCJ-LBPRGKRZSA-N 2 0 321.446 3.229 20 5 DGBDRP CC[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc([N+](=O)[O-])c1 ZINC000873260315 623095533 /nfs/dbraw/zinc/09/55/33/623095533.db2.gz YISAONGWTWQOPM-GUSZCTEKSA-N 2 0 303.406 3.166 20 5 DGBDRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000886543858 627160620 /nfs/dbraw/zinc/16/06/20/627160620.db2.gz WJKHTKGVEBDIDC-UHFFFAOYSA-N 2 0 317.433 3.482 20 5 DGBDRP CC(C)CC[NH+]1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000924953881 627697419 /nfs/dbraw/zinc/69/74/19/627697419.db2.gz FEENJCRCOZXDOP-UHFFFAOYSA-N 2 0 319.449 3.237 20 5 DGBDRP c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000841085613 630406067 /nfs/dbraw/zinc/40/60/67/630406067.db2.gz IPVGTPNGAWKDPL-SFHVURJKSA-N 2 0 320.436 3.461 20 5 DGBDRP CC(C)c1ccc(C[N@H+](C)C2CCC([NH3+])CC2)cc1[N+](=O)[O-] ZINC000843055543 630609283 /nfs/dbraw/zinc/60/92/83/630609283.db2.gz GSLOPSPHLXUJQT-UHFFFAOYSA-N 2 0 305.422 3.420 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H]3CC[NH2+]C3)CC2)cc1Cl ZINC000843126592 630616245 /nfs/dbraw/zinc/61/62/45/630616245.db2.gz LAINRBZDJUCDIR-CQSZACIVSA-N 2 0 323.824 3.070 20 5 DGBDRP [NH3+]CCCCCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000843128773 630617086 /nfs/dbraw/zinc/61/70/86/630617086.db2.gz ZSWMOEBWXBKRMP-UHFFFAOYSA-N 2 0 317.389 3.464 20 5 DGBDRP C[C@@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1CC[NH3+] ZINC000844902881 630972804 /nfs/dbraw/zinc/97/28/04/630972804.db2.gz WEIZXEJAINZOLD-IAQYHMDHSA-N 2 0 311.813 3.198 20 5 DGBDRP Cc1cc(N[C@@H](C)[C@@H]2CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261845790 657133074 /nfs/dbraw/zinc/13/30/74/657133074.db2.gz JAIRYLZFCABPNM-QWHCGFSZSA-N 2 0 314.389 3.251 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC001579734769 1191989337 /nfs/dbraw/zinc/98/93/37/1191989337.db2.gz KWIGRKDQECSEJY-AWEZNQCLSA-N 2 0 305.422 3.079 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC001579734770 1191989398 /nfs/dbraw/zinc/98/93/98/1191989398.db2.gz KWIGRKDQECSEJY-CQSZACIVSA-N 2 0 305.422 3.079 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC001574979581 1191461562 /nfs/dbraw/zinc/46/15/62/1191461562.db2.gz JLXGSJHZLBQEHN-WSYSLRRZSA-N 2 0 303.406 3.120 20 5 DGBDRP C[C@@H](C[NH+](C)C)[C@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001183065894 1083872879 /nfs/dbraw/zinc/87/28/79/1083872879.db2.gz RDVOLVZAVZIKIE-MAUKXSAKSA-N 2 0 319.449 3.190 20 5 DGBDRP CC(C)(C)C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169000241 1092481033 /nfs/dbraw/zinc/48/10/33/1092481033.db2.gz XEWAADUMOSTXRU-FPCVCCKLSA-N 2 0 311.470 3.050 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1-n1cc2ccc(C[NH3+])cc2n1 ZINC001171324250 1096332534 /nfs/dbraw/zinc/33/25/34/1096332534.db2.gz DAQZSQQGJXPFIX-UHFFFAOYSA-N 2 0 309.437 3.081 20 5 DGBDRP C[NH+](C)CCC(C)(C)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911322 1097292055 /nfs/dbraw/zinc/29/20/55/1097292055.db2.gz INPRTDDXITYJET-INIZCTEOSA-N 2 0 319.449 3.162 20 5 DGBDRP CC[NH+](CC)CCCC[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173215234 1097366949 /nfs/dbraw/zinc/36/69/49/1097366949.db2.gz URGUCXWCBPRBDP-OAHLLOKOSA-N 2 0 307.438 3.237 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2C ZINC001173236264 1097381624 /nfs/dbraw/zinc/38/16/24/1097381624.db2.gz ZMVGYFUZGBTWEF-PLYYQAHHSA-N 2 0 317.433 3.131 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246122346 1104396667 /nfs/dbraw/zinc/39/66/67/1104396667.db2.gz ADFGHKMLEJKRJE-HOCLYGCPSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC1CC[NH+](C)CC1 ZINC001254549448 1106101231 /nfs/dbraw/zinc/10/12/31/1106101231.db2.gz VVALUWKWGNBSBW-HNNXBMFYSA-N 2 0 319.449 3.237 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC001308570251 1111445720 /nfs/dbraw/zinc/44/57/20/1111445720.db2.gz KTWJHLWILSYZFU-QAPCUYQASA-N 2 0 317.433 3.128 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000278307075 214079838 /nfs/dbraw/zinc/07/98/38/214079838.db2.gz DLWRLSJACOLAGH-UHFFFAOYSA-N 2 0 323.824 3.212 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cccc1[N+](=O)[O-] ZINC000278516434 214207109 /nfs/dbraw/zinc/20/71/09/214207109.db2.gz RYTGNSUCFMFBRC-CQSZACIVSA-N 2 0 317.433 3.428 20 5 DGBDRP C[NH+]1CCC(CC[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000134913325 432089171 /nfs/dbraw/zinc/08/91/71/432089171.db2.gz CRPKLMGJXSDLJZ-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000449138085 240033151 /nfs/dbraw/zinc/03/31/51/240033151.db2.gz AUACWUULSCOECB-PBHICJAKSA-N 2 0 321.465 3.482 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000468623401 244056444 /nfs/dbraw/zinc/05/64/44/244056444.db2.gz WNIUHHPSLSQZPB-RVDMUPIBSA-N 2 0 317.433 3.461 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)C[NH+](C)C ZINC000468635947 244056964 /nfs/dbraw/zinc/05/69/64/244056964.db2.gz VMMFJHVKBQTWHZ-NTEUORMPSA-N 2 0 305.422 3.176 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[NH+]1CCCCC1 ZINC000468630531 244057297 /nfs/dbraw/zinc/05/72/97/244057297.db2.gz YVJONRHZXQORMH-SSZFMOIBSA-N 2 0 317.433 3.464 20 5 DGBDRP CC[NH+]1CCC([NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000468653918 244060040 /nfs/dbraw/zinc/06/00/40/244060040.db2.gz RQPGELJGFUZYFC-KAMYIIQDSA-N 2 0 303.406 3.072 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000468731992 533384164 /nfs/dbraw/zinc/38/41/64/533384164.db2.gz DVJBFVWLJHMOJO-YWALDVPYSA-N 2 0 317.433 3.461 20 5 DGBDRP Cc1c(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)cccc1[N+](=O)[O-] ZINC000595900235 400290846 /nfs/dbraw/zinc/29/08/46/400290846.db2.gz BSXJSXVHOLQIEA-MRXNPFEDSA-N 2 0 317.433 3.115 20 5 DGBDRP CC[NH+](CC)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000047978560 400638129 /nfs/dbraw/zinc/63/81/29/400638129.db2.gz DCUUEWKKECWPPC-UHFFFAOYSA-N 2 0 305.422 3.149 20 5 DGBDRP Cc1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)cc1[N+](=O)[O-] ZINC000594736595 401165542 /nfs/dbraw/zinc/16/55/42/401165542.db2.gz SKVWJYDDRXBQPT-QGZVFWFLSA-N 2 0 317.433 3.115 20 5 DGBDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)C1 ZINC000151127160 432222478 /nfs/dbraw/zinc/22/24/78/432222478.db2.gz SRMFLWRBHMRNAF-PBHICJAKSA-N 2 0 305.422 3.367 20 5 DGBDRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000346692955 264080816 /nfs/dbraw/zinc/08/08/16/264080816.db2.gz KACPPNIGXFBDAO-TZMCWYRMSA-N 2 0 315.373 3.024 20 5 DGBDRP O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000347168297 264168501 /nfs/dbraw/zinc/16/85/01/264168501.db2.gz MINSGPNPQQKNTI-XQDHMALISA-N 2 0 315.417 3.072 20 5 DGBDRP C[C@@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000192698693 274225432 /nfs/dbraw/zinc/22/54/32/274225432.db2.gz MVIXSWZQSGJTNX-KBXCAEBGSA-N 2 0 317.433 3.294 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)CCC2 ZINC000423474798 275038059 /nfs/dbraw/zinc/03/80/59/275038059.db2.gz HMFRDQJHVZEBPU-WMLDXEAASA-N 2 0 303.406 3.094 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000449096287 278298548 /nfs/dbraw/zinc/29/85/48/278298548.db2.gz GEIKLDCSPRHAMV-AWEZNQCLSA-N 2 0 317.433 3.132 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000420338158 278866774 /nfs/dbraw/zinc/86/67/74/278866774.db2.gz PCYBNCONONJADV-KBXCAEBGSA-N 2 0 317.433 3.428 20 5 DGBDRP Cc1cc(NC[C@@H](C2CC2)[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302147771 280626650 /nfs/dbraw/zinc/62/66/50/280626650.db2.gz GZZYRHIDIBUZJY-KRWDZBQOSA-N 2 0 314.389 3.204 20 5 DGBDRP Cc1c(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000261812631 432453146 /nfs/dbraw/zinc/45/31/46/432453146.db2.gz GPGASGMXXKKPDE-YESZJQIVSA-N 2 0 317.433 3.304 20 5 DGBDRP C[C@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)[C@H]1CCC[NH2+]C1 ZINC000423221525 290000819 /nfs/dbraw/zinc/00/08/19/290000819.db2.gz WXMDDNVRGAWLQZ-GDZNZVCISA-N 2 0 317.433 3.295 20 5 DGBDRP CC[C@H]([NH2+]CC1CC[NH+](CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000314583928 292890203 /nfs/dbraw/zinc/89/02/03/292890203.db2.gz APJWHDNGGCVYMK-KRWDZBQOSA-N 2 0 305.422 3.367 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@H]3C1)CCC2 ZINC000373024955 293251932 /nfs/dbraw/zinc/25/19/32/293251932.db2.gz ONHSDCXUXKYANI-RLFYNMQTSA-N 2 0 315.417 3.189 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@@H]3C1)CCC2 ZINC000373024948 293252126 /nfs/dbraw/zinc/25/21/26/293252126.db2.gz ONHSDCXUXKYANI-HDMKZQKVSA-N 2 0 315.417 3.189 20 5 DGBDRP Cc1c([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cccc1[N+](=O)[O-] ZINC000421890683 433795658 /nfs/dbraw/zinc/79/56/58/433795658.db2.gz YFBVMUVSIYJFKR-NFOMZHRRSA-N 2 0 305.422 3.427 20 5 DGBDRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414875699 433894576 /nfs/dbraw/zinc/89/45/76/433894576.db2.gz KIBJXCZKNVVBFS-LLVKDONJSA-N 2 0 305.403 3.008 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000295114280 434210435 /nfs/dbraw/zinc/21/04/35/434210435.db2.gz WMPSUOGZRPQUEU-HZTRTUMWSA-N 2 0 317.433 3.131 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423213888 434291000 /nfs/dbraw/zinc/29/10/00/434291000.db2.gz KMGDNEBAAAPCHI-GUTXKFCHSA-N 2 0 321.421 3.032 20 5 DGBDRP C[NH+](C)C1CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000353675627 434326795 /nfs/dbraw/zinc/32/67/95/434326795.db2.gz VEONSEISSDHGJQ-UHFFFAOYSA-N 2 0 311.813 3.211 20 5 DGBDRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000423472212 434442480 /nfs/dbraw/zinc/44/24/80/434442480.db2.gz MYXSFDXXAZLEMI-IAOVAPTHSA-N 2 0 317.433 3.023 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000531721904 435114000 /nfs/dbraw/zinc/11/40/00/435114000.db2.gz XMLWLPXJWVTFPM-RDBSUJKOSA-N 2 0 303.406 3.179 20 5 DGBDRP C[N@@H+]1CCC[C@H]2CN(Cc3c(Cl)cccc3[N+](=O)[O-])CC[C@H]21 ZINC000493363792 435157080 /nfs/dbraw/zinc/15/70/80/435157080.db2.gz NKUJGQYPMXWKQL-SWLSCSKDSA-N 2 0 323.824 3.164 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000415069951 534887797 /nfs/dbraw/zinc/88/77/97/534887797.db2.gz PRWRVHKITSJWPP-PBHICJAKSA-N 2 0 317.433 3.038 20 5 DGBDRP CC[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423450254 529204555 /nfs/dbraw/zinc/20/45/55/529204555.db2.gz XCLYKMIOMLHGMS-GVDBMIGSSA-N 2 0 303.406 3.024 20 5 DGBDRP CC[N@@H+]1CCC[C@@H](C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000468621821 535523099 /nfs/dbraw/zinc/52/30/99/535523099.db2.gz ZCCAKTPYIUHCFN-OBHPCNEJSA-N 2 0 317.433 3.320 20 5 DGBDRP C[C@@H](C[NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-] ZINC000903244736 619743271 /nfs/dbraw/zinc/74/32/71/619743271.db2.gz CIQIZAPINBNGPR-UONOGXRCSA-N 2 0 305.422 3.018 20 5 DGBDRP Cc1ccc(C[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000865765634 621991501 /nfs/dbraw/zinc/99/15/01/621991501.db2.gz FBJSDJCBIYNCGF-UHFFFAOYSA-N 2 0 305.422 3.256 20 5 DGBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCC([NH+](C)C)CC1 ZINC000866377246 622106436 /nfs/dbraw/zinc/10/64/36/622106436.db2.gz DVHDCKIOBHKHKK-UWTIGNOOSA-N 2 0 323.412 3.127 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@H]1CCCC[N@@H+](C)C1 ZINC000873141762 623048517 /nfs/dbraw/zinc/04/85/17/623048517.db2.gz KIPVTNVHHDVSHF-OAHLLOKOSA-N 2 0 305.422 3.033 20 5 DGBDRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000873222888 623079870 /nfs/dbraw/zinc/07/98/70/623079870.db2.gz DIKZVVOTCHZZNJ-POZKEBTKSA-N 2 0 317.433 3.305 20 5 DGBDRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000873222887 623080083 /nfs/dbraw/zinc/08/00/83/623080083.db2.gz DIKZVVOTCHZZNJ-JHTBKMLMSA-N 2 0 317.433 3.305 20 5 DGBDRP C[C@@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC[NH2+]CC1 ZINC000873269959 623099770 /nfs/dbraw/zinc/09/97/70/623099770.db2.gz VSLYIXJKAJZULF-SJKOYZFVSA-N 2 0 317.433 3.295 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1Cl ZINC000775199700 623241245 /nfs/dbraw/zinc/24/12/45/623241245.db2.gz FUZCSBUALFYAME-UHFFFAOYSA-N 2 0 323.824 3.212 20 5 DGBDRP Cc1c(C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000779197864 623740848 /nfs/dbraw/zinc/74/08/48/623740848.db2.gz MNCPFAUCVPVBQS-MRXNPFEDSA-N 2 0 307.438 3.359 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC(C)(C)[NH3+] ZINC000925742450 627786100 /nfs/dbraw/zinc/78/61/00/627786100.db2.gz UFNRKMXAFPVBGW-GFCCVEGCSA-N 2 0 311.451 3.183 20 5 DGBDRP Cc1cc(N[C@H](C)[C@@H]2CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261845770 657133083 /nfs/dbraw/zinc/13/30/83/657133083.db2.gz JAIRYLZFCABPNM-CHWSQXEVSA-N 2 0 314.389 3.251 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC001579734773 1191989891 /nfs/dbraw/zinc/98/98/91/1191989891.db2.gz LCMNZOYJZAXMLZ-MRXNPFEDSA-N 2 0 317.433 3.033 20 5 DGBDRP Cc1ccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)cc1[N+](=O)[O-] ZINC001352111441 1180297574 /nfs/dbraw/zinc/29/75/74/1180297574.db2.gz GIQWYUZLZPHGFK-YESZJQIVSA-N 2 0 317.433 3.065 20 5 DGBDRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC001576384109 1191577397 /nfs/dbraw/zinc/57/73/97/1191577397.db2.gz UAAIWXQKOBVLCZ-WNOSKKOXSA-N 2 0 317.433 3.021 20 5 DGBDRP CC[N@@H+]1CC[C@H](N(C)Cc2c(C)ccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC001663596022 1196910821 /nfs/dbraw/zinc/91/08/21/1196910821.db2.gz VUEPURWVOCGLFI-PBHICJAKSA-N 2 0 319.449 3.374 20 5 DGBDRP Cc1cc2cc3cc(C)c(NC4=CC[NH2+]C4)cc3[nH+]c2cc1N ZINC001160223669 1088707473 /nfs/dbraw/zinc/70/74/73/1088707473.db2.gz VANXDMNDAQDJLR-UHFFFAOYSA-N 2 0 304.397 3.486 20 5 DGBDRP O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]C2CC[NH+](CC3CCCCC3)CC2)C1 ZINC001168993415 1092476614 /nfs/dbraw/zinc/47/66/14/1092476614.db2.gz MXLNPJSMYBTONW-FUHWJXTLSA-N 2 0 323.481 3.066 20 5 DGBDRP C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1OCCC[N+](C)(C)C ZINC001224618438 1096247532 /nfs/dbraw/zinc/24/75/32/1096247532.db2.gz HHBWPKGYRYSBCU-IEBWSBKVSA-N 2 0 305.486 3.010 20 5 DGBDRP C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1OCCC[N+](C)(C)C ZINC001224618439 1096247809 /nfs/dbraw/zinc/24/78/09/1096247809.db2.gz HHBWPKGYRYSBCU-MJGOQNOKSA-N 2 0 305.486 3.010 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC001173219886 1097371193 /nfs/dbraw/zinc/37/11/93/1097371193.db2.gz QIMNRNOVGZLYGE-AWEZNQCLSA-N 2 0 317.433 3.132 20 5 DGBDRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC001319382646 1108438999 /nfs/dbraw/zinc/43/89/99/1108438999.db2.gz HYMHNUGTKQKADK-WMLDXEAASA-N 2 0 305.422 3.367 20 5 DGBDRP C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC1CC[NH+](C)CC1 ZINC000174847215 198393448 /nfs/dbraw/zinc/39/34/48/198393448.db2.gz WZVVXOKJQBOVPQ-UHFFFAOYSA-N 2 0 311.813 3.022 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000415018413 237010130 /nfs/dbraw/zinc/01/01/30/237010130.db2.gz BTJLEHWLPXGUEO-HAQNSBGRSA-N 2 0 311.813 3.103 20 5 DGBDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000415042853 237026730 /nfs/dbraw/zinc/02/67/30/237026730.db2.gz RIOOQNYKRGMOHD-CHWSQXEVSA-N 2 0 315.373 3.072 20 5 DGBDRP [NH3+]C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435395886 238300501 /nfs/dbraw/zinc/30/05/01/238300501.db2.gz VQTHSSXGVCXOHN-LBPRGKRZSA-N 2 0 317.414 3.104 20 5 DGBDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000449130738 240030651 /nfs/dbraw/zinc/03/06/51/240030651.db2.gz HOWRWEOZUUSZKD-HOTGVXAUSA-N 2 0 319.449 3.236 20 5 DGBDRP CC[NH+]1CCC(CC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449166791 240049655 /nfs/dbraw/zinc/04/96/55/240049655.db2.gz GECFGTRNTUUJBL-OAHLLOKOSA-N 2 0 319.449 3.237 20 5 DGBDRP C[NH+](C)CCCC(C)(C)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000449527933 240269940 /nfs/dbraw/zinc/26/99/40/240269940.db2.gz LZXQGLJYBJYFCE-YFHOEESVSA-N 2 0 305.422 3.318 20 5 DGBDRP CC[NH+](CC)CCC[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000468636172 244056342 /nfs/dbraw/zinc/05/63/42/244056342.db2.gz XYFHDWIFIBVRKV-NTCAYCPXSA-N 2 0 305.422 3.320 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[NH+]1CCCCC1 ZINC000468630530 244057320 /nfs/dbraw/zinc/05/73/20/244057320.db2.gz YVJONRHZXQORMH-DTQAZKPQSA-N 2 0 317.433 3.464 20 5 DGBDRP Cc1c(C[N@H+]2CCC[C@@H](C)[C@H]2CCC[NH3+])cccc1[N+](=O)[O-] ZINC000595904612 400290901 /nfs/dbraw/zinc/29/09/01/400290901.db2.gz IQPBZJMOEHWTLN-CZUORRHYSA-N 2 0 305.422 3.243 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000595900988 400291172 /nfs/dbraw/zinc/29/11/72/400291172.db2.gz RGVKHGGGHGEHDN-HOCLYGCPSA-N 2 0 317.433 3.367 20 5 DGBDRP C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)C1CC[NH+](C)CC1 ZINC000611335952 400380285 /nfs/dbraw/zinc/38/02/85/400380285.db2.gz NTFPYBPJFRMSCH-HNNXBMFYSA-N 2 0 319.449 3.237 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)cc1[N+](=O)[O-] ZINC000602019737 400404765 /nfs/dbraw/zinc/40/47/65/400404765.db2.gz HCGCTDQWUBNZBY-UMVBOHGHSA-N 2 0 321.421 3.162 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000602019717 400404795 /nfs/dbraw/zinc/40/47/95/400404795.db2.gz GLEMOPULFUOVQR-JQFCIGGWSA-N 2 0 317.433 3.023 20 5 DGBDRP C[C@@H]1C[C@H](Nc2ccc3cnccc3c2[N+](=O)[O-])CC[N@@H+]1C ZINC000599051691 400939197 /nfs/dbraw/zinc/93/91/97/400939197.db2.gz WAVUAUSDNUWFDH-DGCLKSJQSA-N 2 0 300.362 3.038 20 5 DGBDRP Cc1ccc([C@@H](C)NC[C@H]2CCCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000599069291 400948237 /nfs/dbraw/zinc/94/82/37/400948237.db2.gz FBUASXQCMCUMCV-HUUCEWRRSA-N 2 0 305.422 3.286 20 5 DGBDRP C[C@@H]([NH2+]C[C@@H]1CCN1C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599073494 400950626 /nfs/dbraw/zinc/95/06/26/400950626.db2.gz HBZFUGZAWQJIDI-DYVFJYSZSA-N 2 0 303.406 3.262 20 5 DGBDRP C[C@@H]([NH2+]C[C@H]1CCN1C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599073493 400950805 /nfs/dbraw/zinc/95/08/05/400950805.db2.gz HBZFUGZAWQJIDI-CXAGYDPISA-N 2 0 303.406 3.262 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000415025307 533681972 /nfs/dbraw/zinc/68/19/72/533681972.db2.gz PQEDLDKUEPUGFV-JYJNAYRXSA-N 2 0 319.449 3.271 20 5 DGBDRP [NH3+]CC1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000346685682 264079896 /nfs/dbraw/zinc/07/98/96/264079896.db2.gz IZWTXPTUSLDMIM-UHFFFAOYSA-N 2 0 315.373 3.026 20 5 DGBDRP CCC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CC[NH2+]CC1 ZINC000347017064 264141422 /nfs/dbraw/zinc/14/14/22/264141422.db2.gz DGPKIYOTFJMDON-FNORWQNLSA-N 2 0 303.406 3.072 20 5 DGBDRP CC(C)c1ccc(C[NH+]2CCC([C@H](C)[NH3+])CC2)cc1[N+](=O)[O-] ZINC000347049254 264146902 /nfs/dbraw/zinc/14/69/02/264146902.db2.gz QINPJJMHPISIQI-ZDUSSCGKSA-N 2 0 305.422 3.277 20 5 DGBDRP O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000347168296 264168383 /nfs/dbraw/zinc/16/83/83/264168383.db2.gz MINSGPNPQQKNTI-UKINESCASA-N 2 0 315.417 3.072 20 5 DGBDRP Cc1nccn1CCCC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000352564791 265090779 /nfs/dbraw/zinc/09/07/79/265090779.db2.gz WUOPQDRYFZJJCI-UHFFFAOYSA-N 2 0 316.405 3.054 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)CCC2 ZINC000423474799 275037945 /nfs/dbraw/zinc/03/79/45/275037945.db2.gz HMFRDQJHVZEBPU-YOEHRIQHSA-N 2 0 303.406 3.094 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)CCC2 ZINC000423474797 275038077 /nfs/dbraw/zinc/03/80/77/275038077.db2.gz HMFRDQJHVZEBPU-RHSMWYFYSA-N 2 0 303.406 3.094 20 5 DGBDRP CC1(C)C[C@H]([NH2+]C[C@]2(C)CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc21 ZINC000423350993 275868602 /nfs/dbraw/zinc/86/86/02/275868602.db2.gz YIQYDOGPWVUVJF-FUHWJXTLSA-N 2 0 317.433 3.297 20 5 DGBDRP C[N@H+]1CC=C(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000279144468 277023174 /nfs/dbraw/zinc/02/31/74/277023174.db2.gz SEGIHZMHQZLDET-QGZVFWFLSA-N 2 0 315.417 3.169 20 5 DGBDRP CC[NH+]1CCC(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000049963761 431945663 /nfs/dbraw/zinc/94/56/63/431945663.db2.gz TYLKKYQHMSNTKY-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CCC2 ZINC000192657975 432398880 /nfs/dbraw/zinc/39/88/80/432398880.db2.gz QWAJBGVOHCTSDF-ACJLOTCBSA-N 2 0 315.417 3.046 20 5 DGBDRP C[C@@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000261609926 432432238 /nfs/dbraw/zinc/43/22/38/432432238.db2.gz BUWNJOAISCJANF-KRWDZBQOSA-N 2 0 315.373 3.026 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000272579575 432527402 /nfs/dbraw/zinc/52/74/02/432527402.db2.gz QDMNPXUPYBPVAQ-HNNXBMFYSA-N 2 0 319.449 3.237 20 5 DGBDRP Cc1ccc(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1[N+](=O)[O-] ZINC000290525308 433079477 /nfs/dbraw/zinc/07/94/77/433079477.db2.gz QGFFLMLQKRUYCE-QGZVFWFLSA-N 2 0 317.433 3.067 20 5 DGBDRP O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420322431 433165927 /nfs/dbraw/zinc/16/59/27/433165927.db2.gz FCYVHTWCIBPEDQ-QWHCGFSZSA-N 2 0 323.824 3.070 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000414795285 433839310 /nfs/dbraw/zinc/83/93/10/433839310.db2.gz GMFVNEVABCKISN-VNQPRFMTSA-N 2 0 305.422 3.023 20 5 DGBDRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414887350 433898511 /nfs/dbraw/zinc/89/85/11/433898511.db2.gz DKEFCEJDEQXMBN-NSHDSACASA-N 2 0 305.403 3.150 20 5 DGBDRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293840341 433892333 /nfs/dbraw/zinc/89/23/33/433892333.db2.gz XSSHPBKTTSLMRU-AWEZNQCLSA-N 2 0 320.437 3.094 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414968654 293898127 /nfs/dbraw/zinc/89/81/27/293898127.db2.gz SCLRKILGDLNNQB-GOEBONIOSA-N 2 0 305.422 3.038 20 5 DGBDRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000423284182 434340233 /nfs/dbraw/zinc/34/02/33/434340233.db2.gz WNHQDCPWHPUFMY-JQFCIGGWSA-N 2 0 303.406 3.079 20 5 DGBDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000423290790 434345306 /nfs/dbraw/zinc/34/53/06/434345306.db2.gz FLWDLGUMRNKJCW-ZIAGYGMSSA-N 2 0 313.401 3.335 20 5 DGBDRP CCC[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423321538 434360570 /nfs/dbraw/zinc/36/05/70/434360570.db2.gz GIEZEOCQKDOGLW-SJORKVTESA-N 2 0 305.422 3.415 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)C1CC1 ZINC000423484866 434445335 /nfs/dbraw/zinc/44/53/35/434445335.db2.gz REPOROWSTZMMHO-IAGOWNOFSA-N 2 0 317.433 3.038 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000576742579 316161928 /nfs/dbraw/zinc/16/19/28/316161928.db2.gz VKUCKXQHLJBEFH-NQUDRAQSSA-N 2 0 317.433 3.318 20 5 DGBDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000925827426 618639002 /nfs/dbraw/zinc/63/90/02/618639002.db2.gz RZQKSOBATLPKFA-NEPJUHHUSA-N 2 0 314.389 3.169 20 5 DGBDRP C[C@@H](C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000902428058 619634248 /nfs/dbraw/zinc/63/42/48/619634248.db2.gz AQVMTLDZKAEMCT-KBPBESRZSA-N 2 0 305.422 3.066 20 5 DGBDRP CC(C)([NH3+])CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000903939368 619837993 /nfs/dbraw/zinc/83/79/93/619837993.db2.gz YDVZIBONNBSFRH-UHFFFAOYSA-N 2 0 303.362 3.072 20 5 DGBDRP CC(C)([NH3+])CC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000903940006 619840884 /nfs/dbraw/zinc/84/08/84/619840884.db2.gz SRVOBHKBKYNPOK-ZFWWWQNUSA-N 2 0 305.422 3.023 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000873130763 623043551 /nfs/dbraw/zinc/04/35/51/623043551.db2.gz JUYNMFHDCYSJOS-UHFFFAOYSA-N 2 0 305.422 3.176 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@H](C)C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000873221411 623078961 /nfs/dbraw/zinc/07/89/61/623078961.db2.gz JMKLTFRYZHLHEW-CYBMUJFWSA-N 2 0 305.422 3.196 20 5 DGBDRP C[C@H]([NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC[NH2+]CC1 ZINC000873272642 623100282 /nfs/dbraw/zinc/10/02/82/623100282.db2.gz VSLYIXJKAJZULF-SJCJKPOMSA-N 2 0 317.433 3.295 20 5 DGBDRP C[NH+](C)C[C@@](C)(O)C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000131373788 626632465 /nfs/dbraw/zinc/63/24/65/626632465.db2.gz WWFBUZOPVOGWHF-NRFANRHFSA-N 2 0 322.452 3.395 20 5 DGBDRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000886517674 627155737 /nfs/dbraw/zinc/15/57/37/627155737.db2.gz MXXQUXHSHWLVNT-UHFFFAOYSA-N 2 0 317.433 3.482 20 5 DGBDRP c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000841085612 630405899 /nfs/dbraw/zinc/40/58/99/630405899.db2.gz IPVGTPNGAWKDPL-GOSISDBHSA-N 2 0 320.436 3.461 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc1Cl ZINC000843124848 630616722 /nfs/dbraw/zinc/61/67/22/630616722.db2.gz JGVOZCFRLPVTBF-KGLIPLIRSA-N 2 0 323.824 3.070 20 5 DGBDRP CC1(C)C[C@H]([NH2+]CCCCCC[NH3+])c2cc([N+](=O)[O-])ccc21 ZINC000843340791 630647135 /nfs/dbraw/zinc/64/71/35/630647135.db2.gz FEBLOXPNNRMTRQ-INIZCTEOSA-N 2 0 305.422 3.426 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000261996604 657276359 /nfs/dbraw/zinc/27/63/59/657276359.db2.gz UPBDXRMJRFINNP-CZUORRHYSA-N 2 0 303.406 3.120 20 5 DGBDRP CCCC1(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)CC[NH2+]CC1 ZINC001577371747 1191895532 /nfs/dbraw/zinc/89/55/32/1191895532.db2.gz KDNYXVQEZNGSBQ-UHFFFAOYSA-N 2 0 305.422 3.163 20 5 DGBDRP CC(C)C[N@@H+](Cc1ccccc1[N+](=O)[O-])CC1CC[NH+](C)CC1 ZINC001644259047 1195093722 /nfs/dbraw/zinc/09/37/22/1195093722.db2.gz XLHOHCBBBSAJAQ-UHFFFAOYSA-N 2 0 319.449 3.395 20 5 DGBDRP [NH3+][C@H]1CC[N@H+](Cc2ccc3ccc4cccnc4c3n2)CC[C@H]1F ZINC001206188223 1091526433 /nfs/dbraw/zinc/52/64/33/1091526433.db2.gz UUQGDYPODMOERF-SJORKVTESA-N 2 0 324.403 3.044 20 5 DGBDRP CCCC[NH+](CCCC)CCC[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168974938 1092475333 /nfs/dbraw/zinc/47/53/33/1092475333.db2.gz SZMZQMVRERVCLD-IAGOWNOFSA-N 2 0 313.486 3.314 20 5 DGBDRP C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C1CC[NH+](C2CCCCC2)CC1 ZINC001169054567 1092511370 /nfs/dbraw/zinc/51/13/70/1092511370.db2.gz MRINJYZXCNORNE-CRAIPNDOSA-N 2 0 323.481 3.161 20 5 DGBDRP C[N+](C)(C)CCCO[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001224622958 1096248701 /nfs/dbraw/zinc/24/87/01/1096248701.db2.gz JGLCJNCKJJFKQL-PMOLBWCYSA-N 2 0 317.497 3.295 20 5 DGBDRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1OCCC[N+](C)(C)C ZINC001224624837 1096248821 /nfs/dbraw/zinc/24/88/21/1096248821.db2.gz ZUPVSTJBIOPALF-IEBWSBKVSA-N 2 0 305.486 3.010 20 5 DGBDRP C[N+](C)(C)CCCO[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2)C1 ZINC001224621699 1096249107 /nfs/dbraw/zinc/24/91/07/1096249107.db2.gz ZNKRGKJWEXFJIU-QGZVFWFLSA-N 2 0 311.877 3.027 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC001173217098 1097368961 /nfs/dbraw/zinc/36/89/61/1097368961.db2.gz LLKMKRAQCQLBEO-JKSUJKDBSA-N 2 0 319.449 3.380 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC001173223959 1097373978 /nfs/dbraw/zinc/37/39/78/1097373978.db2.gz CHIOEIZMPXYQER-OOHWJJMZSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001254548692 1106101394 /nfs/dbraw/zinc/10/13/94/1106101394.db2.gz KOEKONDCBPWAID-HZPDHXFCSA-N 2 0 319.449 3.367 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC[C@@H]1N(C)C ZINC001319201281 1108362882 /nfs/dbraw/zinc/36/28/82/1108362882.db2.gz OPZZQNJNVKGQNG-HFTRVMKXSA-N 2 0 319.449 3.378 20 5 DGBDRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC001319382642 1108438921 /nfs/dbraw/zinc/43/89/21/1108438921.db2.gz HYMHNUGTKQKADK-PBHICJAKSA-N 2 0 305.422 3.367 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423370822 529418254 /nfs/dbraw/zinc/41/82/54/529418254.db2.gz UPSFPTULKZQLQS-ZIAGYGMSSA-N 2 0 323.462 3.197 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423370821 529534453 /nfs/dbraw/zinc/53/44/53/529534453.db2.gz UPSFPTULKZQLQS-UONOGXRCSA-N 2 0 323.462 3.197 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cccc1[N+](=O)[O-] ZINC000423421869 237848543 /nfs/dbraw/zinc/84/85/43/237848543.db2.gz KQQGZBJNCZFHRR-RBSFLKMASA-N 2 0 305.422 3.319 20 5 DGBDRP O=[N+]([O-])c1ccc(CN(CCC[NH+]2CCCCC2)C2CC2)cc1 ZINC000444614748 239306772 /nfs/dbraw/zinc/30/67/72/239306772.db2.gz ZWPDYLVMJPFWFS-UHFFFAOYSA-N 2 0 317.433 3.435 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000449138088 240035507 /nfs/dbraw/zinc/03/55/07/240035507.db2.gz AUACWUULSCOECB-RHSMWYFYSA-N 2 0 321.465 3.482 20 5 DGBDRP CC[C@H]([NH2+]C[C@@H](C)C[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000171141307 432105453 /nfs/dbraw/zinc/10/54/53/432105453.db2.gz WMNQGWBTSAMJIQ-PBHICJAKSA-N 2 0 305.422 3.367 20 5 DGBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000595900365 400290872 /nfs/dbraw/zinc/29/08/72/400290872.db2.gz DHBBOCMLZPQGCV-RHSMWYFYSA-N 2 0 317.433 3.367 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000591278478 400505554 /nfs/dbraw/zinc/50/55/54/400505554.db2.gz GEOOWJFVNXQSCS-USXIJHARSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000591282645 400506270 /nfs/dbraw/zinc/50/62/70/400506270.db2.gz JURCBXJFUKOCHM-GDBMZVCRSA-N 2 0 317.433 3.180 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000591578319 400541213 /nfs/dbraw/zinc/54/12/13/400541213.db2.gz QICFNHYIDBJGPN-ZIAGYGMSSA-N 2 0 323.462 3.197 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+]CCC2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000593321979 400818010 /nfs/dbraw/zinc/81/80/10/400818010.db2.gz KIUSVFSJUXSZPS-ZDUSSCGKSA-N 2 0 321.421 3.034 20 5 DGBDRP Cc1ccc([C@@H](C)NC[C@@H]2CCCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000599069289 400949154 /nfs/dbraw/zinc/94/91/54/400949154.db2.gz FBUASXQCMCUMCV-CABCVRRESA-N 2 0 305.422 3.286 20 5 DGBDRP C[NH+]1CCC(CCNc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599033424 400932928 /nfs/dbraw/zinc/93/29/28/400932928.db2.gz WMSVDLGMISGXCD-UHFFFAOYSA-N 2 0 314.389 3.287 20 5 DGBDRP CC(C)[N@H+](CCC1CC[NH2+]CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000359221027 286263708 /nfs/dbraw/zinc/26/37/08/286263708.db2.gz OJSCHEZATPDJSV-UHFFFAOYSA-N 2 0 305.422 3.195 20 5 DGBDRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000262051545 165782122 /nfs/dbraw/zinc/78/21/22/165782122.db2.gz CXINFESUILKMBI-HOCLYGCPSA-N 2 0 305.422 3.038 20 5 DGBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000346497835 264041866 /nfs/dbraw/zinc/04/18/66/264041866.db2.gz UVHPHWKHZIDYCH-CXAGYDPISA-N 2 0 313.357 3.204 20 5 DGBDRP C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000346692953 264080404 /nfs/dbraw/zinc/08/04/04/264080404.db2.gz KACPPNIGXFBDAO-JSGCOSHPSA-N 2 0 315.373 3.024 20 5 DGBDRP CCC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000124166015 431885014 /nfs/dbraw/zinc/88/50/14/431885014.db2.gz DTUQAIBMLGUGGV-RHSMWYFYSA-N 2 0 305.422 3.367 20 5 DGBDRP Cc1cc(N2CCC([C@@H](C)[NH3+])CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261649157 432438751 /nfs/dbraw/zinc/43/87/51/432438751.db2.gz FPDPBONJQWUIMT-GFCCVEGCSA-N 2 0 314.389 3.015 20 5 DGBDRP C[C@H](NCc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185701744 432526244 /nfs/dbraw/zinc/52/62/44/432526244.db2.gz GDNMASZEYPHWQA-HOCLYGCPSA-N 2 0 317.433 3.337 20 5 DGBDRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414875700 433894803 /nfs/dbraw/zinc/89/48/03/433894803.db2.gz KIBJXCZKNVVBFS-NSHDSACASA-N 2 0 305.403 3.008 20 5 DGBDRP O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000422785076 434001098 /nfs/dbraw/zinc/00/10/98/434001098.db2.gz JHHUHLCILQAIBL-GVDBMIGSSA-N 2 0 317.433 3.038 20 5 DGBDRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000423472214 434441276 /nfs/dbraw/zinc/44/12/76/434441276.db2.gz MYXSFDXXAZLEMI-KBRIMQKVSA-N 2 0 317.433 3.023 20 5 DGBDRP CC(C)(C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000360181233 434541319 /nfs/dbraw/zinc/54/13/19/434541319.db2.gz PXQRQTSDXIKKET-VQHVLOKHSA-N 2 0 317.433 3.320 20 5 DGBDRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513789842 435401370 /nfs/dbraw/zinc/40/13/70/435401370.db2.gz ODJUVBBCKAAJHC-VYDXJSESSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000564971319 315216241 /nfs/dbraw/zinc/21/62/41/315216241.db2.gz XCYSXQQSYQBGBB-CQSZACIVSA-N 2 0 313.401 3.164 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000574899339 316013590 /nfs/dbraw/zinc/01/35/90/316013590.db2.gz HPTAYGKZNKSGQH-CQSZACIVSA-N 2 0 305.422 3.428 20 5 DGBDRP CCC[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423257825 528221027 /nfs/dbraw/zinc/22/10/27/528221027.db2.gz KZAVLTXCEHRWEY-YOEHRIQHSA-N 2 0 305.422 3.415 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423257758 528607459 /nfs/dbraw/zinc/60/74/59/528607459.db2.gz KWWAJIWZKBJNSJ-KBPBESRZSA-N 2 0 321.421 3.034 20 5 DGBDRP [NH3+]CCC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000925632107 618515537 /nfs/dbraw/zinc/51/55/37/618515537.db2.gz ZXGSJVHUWYTBNB-SFHVURJKSA-N 2 0 313.401 3.207 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21)c1ccccc1[N+](=O)[O-] ZINC000903244873 619743541 /nfs/dbraw/zinc/74/35/41/619743541.db2.gz FWBAFUCHHCXDFS-DZUCGIPZSA-N 2 0 317.433 3.161 20 5 DGBDRP CC(C)([NH3+])CC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000903940003 619841131 /nfs/dbraw/zinc/84/11/31/619841131.db2.gz SRVOBHKBKYNPOK-DZGCQCFKSA-N 2 0 305.422 3.023 20 5 DGBDRP C[C@@H]([NH2+]Cc1cc2c(s1)CC[NH2+]C2)c1ccc([N+](=O)[O-])cc1 ZINC000903987832 619852521 /nfs/dbraw/zinc/85/25/21/619852521.db2.gz KVCWPDXGGINIES-LLVKDONJSA-N 2 0 317.414 3.153 20 5 DGBDRP CC(C)[NH+]1CCC(CC[NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000865715086 621982078 /nfs/dbraw/zinc/98/20/78/621982078.db2.gz IYKLPUKUWPOIHD-UHFFFAOYSA-N 2 0 305.422 3.195 20 5 DGBDRP C[NH+](C)C1(C)CCC([NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000866518042 622131354 /nfs/dbraw/zinc/13/13/54/622131354.db2.gz RMZBOJPJTSAZQF-MNQCNDSGSA-N 2 0 317.433 3.435 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000873101621 623036489 /nfs/dbraw/zinc/03/64/89/623036489.db2.gz BRIDKNMPSAMBSV-UHFFFAOYSA-N 2 0 305.422 3.033 20 5 DGBDRP Cc1ccc(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000873232775 623085752 /nfs/dbraw/zinc/08/57/52/623085752.db2.gz LKAYHMJHSONKBR-QGZVFWFLSA-N 2 0 317.433 3.305 20 5 DGBDRP Cc1ccc(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000873232774 623085958 /nfs/dbraw/zinc/08/59/58/623085958.db2.gz LKAYHMJHSONKBR-KRWDZBQOSA-N 2 0 317.433 3.305 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000873270799 623099577 /nfs/dbraw/zinc/09/95/77/623099577.db2.gz AJIVPCFODPNXES-QWHCGFSZSA-N 2 0 321.421 3.032 20 5 DGBDRP C[NH+]1CCC2(CC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)CC1 ZINC000878865934 624375975 /nfs/dbraw/zinc/37/59/75/624375975.db2.gz FSVLQBIVQWKSPD-UHFFFAOYSA-N 2 0 323.824 3.166 20 5 DGBDRP CC[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000925840691 627804478 /nfs/dbraw/zinc/80/44/78/627804478.db2.gz KHXFZYIUWZWABS-BRWVUGGUSA-N 2 0 303.406 3.168 20 5 DGBDRP C[C@@H]1CC2(C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl)CC[NH2+]CC2 ZINC000818340394 628015826 /nfs/dbraw/zinc/01/58/26/628015826.db2.gz LSXFUMLXCUXYKV-GFCCVEGCSA-N 2 0 323.824 3.212 20 5 DGBDRP C[N@H+](CCCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC1 ZINC000835063953 629842262 /nfs/dbraw/zinc/84/22/62/629842262.db2.gz SDGDXXJBDWNRGI-UHFFFAOYSA-N 2 0 311.813 3.212 20 5 DGBDRP [NH3+]CC1(O)CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000841108271 630408956 /nfs/dbraw/zinc/40/89/56/630408956.db2.gz SOTSYDMOPZIJEP-UHFFFAOYSA-N 2 0 320.436 3.279 20 5 DGBDRP C[C@@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1CC[NH3+] ZINC000844902880 630972992 /nfs/dbraw/zinc/97/29/92/630972992.db2.gz WEIZXEJAINZOLD-ABAIWWIYSA-N 2 0 311.813 3.198 20 5 DGBDRP C[NH+]1CCC2(CCC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)CC1 ZINC000852006985 632538171 /nfs/dbraw/zinc/53/81/71/632538171.db2.gz HPFUZUOLRLTUEZ-UHFFFAOYSA-N 2 0 321.396 3.042 20 5 DGBDRP C[NH+](C)CCCC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000179703462 659938722 /nfs/dbraw/zinc/93/87/22/659938722.db2.gz SFVQPBXQWHVXFB-UHFFFAOYSA-N 2 0 323.412 3.288 20 5 DGBDRP Cc1ccc(C[NH+]2CCC3(CCC[C@@H]3C[NH3+])CC2)cc1[N+](=O)[O-] ZINC001579692296 1191986996 /nfs/dbraw/zinc/98/69/96/1191986996.db2.gz XNDNFZWPZFOAON-MRXNPFEDSA-N 2 0 317.433 3.244 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC001580419766 1192025829 /nfs/dbraw/zinc/02/58/29/1192025829.db2.gz LITAYYSAKDHIBF-HJWJTTGWSA-N 2 0 317.433 3.166 20 5 DGBDRP [NH3+]CCN1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC001209976184 1081856502 /nfs/dbraw/zinc/85/65/02/1081856502.db2.gz GHXAGTWVPRRVTL-UHFFFAOYSA-N 2 0 319.452 3.069 20 5 DGBDRP C[C@H]([NH3+])c1ccc2c(ccn2-c2cc3c(cc2[N+](=O)[O-])C[NH2+]C3)c1 ZINC001162909863 1090020132 /nfs/dbraw/zinc/02/01/32/1090020132.db2.gz ZRYYNBWDPOQCLO-NSHDSACASA-N 2 0 322.368 3.162 20 5 DGBDRP C[N@H+](C1CCC([NH3+])CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899569 1097267392 /nfs/dbraw/zinc/26/73/92/1097267392.db2.gz APSLUNRWVQARAN-CGZBRXJRSA-N 2 0 317.433 3.044 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC001173223958 1097373885 /nfs/dbraw/zinc/37/38/85/1097373885.db2.gz CHIOEIZMPXYQER-ODIFPOPNSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCCC12CC[NH2+]CC2 ZINC001246646037 1104644325 /nfs/dbraw/zinc/64/43/25/1104644325.db2.gz GIAVBYLSGGYDAV-HNNXBMFYSA-N 2 0 317.433 3.134 20 5 DGBDRP CCCC[N@H+](C)CCC[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC001254534731 1106095867 /nfs/dbraw/zinc/09/58/67/1106095867.db2.gz CDNKDNYXWFNGLD-HNNXBMFYSA-N 2 0 307.438 3.237 20 5 DGBDRP CC(C)[N@H+]([C@@H]1Cc2ccc([N+](=O)[O-])cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001254588170 1106109285 /nfs/dbraw/zinc/10/92/85/1106109285.db2.gz VTUWMGARKYPABF-JFIYKMOQSA-N 2 0 317.433 3.042 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@@H]1N(C)C ZINC001319201282 1108362732 /nfs/dbraw/zinc/36/27/32/1108362732.db2.gz OPZZQNJNVKGQNG-KYJSFNMBSA-N 2 0 319.449 3.378 20 5 DGBDRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000423547765 529661038 /nfs/dbraw/zinc/66/10/38/529661038.db2.gz QDWQYMCNXPXKGQ-MPTYRVRUSA-N 2 0 303.406 3.024 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000415013567 237006938 /nfs/dbraw/zinc/00/69/38/237006938.db2.gz YLTMKLLNBRLIKN-IIAWOOMASA-N 2 0 305.422 3.023 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[NH+]1CCCC1 ZINC000344796742 254306680 /nfs/dbraw/zinc/30/66/80/254306680.db2.gz VJFQCORWISAVSP-NTCAYCPXSA-N 2 0 303.406 3.074 20 5 DGBDRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595405326 400140659 /nfs/dbraw/zinc/14/06/59/400140659.db2.gz VZKXDWYSTCTOCC-UHFFFAOYSA-N 2 0 323.412 3.288 20 5 DGBDRP CC1(C)C[C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2cc([N+](=O)[O-])ccc21 ZINC000591578357 400541713 /nfs/dbraw/zinc/54/17/13/400541713.db2.gz WGXXGQVOFHWZEV-MLGOLLRUSA-N 2 0 303.406 3.049 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@@H]2CC23CC[NH2+]CC3)c2cc([N+](=O)[O-])ccc21 ZINC000591581818 400542760 /nfs/dbraw/zinc/54/27/60/400542760.db2.gz WUCWPSFBCJBZMS-JKSUJKDBSA-N 2 0 315.417 3.049 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000269006179 432151302 /nfs/dbraw/zinc/15/13/02/432151302.db2.gz QNERRHXCWASOBY-IIAWOOMASA-N 2 0 303.406 3.072 20 5 DGBDRP [NH3+]C[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000347060169 264149745 /nfs/dbraw/zinc/14/97/45/264149745.db2.gz XOBMCCMMDVEWNW-CYBMUJFWSA-N 2 0 315.373 3.026 20 5 DGBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417331959 276212324 /nfs/dbraw/zinc/21/23/24/276212324.db2.gz WSFYCZAKVHKGCX-KBXCAEBGSA-N 2 0 317.433 3.294 20 5 DGBDRP CC(C)c1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000093089004 431913576 /nfs/dbraw/zinc/91/35/76/431913576.db2.gz SJJNJLPKAINCHQ-UHFFFAOYSA-N 2 0 319.449 3.492 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]CCC2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000125377012 431923268 /nfs/dbraw/zinc/92/32/68/431923268.db2.gz QJLQWIGQWNEZTQ-CQSZACIVSA-N 2 0 305.422 3.286 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000271353482 432379553 /nfs/dbraw/zinc/37/95/53/432379553.db2.gz YUSOYPDUHVAJPW-CPUCHLNUSA-N 2 0 314.389 3.435 20 5 DGBDRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192932828 432430722 /nfs/dbraw/zinc/43/07/22/432430722.db2.gz LFZVMUDPNBYCSS-IIDMSEBBSA-N 2 0 317.433 3.435 20 5 DGBDRP Cc1cc(N2CCC([C@H](C)[NH3+])CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261649162 432439669 /nfs/dbraw/zinc/43/96/69/432439669.db2.gz FPDPBONJQWUIMT-LBPRGKRZSA-N 2 0 314.389 3.015 20 5 DGBDRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000230147904 432724354 /nfs/dbraw/zinc/72/43/54/432724354.db2.gz WWVDWHMZMFQSLY-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP CN1CCC([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000279044321 432929546 /nfs/dbraw/zinc/92/95/46/432929546.db2.gz JOJJUCOEBRZIEJ-MRXNPFEDSA-N 2 0 303.406 3.001 20 5 DGBDRP C[N@H+](CCCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000453396454 433154425 /nfs/dbraw/zinc/15/44/25/433154425.db2.gz IWUQMOZWPLXOBW-GOSISDBHSA-N 2 0 317.433 3.436 20 5 DGBDRP C[N@@H+]1CC[C@@H]2[C@@H](CCCN2C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000290574185 433101669 /nfs/dbraw/zinc/10/16/69/433101669.db2.gz UAKAMMGDWAIGKK-APRRPJGKSA-N 2 0 315.417 3.024 20 5 DGBDRP O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420322429 433164183 /nfs/dbraw/zinc/16/41/83/433164183.db2.gz FCYVHTWCIBPEDQ-CHWSQXEVSA-N 2 0 323.824 3.070 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000449063939 433721831 /nfs/dbraw/zinc/72/18/31/433721831.db2.gz RZZYNCDMMXLGKR-HZPDHXFCSA-N 2 0 319.449 3.380 20 5 DGBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414689693 433792313 /nfs/dbraw/zinc/79/23/13/433792313.db2.gz LVCOLRTTXYVQSM-GDBMZVCRSA-N 2 0 305.422 3.193 20 5 DGBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284182742 433856042 /nfs/dbraw/zinc/85/60/42/433856042.db2.gz RCUXYNALHSWIMZ-KGLIPLIRSA-N 2 0 322.453 3.338 20 5 DGBDRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000414910442 433912235 /nfs/dbraw/zinc/91/22/35/433912235.db2.gz CVDZWDHZEPFCKU-KGLIPLIRSA-N 2 0 315.373 3.214 20 5 DGBDRP CCC([NH3+])(CC)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000423289059 434346838 /nfs/dbraw/zinc/34/68/38/434346838.db2.gz VYRCGZBYGOROFY-OAHLLOKOSA-N 2 0 305.422 3.023 20 5 DGBDRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000423290787 434346923 /nfs/dbraw/zinc/34/69/23/434346923.db2.gz FLWDLGUMRNKJCW-KBPBESRZSA-N 2 0 313.401 3.335 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])cc1[N+](=O)[O-] ZINC000423418813 434414248 /nfs/dbraw/zinc/41/42/48/434414248.db2.gz AFUQGUIJNNKLIQ-STQMWFEESA-N 2 0 309.410 3.162 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000423426057 434421504 /nfs/dbraw/zinc/42/15/04/434421504.db2.gz OXRRRRSEZYHJTR-HBUWYVDXSA-N 2 0 317.433 3.327 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000423514478 434471923 /nfs/dbraw/zinc/47/19/23/434471923.db2.gz SGGWCYZEVHZDKA-MKBNYLNASA-N 2 0 303.406 3.034 20 5 DGBDRP Cc1ccc(CN2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000354077922 434606069 /nfs/dbraw/zinc/60/60/69/434606069.db2.gz KNIZUFASJSAXRL-QGZVFWFLSA-N 2 0 317.433 3.067 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424379933 434715812 /nfs/dbraw/zinc/71/58/12/434715812.db2.gz WEIFXBDALYETOW-BFHYXJOUSA-N 2 0 323.462 3.325 20 5 DGBDRP C[N@H+](CCC[NH3+])Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000564968846 315215648 /nfs/dbraw/zinc/21/56/48/315215648.db2.gz JEHCDJKEWCFMMI-UHFFFAOYSA-N 2 0 305.403 3.104 20 5 DGBDRP C[N@H+](CCC[NH3+])Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000575045369 316027373 /nfs/dbraw/zinc/02/73/73/316027373.db2.gz BHMHQROMRBURKM-UHFFFAOYSA-N 2 0 305.403 3.104 20 5 DGBDRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000415025569 533869884 /nfs/dbraw/zinc/86/98/84/533869884.db2.gz REOZERPHGCBVMW-GFCCVEGCSA-N 2 0 303.362 3.072 20 5 DGBDRP CCC[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423257820 528221121 /nfs/dbraw/zinc/22/11/21/528221121.db2.gz KZAVLTXCEHRWEY-PBHICJAKSA-N 2 0 305.422 3.415 20 5 DGBDRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543774 536389837 /nfs/dbraw/zinc/38/98/37/536389837.db2.gz CRQLBOKWMBNBTN-IRXDYDNUSA-N 2 0 317.433 3.259 20 5 DGBDRP O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000419694700 546804695 /nfs/dbraw/zinc/80/46/95/546804695.db2.gz QNOCMRPWCUOUBW-HUUCEWRRSA-N 2 0 323.824 3.007 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[C@H](n2ccnc2)C1 ZINC000746666499 575467533 /nfs/dbraw/zinc/46/75/33/575467533.db2.gz OOYFMOLCQALCPG-AWEZNQCLSA-N 2 0 320.780 3.282 20 5 DGBDRP Cc1c(C[NH+]2CCC(C(C)(C)C[NH3+])CC2)cccc1[N+](=O)[O-] ZINC000903790441 619811031 /nfs/dbraw/zinc/81/10/31/619811031.db2.gz JASJPMPZVJILMQ-UHFFFAOYSA-N 2 0 305.422 3.100 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[N@H+](CC1C[C@H]2CC[C@@H](C1)[NH2+]2)C1CC1 ZINC000903883082 619828149 /nfs/dbraw/zinc/82/81/49/619828149.db2.gz FHBOCRJHUCNSQF-VHRNVKJDSA-N 2 0 315.417 3.090 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)cc1[N+](=O)[O-] ZINC000904412692 619920972 /nfs/dbraw/zinc/92/09/72/619920972.db2.gz WJQFCIPTVWPDNW-HIFRSBDPSA-N 2 0 305.422 3.135 20 5 DGBDRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000922848044 621108412 /nfs/dbraw/zinc/10/84/12/621108412.db2.gz KWVZFVPUCQFGFL-UHFFFAOYSA-N 2 0 303.406 3.091 20 5 DGBDRP C[N@@H+]1CCCC[C@H](CNCc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000858246072 621167951 /nfs/dbraw/zinc/16/79/51/621167951.db2.gz TXMDBOPHERMDTQ-GFCCVEGCSA-N 2 0 311.813 3.070 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000873063234 623028996 /nfs/dbraw/zinc/02/89/96/623028996.db2.gz ODLYNXPFTKZSFU-MQVJKMGUSA-N 2 0 317.433 3.317 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000873130253 623042753 /nfs/dbraw/zinc/04/27/53/623042753.db2.gz CGDDNPPJMCEKBD-OAHLLOKOSA-N 2 0 305.422 3.033 20 5 DGBDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cc(F)ccc1[N+](=O)[O-])CC2 ZINC000879247933 624464106 /nfs/dbraw/zinc/46/41/06/624464106.db2.gz HDVBDTQHBVUFCA-UHFFFAOYSA-N 2 0 321.396 3.042 20 5 DGBDRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000925803229 627797533 /nfs/dbraw/zinc/79/75/33/627797533.db2.gz OCJIISSEKJGXFR-XNJGSVPQSA-N 2 0 317.433 3.152 20 5 DGBDRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000925881448 627810993 /nfs/dbraw/zinc/81/09/93/627810993.db2.gz BCFJDDKACJNRNP-XOSAIJSUSA-N 2 0 317.433 3.023 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925882293 627812035 /nfs/dbraw/zinc/81/20/35/627812035.db2.gz KFOWGOPFHSPQJJ-HZSPNIEDSA-N 2 0 323.462 3.183 20 5 DGBDRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817963510 627977002 /nfs/dbraw/zinc/97/70/02/627977002.db2.gz SQGPUOUDSUFIPD-RYUDHWBXSA-N 2 0 314.389 3.048 20 5 DGBDRP C[NH2+]CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000070189876 660040752 /nfs/dbraw/zinc/04/07/52/660040752.db2.gz HGVMKIXKJKVAER-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP CN(CCc1ccccc1[N+](=O)[O-])C[C@@H]([NH3+])CCC(C)(C)C ZINC001578481448 1191945517 /nfs/dbraw/zinc/94/55/17/1191945517.db2.gz VNXRUWIJRSNJSA-HNNXBMFYSA-N 2 0 307.438 3.223 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1C[C@@H]2CCCC[C@@]2(C[NH3+])C1 ZINC001579734923 1191990067 /nfs/dbraw/zinc/99/00/67/1191990067.db2.gz SZTLKAOYJZAUKM-MAUKXSAKSA-N 2 0 317.433 3.163 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H](C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC001580331261 1192021780 /nfs/dbraw/zinc/02/17/80/1192021780.db2.gz IJAQAWLFKCVYJX-SHTZXODSSA-N 2 0 317.433 3.324 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCC1CC[NH+](C)CC1 ZINC001352175567 1180306230 /nfs/dbraw/zinc/30/62/30/1180306230.db2.gz MBEMJFFXGGOZAM-UHFFFAOYSA-N 2 0 305.422 3.033 20 5 DGBDRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC001576151927 1191533668 /nfs/dbraw/zinc/53/36/68/1191533668.db2.gz DWYUNMVSIBFDQD-TTZDDIAXSA-N 2 0 305.422 3.021 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCCC[C@@]2(C[NH3+])C1 ZINC001576315829 1191560219 /nfs/dbraw/zinc/56/02/19/1191560219.db2.gz MWJCPQVUPAKYSK-JKIFEVAISA-N 2 0 303.406 3.107 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC001651793940 1195509839 /nfs/dbraw/zinc/50/98/39/1195509839.db2.gz DDPXCIWJFCWABO-UHFFFAOYSA-N 2 0 319.449 3.375 20 5 DGBDRP CC[NH+]1CCC(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC001658258980 1196230676 /nfs/dbraw/zinc/23/06/76/1196230676.db2.gz KVOSXMPDLZPLQO-UHFFFAOYSA-N 2 0 317.433 3.291 20 5 DGBDRP C[C@@H]([NH3+])c1ccc2c(ccn2-c2cc3c(cc2[N+](=O)[O-])C[NH2+]C3)c1 ZINC001162909862 1090019058 /nfs/dbraw/zinc/01/90/58/1090019058.db2.gz ZRYYNBWDPOQCLO-LLVKDONJSA-N 2 0 322.368 3.162 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C2CCCCC2)CC1 ZINC001168998325 1092479465 /nfs/dbraw/zinc/47/94/65/1092479465.db2.gz LHMKKGZDHUHXDP-LAQRGFTBSA-N 2 0 323.481 3.336 20 5 DGBDRP C[NH+](C)CCC(C)(C)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911324 1097292158 /nfs/dbraw/zinc/29/21/58/1097292158.db2.gz INPRTDDXITYJET-MRXNPFEDSA-N 2 0 319.449 3.162 20 5 DGBDRP CC[C@@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC001178204623 1098746723 /nfs/dbraw/zinc/74/67/23/1098746723.db2.gz KUWSZCGKNSCPLJ-HLLBOEOZSA-N 2 0 303.406 3.262 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246138521 1104403320 /nfs/dbraw/zinc/40/33/20/1104403320.db2.gz YOGQDCOXAQSNCI-ZBFHGGJFSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1Cc2ccc([N+](=O)[O-])cc2C1)CC(C)(C)CC[NH3+] ZINC001254580605 1106108352 /nfs/dbraw/zinc/10/83/52/1106108352.db2.gz HATGAEKUGAZACV-XJKSGUPXSA-N 2 0 319.449 3.053 20 5 DGBDRP [NH3+]CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000415047630 237031919 /nfs/dbraw/zinc/03/19/19/237031919.db2.gz FELSTQRUDNOUNI-KRWDZBQOSA-N 2 0 317.364 3.304 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000449204131 240065806 /nfs/dbraw/zinc/06/58/06/240065806.db2.gz MEMHJPUNGQDJND-UQPPLGOBSA-N 2 0 319.449 3.236 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[NH+]1CCCC1 ZINC000344796744 254306193 /nfs/dbraw/zinc/30/61/93/254306193.db2.gz VJFQCORWISAVSP-QINSGFPZSA-N 2 0 303.406 3.074 20 5 DGBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000596653814 400473526 /nfs/dbraw/zinc/47/35/26/400473526.db2.gz LSFHRKKCTGYBKT-CVEARBPZSA-N 2 0 305.422 3.280 20 5 DGBDRP CCC[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000591579378 400542903 /nfs/dbraw/zinc/54/29/03/400542903.db2.gz UNKLRDSENACBNU-HZPDHXFCSA-N 2 0 303.406 3.168 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[N@H+](CCCC1CC[NH2+]CC1)C1CC1 ZINC000592493896 400658334 /nfs/dbraw/zinc/65/83/34/400658334.db2.gz HSHIRKGSTVTXAS-UHFFFAOYSA-N 2 0 317.433 3.339 20 5 DGBDRP Cc1ccc([C@H](C)NC[C@@H]2CCCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000599069290 400948099 /nfs/dbraw/zinc/94/80/99/400948099.db2.gz FBUASXQCMCUMCV-GJZGRUSLSA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCCC[N@H+](C)C1 ZINC000599069310 400948363 /nfs/dbraw/zinc/94/83/63/400948363.db2.gz FZGOJRYROVDBEG-CABCVRRESA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000593733976 400900519 /nfs/dbraw/zinc/90/05/19/400900519.db2.gz PULSOORDLKZPOF-KEYYUXOJSA-N 2 0 303.406 3.025 20 5 DGBDRP CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC(C)(C)[NH3+] ZINC000594735280 401164213 /nfs/dbraw/zinc/16/42/13/401164213.db2.gz KDLKRIRTMJTOLG-UHFFFAOYSA-N 2 0 319.430 3.492 20 5 DGBDRP Cc1cc(N[C@H](C)CC[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302199690 230156774 /nfs/dbraw/zinc/15/67/74/230156774.db2.gz UQBGINDITAXQMJ-LLVKDONJSA-N 2 0 302.378 3.204 20 5 DGBDRP C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000346692954 264080726 /nfs/dbraw/zinc/08/07/26/264080726.db2.gz KACPPNIGXFBDAO-OCCSQVGLSA-N 2 0 315.373 3.024 20 5 DGBDRP [NH3+]C[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000347091342 264155041 /nfs/dbraw/zinc/15/50/41/264155041.db2.gz FDJZLNHCTQNSPP-CYBMUJFWSA-N 2 0 315.373 3.026 20 5 DGBDRP C[NH2+]CC1CC[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000347110857 264158194 /nfs/dbraw/zinc/15/81/94/264158194.db2.gz OBUHYGJMVVDKRB-UHFFFAOYSA-N 2 0 305.422 3.150 20 5 DGBDRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423444021 274208375 /nfs/dbraw/zinc/20/83/75/274208375.db2.gz WDGNOCDLONROID-LRDDRELGSA-N 2 0 305.422 3.424 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CCC2 ZINC000192657944 275037898 /nfs/dbraw/zinc/03/78/98/275037898.db2.gz QWAJBGVOHCTSDF-UGSOOPFHSA-N 2 0 315.417 3.046 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000414812960 280605859 /nfs/dbraw/zinc/60/58/59/280605859.db2.gz XUCRWNYVNXZMSZ-HOCLYGCPSA-N 2 0 305.422 3.325 20 5 DGBDRP Cc1cc(N2CCC[C@H](CC[NH3+])C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261967468 432464785 /nfs/dbraw/zinc/46/47/85/432464785.db2.gz YNDPSNLSPNLFLP-CYBMUJFWSA-N 2 0 314.389 3.017 20 5 DGBDRP C[C@@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000156427667 432596402 /nfs/dbraw/zinc/59/64/02/432596402.db2.gz HLYKFCPFXMETMU-WBMJQRKESA-N 2 0 318.352 3.014 20 5 DGBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279214405 432946370 /nfs/dbraw/zinc/94/63/70/432946370.db2.gz YNSDUPQWDZYPLB-GUYCJALGSA-N 2 0 317.433 3.249 20 5 DGBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279214403 432946626 /nfs/dbraw/zinc/94/66/26/432946626.db2.gz YNSDUPQWDZYPLB-DYVFJYSZSA-N 2 0 317.433 3.249 20 5 DGBDRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000278879705 432911653 /nfs/dbraw/zinc/91/16/53/432911653.db2.gz XRUCQBHAFFPSND-QGZVFWFLSA-N 2 0 317.433 3.294 20 5 DGBDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000414187222 433448899 /nfs/dbraw/zinc/44/88/99/433448899.db2.gz PRELIFLWUBFSJZ-RDTXWAMCSA-N 2 0 317.433 3.294 20 5 DGBDRP [NH3+]CCCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414901174 433908127 /nfs/dbraw/zinc/90/81/27/433908127.db2.gz INCWSDBCQYCKLD-UHFFFAOYSA-N 2 0 305.403 3.152 20 5 DGBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000414910446 433913708 /nfs/dbraw/zinc/91/37/08/433913708.db2.gz CVDZWDHZEPFCKU-ZIAGYGMSSA-N 2 0 315.373 3.214 20 5 DGBDRP CC(C)c1ccc(C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000414989499 433956397 /nfs/dbraw/zinc/95/63/97/433956397.db2.gz HFHYWUAPVUURJS-HIFRSBDPSA-N 2 0 305.422 3.325 20 5 DGBDRP C[C@H]([NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[NH2+]C1 ZINC000423221523 434294559 /nfs/dbraw/zinc/29/45/59/434294559.db2.gz WXMDDNVRGAWLQZ-AHIWAGSCSA-N 2 0 317.433 3.295 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423257760 434317330 /nfs/dbraw/zinc/31/73/30/434317330.db2.gz KWWAJIWZKBJNSJ-KGLIPLIRSA-N 2 0 321.421 3.034 20 5 DGBDRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000517373095 294671296 /nfs/dbraw/zinc/67/12/96/294671296.db2.gz AWMULTOCPAPJNV-SFHVURJKSA-N 2 0 311.385 3.221 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cc1[N+](=O)[O-] ZINC000423431938 434419518 /nfs/dbraw/zinc/41/95/18/434419518.db2.gz VVBKKSIWXDTRES-RBSFLKMASA-N 2 0 305.422 3.319 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)CCC[NH3+] ZINC000423466220 434435236 /nfs/dbraw/zinc/43/52/36/434435236.db2.gz WVHGLXWCTJGOSJ-OLZOCXBDSA-N 2 0 311.451 3.183 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CCC[NH3+] ZINC000423466222 434435371 /nfs/dbraw/zinc/43/53/71/434435371.db2.gz WVHGLXWCTJGOSJ-STQMWFEESA-N 2 0 311.451 3.183 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)CCC[NH3+] ZINC000423466219 434437817 /nfs/dbraw/zinc/43/78/17/434437817.db2.gz WVHGLXWCTJGOSJ-CHWSQXEVSA-N 2 0 311.451 3.183 20 5 DGBDRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000423472215 295311803 /nfs/dbraw/zinc/31/18/03/295311803.db2.gz MYXSFDXXAZLEMI-XKQJLSEDSA-N 2 0 317.433 3.023 20 5 DGBDRP CC(C)c1ccc(CN(C)[C@H]2CC[N@H+](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000573486988 434902816 /nfs/dbraw/zinc/90/28/16/434902816.db2.gz DIIXBUDLWRORBA-PBHICJAKSA-N 2 0 319.449 3.490 20 5 DGBDRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000536867843 435415974 /nfs/dbraw/zinc/41/59/74/435415974.db2.gz FJIOSDRFIUNMBH-RKVPGOIHSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000519155156 435672256 /nfs/dbraw/zinc/67/22/56/435672256.db2.gz AICLJCRQGBNUMJ-RYUDHWBXSA-N 2 0 303.362 3.070 20 5 DGBDRP C[C@H](CCN[C@@H]1CCc2c1cccc2[N+](=O)[O-])[NH+]1CCCCC1 ZINC000576359692 316121996 /nfs/dbraw/zinc/12/19/96/316121996.db2.gz JUGWVVCOFXXTSV-RHSMWYFYSA-N 2 0 317.433 3.436 20 5 DGBDRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000415018106 533874087 /nfs/dbraw/zinc/87/40/87/533874087.db2.gz GJLGRHOFMOLDOU-IJEWVQPXSA-N 2 0 305.422 3.023 20 5 DGBDRP C[C@H](C[NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000897466498 619130990 /nfs/dbraw/zinc/13/09/90/619130990.db2.gz VXPQULGOYXHXEN-CQSZACIVSA-N 2 0 317.433 3.162 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000903790318 619811046 /nfs/dbraw/zinc/81/10/46/619811046.db2.gz BOPRVWNHBLXPCN-ZDUSSCGKSA-N 2 0 305.422 3.353 20 5 DGBDRP CC(C)([NH3+])CC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000903940004 619840988 /nfs/dbraw/zinc/84/09/88/619840988.db2.gz SRVOBHKBKYNPOK-HIFRSBDPSA-N 2 0 305.422 3.023 20 5 DGBDRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000922848811 621108505 /nfs/dbraw/zinc/10/85/05/621108505.db2.gz YEHMUGYDDUSHOV-UHFFFAOYSA-N 2 0 303.406 3.091 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1[N+](=O)[O-] ZINC000923376700 621179891 /nfs/dbraw/zinc/17/98/91/621179891.db2.gz DTTJVWKSRSTBPP-YTTRVJOFSA-N 2 0 317.433 3.475 20 5 DGBDRP CCC[NH+]1CCC([NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866218808 622068438 /nfs/dbraw/zinc/06/84/38/622068438.db2.gz YLZBPAJYVNKEMW-CYBMUJFWSA-N 2 0 323.412 3.129 20 5 DGBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCCC[N@H+](C)C1CC1 ZINC000866368739 622104470 /nfs/dbraw/zinc/10/44/70/622104470.db2.gz GBKJQFCRWFAHOZ-CYBMUJFWSA-N 2 0 323.412 3.129 20 5 DGBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866704657 622158332 /nfs/dbraw/zinc/15/83/32/622158332.db2.gz PYJRNJONWACTPX-CXAGYDPISA-N 2 0 305.422 3.353 20 5 DGBDRP Cc1c(C[NH2+]C2CCC(C)([NH+](C)C)CC2)cccc1[N+](=O)[O-] ZINC000873149825 623050092 /nfs/dbraw/zinc/05/00/92/623050092.db2.gz UTKSWTSXILOARS-UHFFFAOYSA-N 2 0 305.422 3.256 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1C[C@H]3CC[C@@H](C1)[NH2+]3)CCC2 ZINC000873261104 623095916 /nfs/dbraw/zinc/09/59/16/623095916.db2.gz LFWMMYCNDHGMTE-OGIUKLMXSA-N 2 0 315.417 3.092 20 5 DGBDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc([N+](=O)[O-])cc1F)CC2 ZINC000877684507 623990997 /nfs/dbraw/zinc/99/09/97/623990997.db2.gz PKGHRPRHIGHKAT-UHFFFAOYSA-N 2 0 321.396 3.042 20 5 DGBDRP C[C@H](NCCC[N@@H+]1CCCC[C@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815554795 627683953 /nfs/dbraw/zinc/68/39/53/627683953.db2.gz IZESTIDXCLBAJB-KGLIPLIRSA-N 2 0 320.437 3.092 20 5 DGBDRP CC[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000925840692 627804329 /nfs/dbraw/zinc/80/43/29/627804329.db2.gz KHXFZYIUWZWABS-GVDBMIGSSA-N 2 0 303.406 3.168 20 5 DGBDRP CC[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cccc([N+](=O)[O-])c1 ZINC000817949978 627972648 /nfs/dbraw/zinc/97/26/48/627972648.db2.gz VMINUACIQSBCQQ-SFHVURJKSA-N 2 0 313.401 3.337 20 5 DGBDRP CC[NH+]1CCC(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC001461872732 1182867953 /nfs/dbraw/zinc/86/79/53/1182867953.db2.gz SSCUBKDHOPAGRX-UHFFFAOYSA-N 2 0 317.433 3.291 20 5 DGBDRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC001576384103 1191577374 /nfs/dbraw/zinc/57/73/74/1191577374.db2.gz UAAIWXQKOBVLCZ-SDNTUTLCSA-N 2 0 317.433 3.021 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3c[nH+]cn3c2)cc1Cl ZINC001652634720 1195630118 /nfs/dbraw/zinc/63/01/18/1195630118.db2.gz AZODFMOMJDLWRK-UHFFFAOYSA-N 2 0 316.748 3.186 20 5 DGBDRP CC[N@@H+]1CC[C@@H](N(C)Cc2c(C)ccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC001663596024 1196910357 /nfs/dbraw/zinc/91/03/57/1196910357.db2.gz VUEPURWVOCGLFI-WMLDXEAASA-N 2 0 319.449 3.374 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1NC[C@H]1CCC[NH2+]C[C@H]1C ZINC001162456338 1089741704 /nfs/dbraw/zinc/74/17/04/1089741704.db2.gz HWDJDUXFRFHXBP-IAGOWNOFSA-N 2 0 304.502 3.331 20 5 DGBDRP [NH3+][C@@H]1CC[N@H+](Cc2ccc3ccc4cccnc4c3n2)CC[C@H]1F ZINC001206188217 1091526725 /nfs/dbraw/zinc/52/67/25/1091526725.db2.gz UUQGDYPODMOERF-IAGOWNOFSA-N 2 0 324.403 3.044 20 5 DGBDRP O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](CC3CCCCC3)CC2)C1 ZINC001168993417 1092476701 /nfs/dbraw/zinc/47/67/01/1092476701.db2.gz MXLNPJSMYBTONW-SJLPKXTDSA-N 2 0 323.481 3.066 20 5 DGBDRP CC(C)C[NH+]1CCC([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173218029 1097369822 /nfs/dbraw/zinc/36/98/22/1097369822.db2.gz IRKLJKKJWRXNBF-OAHLLOKOSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1cc(CC[NH3+])c2c[nH+]ccc21 ZINC001173221971 1097371723 /nfs/dbraw/zinc/37/17/23/1097371723.db2.gz RNNSYCIHAGNZQW-CYBMUJFWSA-N 2 0 324.384 3.249 20 5 DGBDRP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC001325627231 1103085564 /nfs/dbraw/zinc/08/55/64/1103085564.db2.gz URGKJUIEKHSKNM-GFCCVEGCSA-N 2 0 319.430 3.411 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246138520 1104402834 /nfs/dbraw/zinc/40/28/34/1104402834.db2.gz YOGQDCOXAQSNCI-HOCLYGCPSA-N 2 0 317.433 3.038 20 5 DGBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000415050326 237034074 /nfs/dbraw/zinc/03/40/74/237034074.db2.gz YMMFDNVMESXOSF-OCCSQVGLSA-N 2 0 315.373 3.072 20 5 DGBDRP O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000423010050 237817143 /nfs/dbraw/zinc/81/71/43/237817143.db2.gz FRKXWBXLSVJXFH-KZNAEPCWSA-N 2 0 317.433 3.038 20 5 DGBDRP CC[NH+]1CCC(CC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449166790 240048866 /nfs/dbraw/zinc/04/88/66/240048866.db2.gz GECFGTRNTUUJBL-HNNXBMFYSA-N 2 0 319.449 3.237 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000449237114 240084696 /nfs/dbraw/zinc/08/46/96/240084696.db2.gz AQXGCJXFWLCRTP-HZPDHXFCSA-N 2 0 319.449 3.380 20 5 DGBDRP CC[C@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000171141316 432105645 /nfs/dbraw/zinc/10/56/45/432105645.db2.gz WMNQGWBTSAMJIQ-YOEHRIQHSA-N 2 0 305.422 3.367 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000470176143 533382318 /nfs/dbraw/zinc/38/23/18/533382318.db2.gz UVPVMDMGORHCIQ-PTNGSMBKSA-N 2 0 317.433 3.272 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000468654497 533409303 /nfs/dbraw/zinc/40/93/03/533409303.db2.gz YHKUJIKMLACUKA-AAGJOFLKSA-N 2 0 317.433 3.320 20 5 DGBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595901501 400290812 /nfs/dbraw/zinc/29/08/12/400290812.db2.gz XKQKUYRQZXEQIP-YOEHRIQHSA-N 2 0 317.433 3.367 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000602019718 400404821 /nfs/dbraw/zinc/40/48/21/400404821.db2.gz GLEMOPULFUOVQR-KBRIMQKVSA-N 2 0 317.433 3.023 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000591278479 400505411 /nfs/dbraw/zinc/50/54/11/400505411.db2.gz GEOOWJFVNXQSCS-XIRDDKMYSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000591282646 400506498 /nfs/dbraw/zinc/50/64/98/400506498.db2.gz JURCBXJFUKOCHM-GOEBONIOSA-N 2 0 317.433 3.180 20 5 DGBDRP CC1(C)C[C@@H]([NH2+][C@H]2CCC[NH2+]CC2)c2cc([N+](=O)[O-])ccc21 ZINC000591578355 400541058 /nfs/dbraw/zinc/54/10/58/400541058.db2.gz WGXXGQVOFHWZEV-BLLLJJGKSA-N 2 0 303.406 3.049 20 5 DGBDRP C[C@H]([NH2+]C[C@H]1CCN1C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599073496 400950729 /nfs/dbraw/zinc/95/07/29/400950729.db2.gz HBZFUGZAWQJIDI-SUMWQHHRSA-N 2 0 303.406 3.262 20 5 DGBDRP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000599072930 400951038 /nfs/dbraw/zinc/95/10/38/400951038.db2.gz COILPYSFUZLKPZ-RHSMWYFYSA-N 2 0 315.417 3.189 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000420324017 292295815 /nfs/dbraw/zinc/29/58/15/292295815.db2.gz AMDAQPVZSVTBPV-AWEZNQCLSA-N 2 0 303.406 3.040 20 5 DGBDRP [NH3+]CC1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000346679973 264078691 /nfs/dbraw/zinc/07/86/91/264078691.db2.gz BIJYEHLIMXIQFN-UHFFFAOYSA-N 2 0 315.373 3.026 20 5 DGBDRP [NH3+]CCCN(Cc1ccc([N+](=O)[O-])cc1F)CC1CCCC1 ZINC000352510067 265074326 /nfs/dbraw/zinc/07/43/26/265074326.db2.gz MHSBDWWJMGIMGM-UHFFFAOYSA-N 2 0 309.385 3.075 20 5 DGBDRP C[C@H]([NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)[C@H]1CCC[NH2+]C1 ZINC000423221524 274525091 /nfs/dbraw/zinc/52/50/91/274525091.db2.gz WXMDDNVRGAWLQZ-DCGLDWPTSA-N 2 0 317.433 3.295 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCC2 ZINC000423383706 275038497 /nfs/dbraw/zinc/03/84/97/275038497.db2.gz KPYDXLSFJMNZLZ-LJQANCHMSA-N 2 0 323.396 3.365 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000414864464 275740986 /nfs/dbraw/zinc/74/09/86/275740986.db2.gz YPVMELXUKJJOOX-ZFWWWQNUSA-N 2 0 305.422 3.196 20 5 DGBDRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000278060290 278341750 /nfs/dbraw/zinc/34/17/50/278341750.db2.gz LTKSQSHWYHZEJT-CYBMUJFWSA-N 2 0 303.406 3.120 20 5 DGBDRP Cc1cc(NCC[C@H]2CCC[NH2+]2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000262524160 280626645 /nfs/dbraw/zinc/62/66/45/280626645.db2.gz ORBUUMGKSHIDFS-GFCCVEGCSA-N 2 0 300.362 3.005 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152426979 432331790 /nfs/dbraw/zinc/33/17/90/432331790.db2.gz SQRNRFVDWRUYIO-KBPBESRZSA-N 2 0 303.406 3.038 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453592314 433222937 /nfs/dbraw/zinc/22/29/37/433222937.db2.gz DRKRLBGTIKOPPL-QINSGFPZSA-N 2 0 317.433 3.462 20 5 DGBDRP C[N@H+](CCCC[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000453592931 433224134 /nfs/dbraw/zinc/22/41/34/433224134.db2.gz FYBMQCUNVPESBT-SOFGYWHQSA-N 2 0 303.406 3.072 20 5 DGBDRP C[NH+]1CCC(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433180494 433840663 /nfs/dbraw/zinc/84/06/63/433840663.db2.gz VOGRXMYIWGINLT-QGZVFWFLSA-N 2 0 317.433 3.249 20 5 DGBDRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414878680 433898376 /nfs/dbraw/zinc/89/83/76/433898376.db2.gz OPGIHHBAIDVFHK-NSHDSACASA-N 2 0 305.403 3.008 20 5 DGBDRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC[NH2+]1 ZINC000414955893 433935534 /nfs/dbraw/zinc/93/55/34/433935534.db2.gz UWVSFLXZNJNNIH-MUIFIZLQSA-N 2 0 317.433 3.036 20 5 DGBDRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000422792660 434006513 /nfs/dbraw/zinc/00/65/13/434006513.db2.gz RHFVCGXTEZCQQK-ZBFHGGJFSA-N 2 0 305.422 3.038 20 5 DGBDRP O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000422785078 434000825 /nfs/dbraw/zinc/00/08/25/434000825.db2.gz JHHUHLCILQAIBL-YESZJQIVSA-N 2 0 317.433 3.038 20 5 DGBDRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423039439 434182516 /nfs/dbraw/zinc/18/25/16/434182516.db2.gz FLJUYYQRFJZIPK-KGLIPLIRSA-N 2 0 311.813 3.040 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])cc1[N+](=O)[O-] ZINC000423418811 434415070 /nfs/dbraw/zinc/41/50/70/434415070.db2.gz AFUQGUIJNNKLIQ-QWHCGFSZSA-N 2 0 309.410 3.162 20 5 DGBDRP [NH3+]C[C@@H](N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CCCC1 ZINC000423507238 434465241 /nfs/dbraw/zinc/46/52/41/434465241.db2.gz PVICZUAWPQZSCC-IAGOWNOFSA-N 2 0 303.406 3.079 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000560897082 435194629 /nfs/dbraw/zinc/19/46/29/435194629.db2.gz SWCZJZNRAOGQLU-HUUCEWRRSA-N 2 0 305.422 3.286 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000423434543 298392991 /nfs/dbraw/zinc/39/29/91/298392991.db2.gz OCIUAZJZCMJSOO-CZUORRHYSA-N 2 0 305.422 3.023 20 5 DGBDRP C[N@H+](CCCC[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])C1CC1 ZINC000567519795 435325667 /nfs/dbraw/zinc/32/56/67/435325667.db2.gz QRIFJYORGJPHQG-MRXNPFEDSA-N 2 0 303.406 3.046 20 5 DGBDRP Cc1ccc([C@H](C)NCC[C@@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000538278050 435490779 /nfs/dbraw/zinc/49/07/79/435490779.db2.gz JGEWMASVDSHLAB-HOCLYGCPSA-N 2 0 305.422 3.428 20 5 DGBDRP CC(C)c1ccc(C[NH+]2CCC(CC[NH3+])CC2)cc1[N+](=O)[O-] ZINC000570574478 315659239 /nfs/dbraw/zinc/65/92/39/315659239.db2.gz MCYHUBKGFKINEW-UHFFFAOYSA-N 2 0 305.422 3.279 20 5 DGBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000872054482 619099019 /nfs/dbraw/zinc/09/90/19/619099019.db2.gz XAHSVLDTVAHGCJ-GFCCVEGCSA-N 2 0 321.446 3.229 20 5 DGBDRP C[C@@H](C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000902428060 619634261 /nfs/dbraw/zinc/63/42/61/619634261.db2.gz AQVMTLDZKAEMCT-UONOGXRCSA-N 2 0 305.422 3.066 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000902428324 619634333 /nfs/dbraw/zinc/63/43/33/619634333.db2.gz BULKSIIIEWTMAI-OAUYIBNBSA-N 2 0 311.385 3.433 20 5 DGBDRP C[C@H](C[NH2+][C@H]1CCCN2CCCC[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000903245473 619743668 /nfs/dbraw/zinc/74/36/68/619743668.db2.gz MIUIXSIOAVFBHA-UWWQBHOKSA-N 2 0 317.433 3.305 20 5 DGBDRP [NH3+]CC[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000904405132 619920124 /nfs/dbraw/zinc/92/01/24/619920124.db2.gz FHQHNDUDQIBBKZ-CYBMUJFWSA-N 2 0 315.373 3.026 20 5 DGBDRP [NH3+]CCCOCC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000863650315 621693928 /nfs/dbraw/zinc/69/39/28/621693928.db2.gz QDGWLNRFAIDWRB-UHFFFAOYSA-N 2 0 308.425 3.448 20 5 DGBDRP C[NH+](C)C1(C)CCC([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000865765772 621991433 /nfs/dbraw/zinc/99/14/33/621991433.db2.gz LRXIMAHYTICISN-VURMDHGXSA-N 2 0 317.433 3.461 20 5 DGBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000866282713 622084688 /nfs/dbraw/zinc/08/46/88/622084688.db2.gz PQYPIWNZIKKCBX-WQVCFCJDSA-N 2 0 323.412 3.127 20 5 DGBDRP CC(C)[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866290420 622086163 /nfs/dbraw/zinc/08/61/63/622086163.db2.gz XPNPGFDCKHNVGN-ZDUSSCGKSA-N 2 0 323.412 3.127 20 5 DGBDRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000873222889 623080478 /nfs/dbraw/zinc/08/04/78/623080478.db2.gz DIKZVVOTCHZZNJ-XOWYPZSQSA-N 2 0 317.433 3.305 20 5 DGBDRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1[N+](=O)[O-] ZINC000873249916 623091129 /nfs/dbraw/zinc/09/11/29/623091129.db2.gz DFBLJHWBJURRPY-IXDOHACOSA-N 2 0 317.433 3.304 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000873267244 623098129 /nfs/dbraw/zinc/09/81/29/623098129.db2.gz AJIVPCFODPNXES-CHWSQXEVSA-N 2 0 321.421 3.032 20 5 DGBDRP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788504469 625200037 /nfs/dbraw/zinc/20/00/37/625200037.db2.gz RAEPSRQJHWHDKP-LLVKDONJSA-N 2 0 320.437 3.137 20 5 DGBDRP Cc1c(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cccc1[N+](=O)[O-] ZINC000925658010 627771671 /nfs/dbraw/zinc/77/16/71/627771671.db2.gz MKBUMKRDCSGJJR-QGZVFWFLSA-N 2 0 313.401 3.473 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000843125604 630616291 /nfs/dbraw/zinc/61/62/91/630616291.db2.gz YNTZGUWENLZJOP-STQMWFEESA-N 2 0 323.824 3.070 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@H]2CC[C@H](C[NH3+])CC2)cc1[N+](=O)[O-] ZINC001575854336 1191512491 /nfs/dbraw/zinc/51/24/91/1191512491.db2.gz KINHBWKWTRMUCT-CTYIDZIISA-N 2 0 305.422 3.325 20 5 DGBDRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC001576151926 1191532441 /nfs/dbraw/zinc/53/24/41/1191532441.db2.gz DWYUNMVSIBFDQD-RZLSGREXSA-N 2 0 305.422 3.021 20 5 DGBDRP C[N@H+](CCCC[NH+]1CCCCC1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001644301289 1195097803 /nfs/dbraw/zinc/09/78/03/1195097803.db2.gz BAJUMBWXSSELFD-UHFFFAOYSA-N 2 0 323.412 3.432 20 5 DGBDRP CC[NH+]1CCC(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC001658769032 1196298444 /nfs/dbraw/zinc/29/84/44/1196298444.db2.gz GRMZIWXGDJOIDM-UHFFFAOYSA-N 2 0 305.422 3.151 20 5 DGBDRP C[C@H]1CC[C@@H](C[NH3+])N1Cc1ccc2ccc3cccnc3c2n1 ZINC001205076165 1091095140 /nfs/dbraw/zinc/09/51/40/1091095140.db2.gz QEBKPNUOZHWUFE-GUYCJALGSA-N 2 0 306.413 3.095 20 5 DGBDRP CC(C)(C)C[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169000245 1092480375 /nfs/dbraw/zinc/48/03/75/1092480375.db2.gz XEWAADUMOSTXRU-VGWMRTNUSA-N 2 0 311.470 3.050 20 5 DGBDRP C[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C1CC[NH+](C2CCCCC2)CC1 ZINC001169054571 1092511416 /nfs/dbraw/zinc/51/14/16/1092511416.db2.gz MRINJYZXCNORNE-YJBOKZPZSA-N 2 0 323.481 3.161 20 5 DGBDRP CC[N@H+](CCC[NH+](C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912640 1097292459 /nfs/dbraw/zinc/29/24/59/1097292459.db2.gz KWCABTYZBIAVHN-QGZVFWFLSA-N 2 0 319.449 3.116 20 5 DGBDRP CCC[N@H+](CCC[NH+](C)C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173231150 1097377573 /nfs/dbraw/zinc/37/75/73/1097377573.db2.gz JYFQOZIMIYYAOG-HNNXBMFYSA-N 2 0 307.438 3.190 20 5 DGBDRP CC[NH+]1CCC(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC001179909715 1099256069 /nfs/dbraw/zinc/25/60/69/1099256069.db2.gz SJRIKSJMTJNJTL-UHFFFAOYSA-N 2 0 317.433 3.291 20 5 DGBDRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC001254550336 1106101211 /nfs/dbraw/zinc/10/12/11/1106101211.db2.gz HUWZARCSSSDCQK-UXLLHSPISA-N 2 0 319.449 3.234 20 5 DGBDRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254580245 1106108452 /nfs/dbraw/zinc/10/84/52/1106108452.db2.gz BPRVZIOJDPMDKP-WMLDXEAASA-N 2 0 319.449 3.162 20 5 DGBDRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254580246 1106108507 /nfs/dbraw/zinc/10/85/07/1106108507.db2.gz BPRVZIOJDPMDKP-YOEHRIQHSA-N 2 0 319.449 3.162 20 5 DGBDRP CC(C)[N@H+]([C@H]1Cc2ccc([N+](=O)[O-])cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001254588165 1106109143 /nfs/dbraw/zinc/10/91/43/1106109143.db2.gz VTUWMGARKYPABF-BQFCYCMXSA-N 2 0 317.433 3.042 20 5 DGBDRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000248883080 285035507 /nfs/dbraw/zinc/03/55/07/285035507.db2.gz LFZVMUDPNBYCSS-RKVPGOIHSA-N 2 0 317.433 3.435 20 5 DGBDRP Cc1cc(N[C@@H]2CC[N@@H+](C3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000322354114 400173870 /nfs/dbraw/zinc/17/38/70/400173870.db2.gz FIOONRHUVJSSIJ-GFCCVEGCSA-N 2 0 312.373 3.100 20 5 DGBDRP CC1CC[NH+](CCCC[NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000602514626 400485098 /nfs/dbraw/zinc/48/50/98/400485098.db2.gz OVHKCLCSUKEGLQ-UHFFFAOYSA-N 2 0 319.449 3.239 20 5 DGBDRP CC[NH+](CC)CC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000047978329 400638202 /nfs/dbraw/zinc/63/82/02/400638202.db2.gz FPGQDRVWQOBTRA-UHFFFAOYSA-N 2 0 305.422 3.149 20 5 DGBDRP O=[N+]([O-])c1c(N[C@@H]2CC[N@H+](CC3CC3)C2)ccc2cnccc21 ZINC000599043466 400936347 /nfs/dbraw/zinc/93/63/47/400936347.db2.gz RZCVRFNMEQDVBW-CQSZACIVSA-N 2 0 312.373 3.039 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000599071789 400949878 /nfs/dbraw/zinc/94/98/78/400949878.db2.gz SWIZXRNBOVTKAJ-HZPDHXFCSA-N 2 0 319.449 3.237 20 5 DGBDRP O=[N+]([O-])c1c(NC[C@H]2CC[N@@H+](C3CC3)C2)ccc2cnccc21 ZINC000599022072 400929349 /nfs/dbraw/zinc/92/93/49/400929349.db2.gz ITILPYMJKWOEFP-GFCCVEGCSA-N 2 0 312.373 3.039 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000269006177 432151351 /nfs/dbraw/zinc/15/13/51/432151351.db2.gz QNERRHXCWASOBY-FMKPAKJESA-N 2 0 303.406 3.072 20 5 DGBDRP C[C@@H](C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21)C[NH+](C)C ZINC000417353446 278285073 /nfs/dbraw/zinc/28/50/73/278285073.db2.gz XHALQHYSTOLBJT-SUMWQHHRSA-N 2 0 305.422 3.150 20 5 DGBDRP CCC[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423321535 278872346 /nfs/dbraw/zinc/87/23/46/278872346.db2.gz GIEZEOCQKDOGLW-IAGOWNOFSA-N 2 0 305.422 3.415 20 5 DGBDRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000278060293 279464346 /nfs/dbraw/zinc/46/43/46/279464346.db2.gz LTKSQSHWYHZEJT-ZDUSSCGKSA-N 2 0 303.406 3.120 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCC([NH3+])CC1 ZINC000423210434 280156465 /nfs/dbraw/zinc/15/64/65/280156465.db2.gz GHCUFHBWNTYJBD-MOKVOYLWSA-N 2 0 323.462 3.325 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152427171 432333049 /nfs/dbraw/zinc/33/30/49/432333049.db2.gz SQRNRFVDWRUYIO-UONOGXRCSA-N 2 0 303.406 3.038 20 5 DGBDRP C[NH+]1CCC(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192830493 432417989 /nfs/dbraw/zinc/41/79/89/432417989.db2.gz CBURKWMEPFAXFQ-SFHVURJKSA-N 2 0 317.433 3.294 20 5 DGBDRP CC[C@@H]([NH2+]C[C@H](C)Cn1ccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000178703839 432767848 /nfs/dbraw/zinc/76/78/48/432767848.db2.gz JPSAJGNZIPQIGC-SUMWQHHRSA-N 2 0 316.405 3.477 20 5 DGBDRP Cc1nccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178705219 432768814 /nfs/dbraw/zinc/76/88/14/432768814.db2.gz MDAKYXKFRUGPBD-STQMWFEESA-N 2 0 302.378 3.087 20 5 DGBDRP CN1CCC([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000279044317 432929298 /nfs/dbraw/zinc/92/92/98/432929298.db2.gz JOJJUCOEBRZIEJ-INIZCTEOSA-N 2 0 303.406 3.001 20 5 DGBDRP O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420322430 433164997 /nfs/dbraw/zinc/16/49/97/433164997.db2.gz FCYVHTWCIBPEDQ-OLZOCXBDSA-N 2 0 323.824 3.070 20 5 DGBDRP C[C@H](C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C[NH+](C)C ZINC000425924544 433374037 /nfs/dbraw/zinc/37/40/37/433374037.db2.gz PPPLCZUDKJXANU-INMHGKMJSA-N 2 0 319.449 3.093 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000414173004 433438764 /nfs/dbraw/zinc/43/87/64/433438764.db2.gz FYBGVDHPXFQLGT-GJZGRUSLSA-N 2 0 305.422 3.286 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421380234 433522834 /nfs/dbraw/zinc/52/28/34/433522834.db2.gz XVGIGCVXYTYZHJ-KAMYIIQDSA-N 2 0 317.433 3.461 20 5 DGBDRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293840347 433891647 /nfs/dbraw/zinc/89/16/47/433891647.db2.gz XSSHPBKTTSLMRU-CQSZACIVSA-N 2 0 320.437 3.094 20 5 DGBDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000422937384 434122080 /nfs/dbraw/zinc/12/20/80/434122080.db2.gz GINJJSNLFGEZFC-NEPJUHHUSA-N 2 0 314.389 3.169 20 5 DGBDRP CSC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC[NH+](C)CC1 ZINC000353606951 434266176 /nfs/dbraw/zinc/26/61/76/434266176.db2.gz FQUPQZUIZHWWAR-ZDUSSCGKSA-N 2 0 323.462 3.073 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000423279588 434331976 /nfs/dbraw/zinc/33/19/76/434331976.db2.gz ROGFCCZFMWFMSM-QEJZJMRPSA-N 2 0 321.421 3.162 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1CC[NH2+]CC1 ZINC000517918255 294697514 /nfs/dbraw/zinc/69/75/14/294697514.db2.gz BBBNXIGGLHFGDO-AWEZNQCLSA-N 2 0 323.462 3.055 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424379934 434716844 /nfs/dbraw/zinc/71/68/44/434716844.db2.gz WEIFXBDALYETOW-MGPQQGTHSA-N 2 0 323.462 3.325 20 5 DGBDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000459789225 434722654 /nfs/dbraw/zinc/72/26/54/434722654.db2.gz QNFHTMJZDSIAQY-GFCCVEGCSA-N 2 0 311.813 3.070 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@@H]2CC[N@@H+](C)C[C@H]21 ZINC000470200600 435134480 /nfs/dbraw/zinc/13/44/80/435134480.db2.gz CADBISOUQFWTIP-MBMZNTITSA-N 2 0 315.417 3.024 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000568461765 435439032 /nfs/dbraw/zinc/43/90/32/435439032.db2.gz XPAZIUIMWGRSRW-ZIAGYGMSSA-N 2 0 314.389 3.187 20 5 DGBDRP C[C@H](CCN[C@H]1CCc2c1cccc2[N+](=O)[O-])[NH+]1CCCCC1 ZINC000576359691 316122165 /nfs/dbraw/zinc/12/21/65/316122165.db2.gz JUGWVVCOFXXTSV-PBHICJAKSA-N 2 0 317.433 3.436 20 5 DGBDRP C[C@@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000423011962 534201364 /nfs/dbraw/zinc/20/13/64/534201364.db2.gz JUDSLEJFIPLHEI-HOCLYGCPSA-N 2 0 305.422 3.038 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)cc1[N+](=O)[O-] ZINC000423491516 528605952 /nfs/dbraw/zinc/60/59/52/528605952.db2.gz ZHLBOEFPHCZYBS-ZFWWWQNUSA-N 2 0 321.421 3.176 20 5 DGBDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000449130740 535176666 /nfs/dbraw/zinc/17/66/66/535176666.db2.gz HOWRWEOZUUSZKD-JKSUJKDBSA-N 2 0 319.449 3.236 20 5 DGBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC1CC[NH+](C)CC1 ZINC000891626407 617856810 /nfs/dbraw/zinc/85/68/10/617856810.db2.gz YTORZOGSXFBFDR-UHFFFAOYSA-N 2 0 305.422 3.147 20 5 DGBDRP COc1cc([C@H](C)[NH2+]CCCC[N@H+](C)C2CC2)cc([N+](=O)[O-])c1 ZINC000903182546 619731588 /nfs/dbraw/zinc/73/15/88/619731588.db2.gz DMZJJTGFMVHGGW-ZDUSSCGKSA-N 2 0 321.421 3.128 20 5 DGBDRP CC(C)[NH+]1CCC(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000865717142 621982600 /nfs/dbraw/zinc/98/26/00/621982600.db2.gz QICVIZOIONWRRQ-UHFFFAOYSA-N 2 0 323.412 3.334 20 5 DGBDRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000768337880 622451131 /nfs/dbraw/zinc/45/11/31/622451131.db2.gz WQILSHOMCSPLME-UHFFFAOYSA-N 2 0 313.401 3.288 20 5 DGBDRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077769 622793279 /nfs/dbraw/zinc/79/32/79/622793279.db2.gz AXTBSPZDRBSXJR-STQMWFEESA-N 2 0 309.385 3.116 20 5 DGBDRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872081494 622794390 /nfs/dbraw/zinc/79/43/90/622794390.db2.gz YFYVMIKRXWNTNO-PNESKVBLSA-N 2 0 309.385 3.257 20 5 DGBDRP C[NH+](C)C[C@](C)(O)C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000131373569 626632267 /nfs/dbraw/zinc/63/22/67/626632267.db2.gz WWFBUZOPVOGWHF-OAQYLSRUSA-N 2 0 322.452 3.395 20 5 DGBDRP Cc1c(C[NH2+][C@@H]2CC[NH2+]C[C@@H]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000925659011 627772113 /nfs/dbraw/zinc/77/21/13/627772113.db2.gz RUVCIUBAVPQZES-IAGOWNOFSA-N 2 0 317.433 3.161 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1[N+](=O)[O-] ZINC000817947092 627970394 /nfs/dbraw/zinc/97/03/94/627970394.db2.gz JWQAQRVLBCOWPD-CQSZACIVSA-N 2 0 313.401 3.255 20 5 DGBDRP Cc1c([C@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cccc1[N+](=O)[O-] ZINC000817949967 627972103 /nfs/dbraw/zinc/97/21/03/627972103.db2.gz VARWGUGTGYNEMB-AWEZNQCLSA-N 2 0 313.401 3.255 20 5 DGBDRP C[C@H]1CC2(C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1)CC[NH2+]CC2 ZINC000818431128 628022662 /nfs/dbraw/zinc/02/26/62/628022662.db2.gz GGHBNSRHEBXARE-LBPRGKRZSA-N 2 0 323.824 3.212 20 5 DGBDRP C[N@H+](CC[C@@H]1CCC[NH2+]C1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000842471779 630538797 /nfs/dbraw/zinc/53/87/97/630538797.db2.gz ZGUSGDGOXFURBA-LBPRGKRZSA-N 2 0 311.813 3.070 20 5 DGBDRP C[NH2+]CCC1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000262006400 657284892 /nfs/dbraw/zinc/28/48/92/657284892.db2.gz UQOIJDJBSZCSJB-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP CC1([NH+]2CCC2)CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001355357520 1181043436 /nfs/dbraw/zinc/04/34/36/1181043436.db2.gz DQDPPVDVVQDPPZ-UHFFFAOYSA-N 2 0 317.433 3.134 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1NC[C@]1(F)CCCC[NH2+]C1 ZINC001162583255 1089807630 /nfs/dbraw/zinc/80/76/30/1089807630.db2.gz LOZTYJOTMDYBHX-SFHVURJKSA-N 2 0 308.465 3.177 20 5 DGBDRP C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C1CC[NH+](C2CCCCC2)CC1 ZINC001169054569 1092511894 /nfs/dbraw/zinc/51/18/94/1092511894.db2.gz MRINJYZXCNORNE-MAUKXSAKSA-N 2 0 323.481 3.161 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC001173213928 1097381246 /nfs/dbraw/zinc/38/12/46/1097381246.db2.gz MDKGKPGNHPQGHT-INIZCTEOSA-N 2 0 319.449 3.237 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H](C)[NH2+]C ZINC001326034835 1103187951 /nfs/dbraw/zinc/18/79/51/1103187951.db2.gz APCFVEHMRUAEQQ-CHWSQXEVSA-N 2 0 311.451 3.053 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001326277886 1103253431 /nfs/dbraw/zinc/25/34/31/1103253431.db2.gz OVYLOSLTQQZCMQ-CQSZACIVSA-N 2 0 303.406 3.121 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCCCCCC[NH3+] ZINC001246079062 1104374969 /nfs/dbraw/zinc/37/49/69/1104374969.db2.gz JAASZAOIVLTJCX-HNNXBMFYSA-N 2 0 307.438 3.415 20 5 DGBDRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC001254550334 1106101510 /nfs/dbraw/zinc/10/15/10/1106101510.db2.gz HUWZARCSSSDCQK-BFYDXBDKSA-N 2 0 319.449 3.234 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1N(C)C ZINC001319201283 1108362656 /nfs/dbraw/zinc/36/26/56/1108362656.db2.gz OPZZQNJNVKGQNG-QGPMSJSTSA-N 2 0 319.449 3.378 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000423499121 529418052 /nfs/dbraw/zinc/41/80/52/529418052.db2.gz HHGFCDCGHPPXCM-MCIONIFRSA-N 2 0 323.462 3.183 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000423499122 529418287 /nfs/dbraw/zinc/41/82/87/529418287.db2.gz HHGFCDCGHPPXCM-MGPQQGTHSA-N 2 0 323.462 3.183 20 5 DGBDRP C[C@@H](CCCC[NH3+])[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000423434544 295852670 /nfs/dbraw/zinc/85/26/70/295852670.db2.gz OCIUAZJZCMJSOO-XJKSGUPXSA-N 2 0 305.422 3.023 20 5 DGBDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000415051884 237036127 /nfs/dbraw/zinc/03/61/27/237036127.db2.gz ZYLPHDDVJQDKFX-TZMCWYRMSA-N 2 0 315.373 3.072 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000449282140 240108429 /nfs/dbraw/zinc/10/84/29/240108429.db2.gz FVSSQOFIRUWERO-HNNXBMFYSA-N 2 0 319.449 3.237 20 5 DGBDRP O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420322716 285088997 /nfs/dbraw/zinc/08/89/97/285088997.db2.gz FCYVHTWCIBPEDQ-STQMWFEESA-N 2 0 323.824 3.070 20 5 DGBDRP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000595043501 400086977 /nfs/dbraw/zinc/08/69/77/400086977.db2.gz GBPNJYSDROREES-IYXRBSQSSA-N 2 0 321.421 3.127 20 5 DGBDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000609133537 400142103 /nfs/dbraw/zinc/14/21/03/400142103.db2.gz SWONJBPGJXRXOW-UHFFFAOYSA-N 2 0 305.422 3.147 20 5 DGBDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609133435 400143029 /nfs/dbraw/zinc/14/30/29/400143029.db2.gz DOKIPZOGRUDJGK-UHFFFAOYSA-N 2 0 305.422 3.147 20 5 DGBDRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000589195031 400274195 /nfs/dbraw/zinc/27/41/95/400274195.db2.gz BZLDSUGYAGBBHO-HZPDHXFCSA-N 2 0 319.449 3.236 20 5 DGBDRP Cc1c(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)cccc1[N+](=O)[O-] ZINC000595901419 400290495 /nfs/dbraw/zinc/29/04/95/400290495.db2.gz VMHHDWHSYWVGJT-QGZVFWFLSA-N 2 0 317.433 3.115 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000602020471 400405421 /nfs/dbraw/zinc/40/54/21/400405421.db2.gz LWOVJBSUDUJMNK-SUYBPPKGSA-N 2 0 303.406 3.079 20 5 DGBDRP C[N@@H+]1CCC[C@@H]2CN(C/C=C\c3ccccc3[N+](=O)[O-])CC[C@@H]21 ZINC000255393964 401105044 /nfs/dbraw/zinc/10/50/44/401105044.db2.gz GJCKUFWFWRTEEF-DBZNTZSBSA-N 2 0 315.417 3.024 20 5 DGBDRP CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC(C)(C)[NH3+] ZINC000594735619 401163945 /nfs/dbraw/zinc/16/39/45/401163945.db2.gz LHFLLLUGYHCGKG-UHFFFAOYSA-N 2 0 303.362 3.024 20 5 DGBDRP Cc1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1[N+](=O)[O-] ZINC000595001288 401223743 /nfs/dbraw/zinc/22/37/43/401223743.db2.gz TYGGHYPXCOCXSV-UHFFFAOYSA-N 2 0 317.433 3.115 20 5 DGBDRP Cc1cc(NCC(C)(C)[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302102339 230095307 /nfs/dbraw/zinc/09/53/07/230095307.db2.gz VPOGVXARGSYYMG-UHFFFAOYSA-N 2 0 302.378 3.204 20 5 DGBDRP C[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000192698734 274491914 /nfs/dbraw/zinc/49/19/14/274491914.db2.gz MVIXSWZQSGJTNX-KDOFPFPSSA-N 2 0 317.433 3.294 20 5 DGBDRP CC1(C)C[C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc21 ZINC000423283571 275867632 /nfs/dbraw/zinc/86/76/32/275867632.db2.gz XLLKFOKPUZVEGA-DYVFJYSZSA-N 2 0 317.433 3.297 20 5 DGBDRP CCC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000124165388 431885497 /nfs/dbraw/zinc/88/54/97/431885497.db2.gz DTUQAIBMLGUGGV-YOEHRIQHSA-N 2 0 305.422 3.367 20 5 DGBDRP CCC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000124165566 431885522 /nfs/dbraw/zinc/88/55/22/431885522.db2.gz DTUQAIBMLGUGGV-WMLDXEAASA-N 2 0 305.422 3.367 20 5 DGBDRP Cc1c(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000261812630 432452932 /nfs/dbraw/zinc/45/29/32/432452932.db2.gz GPGASGMXXKKPDE-IXDOHACOSA-N 2 0 317.433 3.304 20 5 DGBDRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000262051532 432471182 /nfs/dbraw/zinc/47/11/82/432471182.db2.gz CXINFESUILKMBI-GDBMZVCRSA-N 2 0 305.422 3.038 20 5 DGBDRP C[N@@H+]1CC[C@H]2[C@H](CCCN2C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000290574194 433100261 /nfs/dbraw/zinc/10/02/61/433100261.db2.gz UAKAMMGDWAIGKK-YQIFSTGGSA-N 2 0 315.417 3.024 20 5 DGBDRP CC(C)c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000350185569 433109318 /nfs/dbraw/zinc/10/93/18/433109318.db2.gz WOFQKLTUTJNBBI-UHFFFAOYSA-N 2 0 319.449 3.492 20 5 DGBDRP C[N@H+](CCCC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000453599446 433231782 /nfs/dbraw/zinc/23/17/82/433231782.db2.gz RGENUIDDGLJKEF-UHFFFAOYSA-N 2 0 311.813 3.212 20 5 DGBDRP CC[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000414188358 433449961 /nfs/dbraw/zinc/44/99/61/433449961.db2.gz QPAAMTNWANWQAR-PBHICJAKSA-N 2 0 305.422 3.367 20 5 DGBDRP C[NH+](C)C1CCC([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000421375622 433521814 /nfs/dbraw/zinc/52/18/14/433521814.db2.gz QQSAHKZXLACAPP-FNORWQNLSA-N 2 0 303.406 3.070 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421365816 433509115 /nfs/dbraw/zinc/50/91/15/433509115.db2.gz BHNFRNBFUZPZAW-OOHWJJMZSA-N 2 0 319.449 3.378 20 5 DGBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000414359601 433566743 /nfs/dbraw/zinc/56/67/43/433566743.db2.gz OULIKTREHWIYIA-SJLPKXTDSA-N 2 0 317.433 3.134 20 5 DGBDRP CC(C)C[NH+]1CCC([NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449072418 433723366 /nfs/dbraw/zinc/72/33/66/433723366.db2.gz KDBRLDLRDJRAAU-OAHLLOKOSA-N 2 0 319.449 3.236 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c(Cl)c1 ZINC000414780929 433828141 /nfs/dbraw/zinc/82/81/41/433828141.db2.gz MDZLNHUMWXGATH-OLZOCXBDSA-N 2 0 323.824 3.070 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)c(Cl)c1 ZINC000357058617 433848100 /nfs/dbraw/zinc/84/81/00/433848100.db2.gz VWXNJIAOBTYJMD-ZDUSSCGKSA-N 2 0 323.824 3.070 20 5 DGBDRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000414909911 433914402 /nfs/dbraw/zinc/91/44/02/433914402.db2.gz CQRNGXFRQRSFAT-KGLIPLIRSA-N 2 0 315.373 3.214 20 5 DGBDRP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414841379 433879269 /nfs/dbraw/zinc/87/92/69/433879269.db2.gz NUDMKBGDCLPALT-GFCCVEGCSA-N 2 0 319.430 3.268 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414968656 293898086 /nfs/dbraw/zinc/89/80/86/293898086.db2.gz SCLRKILGDLNNQB-ZBFHGGJFSA-N 2 0 305.422 3.038 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414968655 293898250 /nfs/dbraw/zinc/89/82/50/293898250.db2.gz SCLRKILGDLNNQB-HOCLYGCPSA-N 2 0 305.422 3.038 20 5 DGBDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000422937387 434124082 /nfs/dbraw/zinc/12/40/82/434124082.db2.gz GINJJSNLFGEZFC-VXGBXAGGSA-N 2 0 314.389 3.169 20 5 DGBDRP Cc1cc(N[C@H]2CC[N@H+](C)[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000322737229 434263275 /nfs/dbraw/zinc/26/32/75/434263275.db2.gz XKBMCBZBYZBBSM-STQMWFEESA-N 2 0 314.389 3.346 20 5 DGBDRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513789841 435401150 /nfs/dbraw/zinc/40/11/50/435401150.db2.gz ODJUVBBCKAAJHC-INMHGKMJSA-N 2 0 319.449 3.236 20 5 DGBDRP CC[N@@H+]1CC[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000539089489 435538174 /nfs/dbraw/zinc/53/81/74/435538174.db2.gz SLRUGJHDBHQZEF-QAPCUYQASA-N 2 0 319.449 3.237 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000564971318 315216196 /nfs/dbraw/zinc/21/61/96/315216196.db2.gz XCYSXQQSYQBGBB-AWEZNQCLSA-N 2 0 313.401 3.164 20 5 DGBDRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000564973731 315216551 /nfs/dbraw/zinc/21/65/51/315216551.db2.gz PUBLCMIQVWXOIN-RYUDHWBXSA-N 2 0 303.362 3.070 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]CCC[NH+]2CCCC2)c2cc([N+](=O)[O-])ccc21 ZINC000433158853 529139216 /nfs/dbraw/zinc/13/92/16/529139216.db2.gz CBQNWJQIXBKXTR-QGZVFWFLSA-N 2 0 317.433 3.393 20 5 DGBDRP CCC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000468627737 534955079 /nfs/dbraw/zinc/95/50/79/534955079.db2.gz ODYUWUDGEZMBSS-XBNGYDHASA-N 2 0 317.433 3.320 20 5 DGBDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000894858420 618480395 /nfs/dbraw/zinc/48/03/95/618480395.db2.gz FSJJHQLOVHLHBD-LBPRGKRZSA-N 2 0 311.813 3.070 20 5 DGBDRP [NH3+]CC[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000904406949 619920721 /nfs/dbraw/zinc/92/07/21/619920721.db2.gz YCQOBVWMQXXBNY-ZDUSSCGKSA-N 2 0 315.373 3.026 20 5 DGBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000872027458 622760191 /nfs/dbraw/zinc/76/01/91/622760191.db2.gz DPYWVKDYDHQKBM-LBPRGKRZSA-N 2 0 311.451 3.309 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000873132277 623043977 /nfs/dbraw/zinc/04/39/77/623043977.db2.gz NKLRVVDSPSTAKG-UHFFFAOYSA-N 2 0 305.422 3.174 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@@H](C)C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000873223242 623080104 /nfs/dbraw/zinc/08/01/04/623080104.db2.gz JMKLTFRYZHLHEW-ZDUSSCGKSA-N 2 0 305.422 3.196 20 5 DGBDRP C[C@@H]([NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC[NH2+]CC1 ZINC000873269956 623099180 /nfs/dbraw/zinc/09/91/80/623099180.db2.gz VSLYIXJKAJZULF-PXAZEXFGSA-N 2 0 317.433 3.295 20 5 DGBDRP CC(C)[NH+]1CCC(CC[NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000877698323 623995352 /nfs/dbraw/zinc/99/53/52/623995352.db2.gz XELMSHACAVVCPN-UHFFFAOYSA-N 2 0 319.449 3.237 20 5 DGBDRP CC[NH+]1CCC(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000783622640 624375532 /nfs/dbraw/zinc/37/55/32/624375532.db2.gz MGXNWONNIXQHPM-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP C[C@@H](NCCC[N@@H+]1CCCC[C@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815554797 627684367 /nfs/dbraw/zinc/68/43/67/627684367.db2.gz IZESTIDXCLBAJB-ZIAGYGMSSA-N 2 0 320.437 3.092 20 5 DGBDRP C[NH+](C)C1CCC([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000817416217 627897009 /nfs/dbraw/zinc/89/70/09/627897009.db2.gz RYGGIYLCPWAAOZ-UHFFFAOYSA-N 2 0 311.813 3.211 20 5 DGBDRP CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)C1CCC([NH3+])CC1 ZINC000843355863 630649676 /nfs/dbraw/zinc/64/96/76/630649676.db2.gz YPYRPKWFJNSSHN-UHFFFAOYSA-N 2 0 321.421 3.084 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c(Cl)c1 ZINC000261947886 657237501 /nfs/dbraw/zinc/23/75/01/657237501.db2.gz MOROEGJTLDIWQL-MRXNPFEDSA-N 2 0 323.824 3.212 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CCCC[C@]2(C[NH3+])C1 ZINC001576315827 1191560805 /nfs/dbraw/zinc/56/08/05/1191560805.db2.gz MWJCPQVUPAKYSK-CPUCHLNUSA-N 2 0 303.406 3.107 20 5 DGBDRP C[NH+]1CCC(CC[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000229940004 1202447106 /nfs/dbraw/zinc/44/71/06/1202447106.db2.gz VNSYTOAIWXAQIG-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]CC2CC[NH+](C3CCCCC3)CC2)C1 ZINC001168978001 1092456399 /nfs/dbraw/zinc/45/63/99/1092456399.db2.gz NNPJDIKXYKNWAF-DLBZAZTESA-N 2 0 323.481 3.066 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1-n1ncc2c1cccc2C[NH3+] ZINC001169192846 1092581264 /nfs/dbraw/zinc/58/12/64/1092581264.db2.gz SFFORUZAKRXPDE-UHFFFAOYSA-N 2 0 309.437 3.081 20 5 DGBDRP O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001118264139 1095969738 /nfs/dbraw/zinc/96/97/38/1095969738.db2.gz UFZQEHSFKZTEBK-UHFFFAOYSA-N 2 0 323.824 3.214 20 5 DGBDRP C[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1OCCC[N+](C)(C)C ZINC001224618440 1096247607 /nfs/dbraw/zinc/24/76/07/1096247607.db2.gz HHBWPKGYRYSBCU-PKOBYXMFSA-N 2 0 305.486 3.010 20 5 DGBDRP CC(C)[NH+]1CCC(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173215587 1097367581 /nfs/dbraw/zinc/36/75/81/1097367581.db2.gz XBYSPFQERCHMQQ-HNNXBMFYSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC001173217097 1097368334 /nfs/dbraw/zinc/36/83/34/1097368334.db2.gz LLKMKRAQCQLBEO-HZPDHXFCSA-N 2 0 319.449 3.380 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001326202324 1103232464 /nfs/dbraw/zinc/23/24/64/1103232464.db2.gz NZEHSFCTQKJFCQ-UHFFFAOYSA-N 2 0 323.824 3.214 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)cc1Cl ZINC001326236822 1103242145 /nfs/dbraw/zinc/24/21/45/1103242145.db2.gz QHDFKPIEJLZLTR-UHFFFAOYSA-N 2 0 323.824 3.214 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001254548691 1106101407 /nfs/dbraw/zinc/10/14/07/1106101407.db2.gz KOEKONDCBPWAID-HOTGVXAUSA-N 2 0 319.449 3.367 20 5 DGBDRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC001320881460 1107175241 /nfs/dbraw/zinc/17/52/41/1107175241.db2.gz WJXJSWDHYMZTAP-KBXCAEBGSA-N 2 0 317.433 3.294 20 5 DGBDRP C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC1CC[NH+](C)CC1 ZINC000272793194 210197074 /nfs/dbraw/zinc/19/70/74/210197074.db2.gz JRLQHCVYYZXNJE-UHFFFAOYSA-N 2 0 311.813 3.022 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000152427953 186071918 /nfs/dbraw/zinc/07/19/18/186071918.db2.gz CRBMGMQMYRQPCZ-ZIAGYGMSSA-N 2 0 303.406 3.038 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000470169719 533407294 /nfs/dbraw/zinc/40/72/94/533407294.db2.gz IFJGDWHLZYVMCZ-IUYQLWOBSA-N 2 0 317.433 3.272 20 5 DGBDRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000595105032 400107545 /nfs/dbraw/zinc/10/75/45/400107545.db2.gz VRDRIPRPJFGLEJ-CQSZACIVSA-N 2 0 317.433 3.367 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@H]1CCCC[NH2+]1 ZINC000591578082 400541353 /nfs/dbraw/zinc/54/13/53/400541353.db2.gz WFMMNBHJMVUHAO-ZIAGYGMSSA-N 2 0 323.462 3.197 20 5 DGBDRP Cc1c([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cccc1[N+](=O)[O-] ZINC000593319781 400818171 /nfs/dbraw/zinc/81/81/71/400818171.db2.gz PJYWPAOZIBUPOD-LBPRGKRZSA-N 2 0 317.364 3.352 20 5 DGBDRP C[C@H]1C[C@H](Nc2ccc3cnccc3c2[N+](=O)[O-])CC[N@@H+]1C ZINC000599051692 400940362 /nfs/dbraw/zinc/94/03/62/400940362.db2.gz WAVUAUSDNUWFDH-WCQYABFASA-N 2 0 300.362 3.038 20 5 DGBDRP Cc1ccc(C[NH2+]C[C@H]2CCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000598997973 400924109 /nfs/dbraw/zinc/92/41/09/400924109.db2.gz AASLVAXIOYIQFY-MRXNPFEDSA-N 2 0 303.406 3.010 20 5 DGBDRP O=[N+]([O-])c1c(NC[C@@H]2CC[N@@H+](C3CC3)C2)ccc2cnccc21 ZINC000599022073 400929528 /nfs/dbraw/zinc/92/95/28/400929528.db2.gz ITILPYMJKWOEFP-LBPRGKRZSA-N 2 0 312.373 3.039 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420327198 292295974 /nfs/dbraw/zinc/29/59/74/292295974.db2.gz KYOZZGLIXVGLBV-XHSDSOJGSA-N 2 0 317.433 3.286 20 5 DGBDRP Cc1cc(NC[C@@H]2CCC[N@@H+](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302196564 230153032 /nfs/dbraw/zinc/15/30/32/230153032.db2.gz SRVMAGFKSYCHSB-ZDUSSCGKSA-N 2 0 314.389 3.205 20 5 DGBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000346497838 264042117 /nfs/dbraw/zinc/04/21/17/264042117.db2.gz UVHPHWKHZIDYCH-SUMWQHHRSA-N 2 0 313.357 3.204 20 5 DGBDRP C[NH+](C)C1CCC([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000421872411 273792252 /nfs/dbraw/zinc/79/22/52/273792252.db2.gz GUDFHTUWCHIMIR-JMLCCBQJSA-N 2 0 317.433 3.435 20 5 DGBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279214407 276212387 /nfs/dbraw/zinc/21/23/87/276212387.db2.gz YNSDUPQWDZYPLB-SUMWQHHRSA-N 2 0 317.433 3.249 20 5 DGBDRP C[NH+](C)CCCC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000123564397 431867872 /nfs/dbraw/zinc/86/78/72/431867872.db2.gz QGLRVTNHPIPSJJ-UHFFFAOYSA-N 2 0 319.449 3.191 20 5 DGBDRP C[NH+](C)[C@@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000277366453 432842207 /nfs/dbraw/zinc/84/22/07/432842207.db2.gz FLEJXCTZXYIFKN-CDVVCGDMSA-N 2 0 303.406 3.024 20 5 DGBDRP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446886025 433124162 /nfs/dbraw/zinc/12/41/62/433124162.db2.gz ZQFFQARHRLJUIZ-HYXAFXHYSA-N 2 0 315.417 3.072 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]CCCC[N@H+](C)C2CC2)cc1[N+](=O)[O-] ZINC000453408594 433160771 /nfs/dbraw/zinc/16/07/71/433160771.db2.gz FLEHCGBVJLMVQL-AWEZNQCLSA-N 2 0 305.422 3.428 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cccc1[N+](=O)[O-] ZINC000421890685 433795361 /nfs/dbraw/zinc/79/53/61/433795361.db2.gz YFBVMUVSIYJFKR-WLYUNCDWSA-N 2 0 305.422 3.427 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c(Cl)c1 ZINC000414780930 433829066 /nfs/dbraw/zinc/82/90/66/433829066.db2.gz MDZLNHUMWXGATH-QWHCGFSZSA-N 2 0 323.824 3.070 20 5 DGBDRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414869633 433897439 /nfs/dbraw/zinc/89/74/39/433897439.db2.gz BADROIBFXDTZNN-SNVBAGLBSA-N 2 0 323.780 3.193 20 5 DGBDRP O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000422785073 433998763 /nfs/dbraw/zinc/99/87/63/433998763.db2.gz JHHUHLCILQAIBL-BRWVUGGUSA-N 2 0 317.433 3.038 20 5 DGBDRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422918508 434107662 /nfs/dbraw/zinc/10/76/62/434107662.db2.gz IJPOJLRWFHNFPY-IRXDYDNUSA-N 2 0 305.422 3.167 20 5 DGBDRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000422937386 434122288 /nfs/dbraw/zinc/12/22/88/434122288.db2.gz GINJJSNLFGEZFC-RYUDHWBXSA-N 2 0 314.389 3.169 20 5 DGBDRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000423011960 434167048 /nfs/dbraw/zinc/16/70/48/434167048.db2.gz JUDSLEJFIPLHEI-GDBMZVCRSA-N 2 0 305.422 3.038 20 5 DGBDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423147415 434248295 /nfs/dbraw/zinc/24/82/95/434248295.db2.gz RZQKSOBATLPKFA-NWDGAFQWSA-N 2 0 314.389 3.169 20 5 DGBDRP CCC[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423321537 434361401 /nfs/dbraw/zinc/36/14/01/434361401.db2.gz GIEZEOCQKDOGLW-IRXDYDNUSA-N 2 0 305.422 3.415 20 5 DGBDRP CCc1ccc([C@H]([NH2+]CCCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423339872 434372295 /nfs/dbraw/zinc/37/22/95/434372295.db2.gz XBIDOJLAGDBBAL-QGZVFWFLSA-N 2 0 317.389 3.168 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000423479244 434444179 /nfs/dbraw/zinc/44/41/79/434444179.db2.gz UUCOEOJGIMTAGP-YDHLFZDLSA-N 2 0 321.421 3.162 20 5 DGBDRP CC[N@@H+]1CC[C@H](N(C)Cc2cccc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000354219245 434673591 /nfs/dbraw/zinc/67/35/91/434673591.db2.gz DJBYXVRCGKFCQT-BBRMVZONSA-N 2 0 305.422 3.208 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000415014442 298392980 /nfs/dbraw/zinc/39/29/80/298392980.db2.gz MFNDUTHTUIUETI-INMHGKMJSA-N 2 0 319.449 3.413 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000541881698 314045901 /nfs/dbraw/zinc/04/59/01/314045901.db2.gz GTHFGNQCKHTYDJ-CQSZACIVSA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000581647200 324140199 /nfs/dbraw/zinc/14/01/99/324140199.db2.gz LVZRMIKPMMGLIU-AWEZNQCLSA-N 2 0 317.433 3.428 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000415014851 533846602 /nfs/dbraw/zinc/84/66/02/533846602.db2.gz NGECCHWRIHIFJD-CYBMUJFWSA-N 2 0 317.389 3.462 20 5 DGBDRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000415018104 533873431 /nfs/dbraw/zinc/87/34/31/533873431.db2.gz GJLGRHOFMOLDOU-IIAWOOMASA-N 2 0 305.422 3.023 20 5 DGBDRP CC1(C)C[NH2+]CC[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000902348573 619620148 /nfs/dbraw/zinc/62/01/48/619620148.db2.gz UDAVWSBOYQXWDR-INIZCTEOSA-N 2 0 319.449 3.285 20 5 DGBDRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000902348574 619620270 /nfs/dbraw/zinc/62/02/70/619620270.db2.gz UDAVWSBOYQXWDR-MRXNPFEDSA-N 2 0 319.449 3.285 20 5 DGBDRP C[C@H](C[NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000902432710 619634911 /nfs/dbraw/zinc/63/49/11/619634911.db2.gz WSRXGWAPKIXHJV-RDBSUJKOSA-N 2 0 305.422 3.194 20 5 DGBDRP C[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000902432708 619634968 /nfs/dbraw/zinc/63/49/68/619634968.db2.gz WSRXGWAPKIXHJV-MCIONIFRSA-N 2 0 305.422 3.194 20 5 DGBDRP [NH3+]C[C@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000902487327 619646276 /nfs/dbraw/zinc/64/62/76/619646276.db2.gz SXVQHXZQLXXYSO-MZMPZRCHSA-N 2 0 311.385 3.011 20 5 DGBDRP [NH3+]CC1([C@H]2CCCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])CCC1 ZINC000903815923 619814327 /nfs/dbraw/zinc/81/43/27/619814327.db2.gz VOAQGWAHLYZZOK-MRXNPFEDSA-N 2 0 303.406 3.078 20 5 DGBDRP [NH3+]CC1([C@H]2CCCCN2Cc2csc([N+](=O)[O-])c2)CCC1 ZINC000903813438 619818525 /nfs/dbraw/zinc/81/85/25/619818525.db2.gz GFLNGIARZBTVMQ-CYBMUJFWSA-N 2 0 309.435 3.140 20 5 DGBDRP CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@H]1CCC[N@H+](C)C1 ZINC000153947120 620626000 /nfs/dbraw/zinc/62/60/00/620626000.db2.gz SMFJUPLSVISYQE-ZDUSSCGKSA-N 2 0 311.813 3.022 20 5 DGBDRP [NH3+]CCC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000925490076 620987604 /nfs/dbraw/zinc/98/76/04/620987604.db2.gz ALYNGJZSFYFHOJ-SFHVURJKSA-N 2 0 313.401 3.207 20 5 DGBDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000839183479 621344778 /nfs/dbraw/zinc/34/47/78/621344778.db2.gz WWRFMGDQURBIBY-GFCCVEGCSA-N 2 0 311.813 3.070 20 5 DGBDRP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000872254278 622867666 /nfs/dbraw/zinc/86/76/66/622867666.db2.gz YJHHAFULXRSAIE-GFCCVEGCSA-N 2 0 311.813 3.116 20 5 DGBDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc(F)cc1[N+](=O)[O-])CC2 ZINC000879251523 624464957 /nfs/dbraw/zinc/46/49/57/624464957.db2.gz XFMCDNUYDLDXAS-UHFFFAOYSA-N 2 0 321.396 3.042 20 5 DGBDRP C[N@H+](CCCC[NH+]1CCCCC1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000880517790 624971195 /nfs/dbraw/zinc/97/11/95/624971195.db2.gz XCDRHEZYSGWRIG-UHFFFAOYSA-N 2 0 323.412 3.432 20 5 DGBDRP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788613562 625229926 /nfs/dbraw/zinc/22/99/26/625229926.db2.gz YEIIFHQWIWMTEN-WBMJQRKESA-N 2 0 322.453 3.194 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799177612 626277936 /nfs/dbraw/zinc/27/79/36/626277936.db2.gz YJFXKUONJITIIJ-OAHLLOKOSA-N 2 0 317.433 3.464 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2 ZINC000925844239 627804853 /nfs/dbraw/zinc/80/48/53/627804853.db2.gz RVLGDTFUFUZYIV-ZTFGCOKTSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@@H]1CC2(C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1)CC[NH2+]CC2 ZINC000818431126 628022670 /nfs/dbraw/zinc/02/26/70/628022670.db2.gz GGHBNSRHEBXARE-GFCCVEGCSA-N 2 0 323.824 3.212 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c1 ZINC000843125821 630616384 /nfs/dbraw/zinc/61/63/84/630616384.db2.gz JHOFBBMNXKYEDL-CHWSQXEVSA-N 2 0 323.824 3.070 20 5 DGBDRP [NH3+]CCCCCC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000843130096 630617507 /nfs/dbraw/zinc/61/75/07/630617507.db2.gz WUBHFJBUXQYHQW-WBVHZDCISA-N 2 0 319.449 3.415 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC001574979578 1191461823 /nfs/dbraw/zinc/46/18/23/1191461823.db2.gz JLXGSJHZLBQEHN-QBOMHBFWSA-N 2 0 303.406 3.120 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC001574979579 1191462015 /nfs/dbraw/zinc/46/20/15/1191462015.db2.gz JLXGSJHZLBQEHN-SYCZXOQXSA-N 2 0 303.406 3.120 20 5 DGBDRP O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]C2CC[NH+](CC3CCCCC3)CC2)C1 ZINC001168993412 1092476721 /nfs/dbraw/zinc/47/67/21/1092476721.db2.gz MXLNPJSMYBTONW-AEFFLSMTSA-N 2 0 323.481 3.066 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C2CCCCC2)CC1 ZINC001168998324 1092479621 /nfs/dbraw/zinc/47/96/21/1092479621.db2.gz LHMKKGZDHUHXDP-JOCBIADPSA-N 2 0 323.481 3.336 20 5 DGBDRP [NH3+]CC1(F)CC[NH+](Cc2ccc3ccc4cccnc4c3n2)CC1 ZINC001222542824 1095659215 /nfs/dbraw/zinc/65/92/15/1095659215.db2.gz KKWQMFSYRXCURB-UHFFFAOYSA-N 2 0 324.403 3.046 20 5 DGBDRP CC[NH+](CC)CCCC[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173215232 1097367038 /nfs/dbraw/zinc/36/70/38/1097367038.db2.gz URGUCXWCBPRBDP-HNNXBMFYSA-N 2 0 307.438 3.237 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001326277884 1103253082 /nfs/dbraw/zinc/25/30/82/1103253082.db2.gz OVYLOSLTQQZCMQ-AWEZNQCLSA-N 2 0 303.406 3.121 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001329499955 1104286133 /nfs/dbraw/zinc/28/61/33/1104286133.db2.gz XHWYJLJDCRJUMT-HNNXBMFYSA-N 2 0 317.433 3.430 20 5 DGBDRP C[C@@]1([NH3+])CCC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001246555575 1104592924 /nfs/dbraw/zinc/59/29/24/1104592924.db2.gz XTIJJYFLBIPTIX-FUHWJXTLSA-N 2 0 317.433 3.046 20 5 DGBDRP C[C@@]1([NH3+])CCC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001246555576 1104593883 /nfs/dbraw/zinc/59/38/83/1104593883.db2.gz XTIJJYFLBIPTIX-SJLPKXTDSA-N 2 0 317.433 3.046 20 5 DGBDRP CCC[N@H+](CCC[NH+](C)C)[C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC001254567985 1106106024 /nfs/dbraw/zinc/10/60/24/1106106024.db2.gz DTCJZZSADUGAQR-OAHLLOKOSA-N 2 0 307.438 3.190 20 5 DGBDRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC001320881461 1107174931 /nfs/dbraw/zinc/17/49/31/1107174931.db2.gz WJXJSWDHYMZTAP-KDOFPFPSSA-N 2 0 317.433 3.294 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000415013565 237004751 /nfs/dbraw/zinc/00/47/51/237004751.db2.gz YLTMKLLNBRLIKN-FMKPAKJESA-N 2 0 305.422 3.023 20 5 DGBDRP C[C@H](C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])C[NH+]1CCCCC1 ZINC000449089741 240013042 /nfs/dbraw/zinc/01/30/42/240013042.db2.gz LDXKKEVRNSQKOH-HZPDHXFCSA-N 2 0 319.449 3.237 20 5 DGBDRP CCC[NH+]1CCC([NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000468620324 244057551 /nfs/dbraw/zinc/05/75/51/244057551.db2.gz JLVVNXKEZZRBNE-NTCAYCPXSA-N 2 0 317.433 3.462 20 5 DGBDRP CC[NH+]1CCC([NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000468653919 244058445 /nfs/dbraw/zinc/05/84/45/244058445.db2.gz RQPGELJGFUZYFC-SDNWHVSQSA-N 2 0 303.406 3.072 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[N@@H+](C)C(C)C ZINC000468649206 244059467 /nfs/dbraw/zinc/05/94/67/244059467.db2.gz PEVOGASTXUYBFA-PTNGSMBKSA-N 2 0 305.422 3.318 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000344792506 254305657 /nfs/dbraw/zinc/30/56/57/254305657.db2.gz NAMUWOIUEYAAMT-SCZPIIQISA-N 2 0 315.417 3.072 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000470174420 533380696 /nfs/dbraw/zinc/38/06/96/533380696.db2.gz KTWUBXMNSDIUFZ-PTNGSMBKSA-N 2 0 317.433 3.272 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000470174422 533407373 /nfs/dbraw/zinc/40/73/73/533407373.db2.gz KTWUBXMNSDIUFZ-RVDMUPIBSA-N 2 0 317.433 3.272 20 5 DGBDRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595290529 400118559 /nfs/dbraw/zinc/11/85/59/400118559.db2.gz LUDUAHNXFCSISO-UHFFFAOYSA-N 2 0 323.412 3.288 20 5 DGBDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000315455232 400145527 /nfs/dbraw/zinc/14/55/27/400145527.db2.gz YTEDBCJIOZZLEB-CQSZACIVSA-N 2 0 305.422 3.286 20 5 DGBDRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000589195030 400273826 /nfs/dbraw/zinc/27/38/26/400273826.db2.gz BZLDSUGYAGBBHO-HOTGVXAUSA-N 2 0 319.449 3.236 20 5 DGBDRP Cc1c(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)cccc1[N+](=O)[O-] ZINC000595900234 400291026 /nfs/dbraw/zinc/29/10/26/400291026.db2.gz BSXJSXVHOLQIEA-INIZCTEOSA-N 2 0 317.433 3.115 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@H]2CCC[NH2+]CC2)c2cc([N+](=O)[O-])ccc21 ZINC000591578356 400541901 /nfs/dbraw/zinc/54/19/01/400541901.db2.gz WGXXGQVOFHWZEV-LRDDRELGSA-N 2 0 303.406 3.049 20 5 DGBDRP Cc1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000592433827 400649473 /nfs/dbraw/zinc/64/94/73/400649473.db2.gz ZADUROJDAPLGEH-IAGOWNOFSA-N 2 0 317.433 3.115 20 5 DGBDRP O=[N+]([O-])c1cccc(C[N@H+](CCCC2CC[NH2+]CC2)C2CC2)c1 ZINC000592494402 400658192 /nfs/dbraw/zinc/65/81/92/400658192.db2.gz TYAKRBDQDGBVKO-UHFFFAOYSA-N 2 0 317.433 3.339 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+]CCC2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000593321977 400817756 /nfs/dbraw/zinc/81/77/56/400817756.db2.gz KIUSVFSJUXSZPS-CYBMUJFWSA-N 2 0 321.421 3.034 20 5 DGBDRP CC[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599072066 400949902 /nfs/dbraw/zinc/94/99/02/400949902.db2.gz XHNSTWHFDYCBIG-YOEHRIQHSA-N 2 0 305.422 3.367 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000364448476 287027787 /nfs/dbraw/zinc/02/77/87/287027787.db2.gz QKWZQFOJOPZPDI-HYVNUMGLSA-N 2 0 317.433 3.132 20 5 DGBDRP O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000247031723 432193814 /nfs/dbraw/zinc/19/38/14/432193814.db2.gz YLBOBKAPQKBYFE-MAUKXSAKSA-N 2 0 315.417 3.044 20 5 DGBDRP CCC[N@@H+]1CC[C@@H](CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000151111878 432219426 /nfs/dbraw/zinc/21/94/26/432219426.db2.gz PXDBTDDYQQRRES-GJZGRUSLSA-N 2 0 305.422 3.286 20 5 DGBDRP C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC(C)(C)C[NH3+] ZINC000346695073 264081754 /nfs/dbraw/zinc/08/17/54/264081754.db2.gz YDAFLETYYBRMGA-UHFFFAOYSA-N 2 0 317.389 3.272 20 5 DGBDRP CC[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000125420330 431925017 /nfs/dbraw/zinc/92/50/17/431925017.db2.gz NRCHGRDKGMRRHK-QGZVFWFLSA-N 2 0 305.422 3.367 20 5 DGBDRP O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000261661039 432439344 /nfs/dbraw/zinc/43/93/44/432439344.db2.gz GEVWKZGBRWUCDU-KZNAEPCWSA-N 2 0 317.433 3.038 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000272592932 432529759 /nfs/dbraw/zinc/52/97/59/432529759.db2.gz SJCGYWFFQJBHSZ-AWEZNQCLSA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1nccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178705228 432768878 /nfs/dbraw/zinc/76/88/78/432768878.db2.gz MDAKYXKFRUGPBD-OLZOCXBDSA-N 2 0 302.378 3.087 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000266921610 432798722 /nfs/dbraw/zinc/79/87/22/432798722.db2.gz MGPQRAVCPHFOFW-CHWSQXEVSA-N 2 0 300.362 3.259 20 5 DGBDRP C[NH+](C)[C@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000277366456 432842323 /nfs/dbraw/zinc/84/23/23/432842323.db2.gz FLEJXCTZXYIFKN-WHWKNOJMSA-N 2 0 303.406 3.024 20 5 DGBDRP C[C@H](C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C[NH+](C)C ZINC000425924545 433373441 /nfs/dbraw/zinc/37/34/41/433373441.db2.gz PPPLCZUDKJXANU-VYDXJSESSA-N 2 0 319.449 3.093 20 5 DGBDRP Cc1c([C@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-] ZINC000414176439 433441932 /nfs/dbraw/zinc/44/19/32/433441932.db2.gz IZZIEPYUFDCJHZ-LSDHHAIUSA-N 2 0 305.422 3.286 20 5 DGBDRP CC(C)c1ccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cc1[N+](=O)[O-] ZINC000414769314 433824000 /nfs/dbraw/zinc/82/40/00/433824000.db2.gz NEUVQRIPNHRYLC-IYBDPMFKSA-N 2 0 317.433 3.150 20 5 DGBDRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414869632 433894868 /nfs/dbraw/zinc/89/48/68/433894868.db2.gz BADROIBFXDTZNN-JTQLQIEISA-N 2 0 323.780 3.193 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414968653 293897999 /nfs/dbraw/zinc/89/79/99/293897999.db2.gz SCLRKILGDLNNQB-GDBMZVCRSA-N 2 0 305.422 3.038 20 5 DGBDRP C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[NH2+]1 ZINC000422918010 434105682 /nfs/dbraw/zinc/10/56/82/434105682.db2.gz HCNOSKFDVZHYGN-PBHICJAKSA-N 2 0 305.422 3.038 20 5 DGBDRP Cc1cc(N[C@@H]2CC[N@H+](C)[C@H](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000322737226 434263401 /nfs/dbraw/zinc/26/34/01/434263401.db2.gz XKBMCBZBYZBBSM-CHWSQXEVSA-N 2 0 314.389 3.346 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000353647419 434299504 /nfs/dbraw/zinc/29/95/04/434299504.db2.gz RYXYNBWFAKFMPU-JEYLPNPQSA-N 2 0 305.422 3.427 20 5 DGBDRP CCc1ccc([C@@H]([NH2+]CCCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423339870 434368854 /nfs/dbraw/zinc/36/88/54/434368854.db2.gz XBIDOJLAGDBBAL-KRWDZBQOSA-N 2 0 317.389 3.168 20 5 DGBDRP CCC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423321530 434359704 /nfs/dbraw/zinc/35/97/04/434359704.db2.gz GIEZEOCQKDOGLW-DLBZAZTESA-N 2 0 305.422 3.415 20 5 DGBDRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000423453852 434431761 /nfs/dbraw/zinc/43/17/61/434431761.db2.gz BDSJQJSMTFTSJG-GEHYHNTPSA-N 2 0 315.417 3.078 20 5 DGBDRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000423461313 434432504 /nfs/dbraw/zinc/43/25/04/434432504.db2.gz CCAGVUUIWDJWBS-QEORTHHSSA-N 2 0 303.406 3.079 20 5 DGBDRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423471988 434441500 /nfs/dbraw/zinc/44/15/00/434441500.db2.gz ZZOUYCFFUIAGCT-KBXCAEBGSA-N 2 0 313.401 3.401 20 5 DGBDRP CC[N@@H+]1CC[C@@H](N(C)Cc2cccc([N+](=O)[O-])c2C)C[C@H]1C ZINC000354219259 434675058 /nfs/dbraw/zinc/67/50/58/434675058.db2.gz DJBYXVRCGKFCQT-CZUORRHYSA-N 2 0 305.422 3.208 20 5 DGBDRP CC(C)([NH2+]Cc1cccc2nccn21)c1ccccc1[N+](=O)[O-] ZINC000492308127 434957702 /nfs/dbraw/zinc/95/77/02/434957702.db2.gz AVZQPPQHWZGQPI-UHFFFAOYSA-N 2 0 310.357 3.267 20 5 DGBDRP CC[N@H+](CCC[NH+](C)C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000583962100 435261777 /nfs/dbraw/zinc/26/17/77/435261777.db2.gz DRHAZHPGUHWAFE-NTCAYCPXSA-N 2 0 305.422 3.272 20 5 DGBDRP Cc1ccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cc1[N+](=O)[O-] ZINC000535815213 435356341 /nfs/dbraw/zinc/35/63/41/435356341.db2.gz GORYUBVLXIUPAU-UHFFFAOYSA-N 2 0 319.449 3.455 20 5 DGBDRP CC[N@@H+]1CC[C@H](N(C)C/C=C/c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000539818646 435569635 /nfs/dbraw/zinc/56/96/35/435569635.db2.gz CAVPKYIISJLVPQ-FUZMGVLZSA-N 2 0 317.433 3.413 20 5 DGBDRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000415047631 534620574 /nfs/dbraw/zinc/62/05/74/534620574.db2.gz FELSTQRUDNOUNI-QGZVFWFLSA-N 2 0 317.364 3.304 20 5 DGBDRP CC[NH+]1CCC(Nc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000302159690 528988603 /nfs/dbraw/zinc/98/86/03/528988603.db2.gz JMIANXPTVXGDII-UHFFFAOYSA-N 2 0 314.389 3.348 20 5 DGBDRP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CCCCC[NH+]1CCCC1 ZINC000584665445 547024057 /nfs/dbraw/zinc/02/40/57/547024057.db2.gz MZKAGEYCNSBDFF-QGZVFWFLSA-N 2 0 317.433 3.438 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@H](n3ccnc3)C2)c1 ZINC000735492713 574703998 /nfs/dbraw/zinc/70/39/98/574703998.db2.gz SDMYVRZCDIGOTO-AWEZNQCLSA-N 2 0 320.780 3.282 20 5 DGBDRP C[C@@H]([NH2+][C@H]1CCCN2CCCC[C@@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000926891777 618392839 /nfs/dbraw/zinc/39/28/39/618392839.db2.gz KGDYYXIJOOEUJS-COXVUDFISA-N 2 0 303.406 3.262 20 5 DGBDRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000897465718 619130532 /nfs/dbraw/zinc/13/05/32/619130532.db2.gz GZQPHMWGCTZUIR-DZKIICNBSA-N 2 0 305.422 3.018 20 5 DGBDRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000897465721 619130566 /nfs/dbraw/zinc/13/05/66/619130566.db2.gz GZQPHMWGCTZUIR-YCPHGPKFSA-N 2 0 305.422 3.018 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000902428061 619634288 /nfs/dbraw/zinc/63/42/88/619634288.db2.gz AQVMTLDZKAEMCT-ZIAGYGMSSA-N 2 0 305.422 3.066 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000903244876 619743641 /nfs/dbraw/zinc/74/36/41/619743641.db2.gz FWBAFUCHHCXDFS-XLNGHYISSA-N 2 0 317.433 3.161 20 5 DGBDRP C[C@H](C[NH2+][C@H]1CCCN2CCCC[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000903245469 619743677 /nfs/dbraw/zinc/74/36/77/619743677.db2.gz MIUIXSIOAVFBHA-HFTRVMKXSA-N 2 0 317.433 3.305 20 5 DGBDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000839180087 621343480 /nfs/dbraw/zinc/34/34/80/621343480.db2.gz CFKOWEOHYYOZON-LBPRGKRZSA-N 2 0 311.813 3.070 20 5 DGBDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000839182586 621343710 /nfs/dbraw/zinc/34/37/10/621343710.db2.gz NUGFPGFPOBGWPU-LBPRGKRZSA-N 2 0 311.813 3.070 20 5 DGBDRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077767 622792916 /nfs/dbraw/zinc/79/29/16/622792916.db2.gz AXTBSPZDRBSXJR-OLZOCXBDSA-N 2 0 309.385 3.116 20 5 DGBDRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000925881446 627811022 /nfs/dbraw/zinc/81/10/22/627811022.db2.gz BCFJDDKACJNRNP-XJNFMUPTSA-N 2 0 317.433 3.023 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c1 ZINC000843125827 630616271 /nfs/dbraw/zinc/61/62/71/630616271.db2.gz JHOFBBMNXKYEDL-STQMWFEESA-N 2 0 323.824 3.070 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000843125603 630616353 /nfs/dbraw/zinc/61/63/53/630616353.db2.gz YNTZGUWENLZJOP-QWHCGFSZSA-N 2 0 323.824 3.070 20 5 DGBDRP C[N@H+](CCC1CC[NH2+]CC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000843357098 630649371 /nfs/dbraw/zinc/64/93/71/630649371.db2.gz CHRIXYWNRLMGDC-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP C[C@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000261678286 656962226 /nfs/dbraw/zinc/96/22/26/656962226.db2.gz GTMVYLHTMUXEAH-QGZVFWFLSA-N 2 0 315.373 3.026 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC001574979580 1191461997 /nfs/dbraw/zinc/46/19/97/1191461997.db2.gz JLXGSJHZLBQEHN-UKYUDJEDSA-N 2 0 303.406 3.120 20 5 DGBDRP CCCC[NH+](CCCC)CCC[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168974937 1092474179 /nfs/dbraw/zinc/47/41/79/1092474179.db2.gz SZMZQMVRERVCLD-DLBZAZTESA-N 2 0 313.486 3.314 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C2CCCCC2)CC1 ZINC001168998326 1092478394 /nfs/dbraw/zinc/47/83/94/1092478394.db2.gz LHMKKGZDHUHXDP-UOVPBQLFSA-N 2 0 323.481 3.336 20 5 DGBDRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1OCCC[N+](C)(C)C ZINC001224624835 1096249195 /nfs/dbraw/zinc/24/91/95/1096249195.db2.gz ZUPVSTJBIOPALF-HKUYNNGSSA-N 2 0 305.486 3.010 20 5 DGBDRP C[C@@H]([C@H](OCCC[N+](C)(C)C)c1ccccc1)[NH+]1CCCC1 ZINC001224620195 1096249268 /nfs/dbraw/zinc/24/92/68/1096249268.db2.gz VGKAHROEPVQBPB-HKUYNNGSSA-N 2 0 305.486 3.325 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC001173219887 1097371161 /nfs/dbraw/zinc/37/11/61/1097371161.db2.gz QIMNRNOVGZLYGE-CQSZACIVSA-N 2 0 317.433 3.132 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001173228678 1097375948 /nfs/dbraw/zinc/37/59/48/1097375948.db2.gz JMYPERSJPGVDEX-WBVHZDCISA-N 2 0 319.449 3.367 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H](C)[NH2+]C ZINC001326034838 1103188977 /nfs/dbraw/zinc/18/89/77/1103188977.db2.gz APCFVEHMRUAEQQ-STQMWFEESA-N 2 0 311.451 3.053 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246635499 1104638935 /nfs/dbraw/zinc/63/89/35/1104638935.db2.gz ROJSLIWYZXNGMU-CRAIPNDOSA-N 2 0 317.433 3.134 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCC(CC[NH3+])CC1 ZINC001254549742 1106101463 /nfs/dbraw/zinc/10/14/63/1106101463.db2.gz YNSKYKOSBJOXHG-VQCLRJIVSA-N 2 0 305.422 3.023 20 5 DGBDRP CCC[N@H+](CCC[NH+](C)C)[C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC001254567984 1106106179 /nfs/dbraw/zinc/10/61/79/1106106179.db2.gz DTCJZZSADUGAQR-HNNXBMFYSA-N 2 0 307.438 3.190 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC001308570249 1111445455 /nfs/dbraw/zinc/44/54/55/1111445455.db2.gz KTWJHLWILSYZFU-CRAIPNDOSA-N 2 0 317.433 3.128 20 5 DGBDRP C[NH+]1CCC(C)(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000227328339 201798631 /nfs/dbraw/zinc/79/86/31/201798631.db2.gz BUDKDBKSFBLBLC-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000272579577 209998634 /nfs/dbraw/zinc/99/86/34/209998634.db2.gz QDMNPXUPYBPVAQ-OAHLLOKOSA-N 2 0 319.449 3.237 20 5 DGBDRP CC(C)N(CC[C@H]1CCC[N@@H+]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000179409408 432056993 /nfs/dbraw/zinc/05/69/93/432056993.db2.gz DRLSXUWVQXXODM-MRXNPFEDSA-N 2 0 305.422 3.290 20 5 DGBDRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543772 241166010 /nfs/dbraw/zinc/16/60/10/241166010.db2.gz CRQLBOKWMBNBTN-DLBZAZTESA-N 2 0 317.433 3.259 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000468654500 533408586 /nfs/dbraw/zinc/40/85/86/533408586.db2.gz YHKUJIKMLACUKA-KMPOOHAWSA-N 2 0 317.433 3.320 20 5 DGBDRP C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)C1CC[NH+](C)CC1 ZINC000611335953 400379829 /nfs/dbraw/zinc/37/98/29/400379829.db2.gz NTFPYBPJFRMSCH-OAHLLOKOSA-N 2 0 319.449 3.237 20 5 DGBDRP C[C@@H]1CCC[N@H+](CCCC[NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000602514076 400484660 /nfs/dbraw/zinc/48/46/60/400484660.db2.gz LDTQQTIOAYSTTO-MRXNPFEDSA-N 2 0 319.449 3.239 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CCC2 ZINC000591582594 400542931 /nfs/dbraw/zinc/54/29/31/400542931.db2.gz MYAFFCRSGVVZQD-YOEHRIQHSA-N 2 0 315.417 3.237 20 5 DGBDRP Cc1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000592433829 400649166 /nfs/dbraw/zinc/64/91/66/400649166.db2.gz ZADUROJDAPLGEH-SJORKVTESA-N 2 0 317.433 3.115 20 5 DGBDRP Cc1c(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000592492868 400658462 /nfs/dbraw/zinc/65/84/62/400658462.db2.gz FCQGMTXYBLWDQK-RDJZCZTQSA-N 2 0 317.433 3.115 20 5 DGBDRP C[N@@H+]1CCCC[C@@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599142301 400975083 /nfs/dbraw/zinc/97/50/83/400975083.db2.gz SVWQUNQMHVPXGX-ZDUSSCGKSA-N 2 0 314.389 3.287 20 5 DGBDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)C1 ZINC000247147057 432207714 /nfs/dbraw/zinc/20/77/14/432207714.db2.gz SRMFLWRBHMRNAF-WMLDXEAASA-N 2 0 305.422 3.367 20 5 DGBDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)C1 ZINC000151127222 432220820 /nfs/dbraw/zinc/22/08/20/432220820.db2.gz SRMFLWRBHMRNAF-YOEHRIQHSA-N 2 0 305.422 3.367 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000272592933 432530102 /nfs/dbraw/zinc/53/01/02/432530102.db2.gz SJCGYWFFQJBHSZ-CQSZACIVSA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1cc(NCC2=CC[N@H+](C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000273572166 432612911 /nfs/dbraw/zinc/61/29/11/432612911.db2.gz ALHBDOBPNDTLAL-UHFFFAOYSA-N 2 0 312.373 3.125 20 5 DGBDRP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000263845454 432584045 /nfs/dbraw/zinc/58/40/45/432584045.db2.gz ZKSSXRRKKWXVBK-GQCTYLIASA-N 2 0 315.417 3.215 20 5 DGBDRP CC[C@H]([NH2+]C[C@@H](C)Cn1ccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000178703810 432768902 /nfs/dbraw/zinc/76/89/02/432768902.db2.gz JPSAJGNZIPQIGC-DYVFJYSZSA-N 2 0 316.405 3.477 20 5 DGBDRP CN(Cc1ccc(Cl)cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000375758436 433555546 /nfs/dbraw/zinc/55/55/46/433555546.db2.gz AAINXYFTFVAHLE-YIONKMFJSA-N 2 0 323.824 3.305 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCCC1 ZINC000414846469 433875924 /nfs/dbraw/zinc/87/59/24/433875924.db2.gz SNHTZRSZVRYAST-AWEZNQCLSA-N 2 0 305.422 3.167 20 5 DGBDRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284182736 433855249 /nfs/dbraw/zinc/85/52/49/433855249.db2.gz RCUXYNALHSWIMZ-KBPBESRZSA-N 2 0 322.453 3.338 20 5 DGBDRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414878677 433900133 /nfs/dbraw/zinc/90/01/33/433900133.db2.gz OPGIHHBAIDVFHK-LLVKDONJSA-N 2 0 305.403 3.008 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414908279 433908165 /nfs/dbraw/zinc/90/81/65/433908165.db2.gz RLZNYZIDBDKXNV-UAGQMJEPSA-N 2 0 317.433 3.038 20 5 DGBDRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422915871 434107934 /nfs/dbraw/zinc/10/79/34/434107934.db2.gz BVUXIVWADYMGMM-DOTOQJQBSA-N 2 0 305.422 3.025 20 5 DGBDRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422915874 434109039 /nfs/dbraw/zinc/10/90/39/434109039.db2.gz BVUXIVWADYMGMM-WBVHZDCISA-N 2 0 305.422 3.025 20 5 DGBDRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422918507 434109881 /nfs/dbraw/zinc/10/98/81/434109881.db2.gz IJPOJLRWFHNFPY-IAGOWNOFSA-N 2 0 305.422 3.167 20 5 DGBDRP Cc1cc(N[C@H]2CC[N@H+](C)[C@H](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000322737227 434262322 /nfs/dbraw/zinc/26/23/22/434262322.db2.gz XKBMCBZBYZBBSM-OLZOCXBDSA-N 2 0 314.389 3.346 20 5 DGBDRP CCC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423206386 434284319 /nfs/dbraw/zinc/28/43/19/434284319.db2.gz BYAURTLOWPIYOI-KMFMINBZSA-N 2 0 305.422 3.414 20 5 DGBDRP O=[N+]([O-])c1cccc([C@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2)c1 ZINC000423347371 434374847 /nfs/dbraw/zinc/37/48/47/434374847.db2.gz QGPJSXRIMMUOTF-LJQANCHMSA-N 2 0 323.396 3.194 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423376930 434389385 /nfs/dbraw/zinc/38/93/85/434389385.db2.gz JKHOSZSAXJREKB-MGPQQGTHSA-N 2 0 323.462 3.325 20 5 DGBDRP C[NH+]1CCC(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417312162 434351474 /nfs/dbraw/zinc/35/14/74/434351474.db2.gz NEFRKNUIVZDESU-SFHVURJKSA-N 2 0 317.433 3.294 20 5 DGBDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000564973729 315216187 /nfs/dbraw/zinc/21/61/87/315216187.db2.gz PUBLCMIQVWXOIN-NEPJUHHUSA-N 2 0 303.362 3.070 20 5 DGBDRP CC(C)c1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2)cc1[N+](=O)[O-] ZINC000572762775 315815705 /nfs/dbraw/zinc/81/57/05/315815705.db2.gz DUSRITVQTBDLTO-UHFFFAOYSA-N 2 0 313.401 3.467 20 5 DGBDRP C[C@@H]1C[C@H](C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)CC[NH2+]1 ZINC000841004789 619148712 /nfs/dbraw/zinc/14/87/12/619148712.db2.gz XCUPITPEQFECIZ-VXGBXAGGSA-N 2 0 311.813 3.068 20 5 DGBDRP C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903878598 619827787 /nfs/dbraw/zinc/82/77/87/619827787.db2.gz JFLOCDQSUFKOTM-QXMXGUDHSA-N 2 0 323.824 3.211 20 5 DGBDRP C[NH+](C)C1(C)CCC([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000865765771 621991392 /nfs/dbraw/zinc/99/13/92/621991392.db2.gz LRXIMAHYTICISN-SOFGYWHQSA-N 2 0 317.433 3.461 20 5 DGBDRP CC[NH+]1CCC(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000873041545 623024166 /nfs/dbraw/zinc/02/41/66/623024166.db2.gz AZUGMGZFOQIQGQ-UHFFFAOYSA-N 2 0 305.422 3.033 20 5 DGBDRP [NH3+][C@H]1C[C@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000873258635 623094385 /nfs/dbraw/zinc/09/43/85/623094385.db2.gz SYIKGZRGEGKIEF-MZMPZRCHSA-N 2 0 311.385 3.011 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1[N+](=O)[O-] ZINC000873259720 623095233 /nfs/dbraw/zinc/09/52/33/623095233.db2.gz KHKPESWHTSUPQO-UGQVUOCMSA-N 2 0 303.406 3.084 20 5 DGBDRP Cc1c([C@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cccc1[N+](=O)[O-] ZINC000873263812 623096678 /nfs/dbraw/zinc/09/66/78/623096678.db2.gz KJWIKZKDUOCXPW-XQLPTFJDSA-N 2 0 303.406 3.084 20 5 DGBDRP CCC[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000873269674 623099375 /nfs/dbraw/zinc/09/93/75/623099375.db2.gz JLZKJAHGSRYSOE-GUYCJALGSA-N 2 0 305.422 3.414 20 5 DGBDRP Cc1ccc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)cc1[N+](=O)[O-] ZINC000877684996 623992072 /nfs/dbraw/zinc/99/20/72/623992072.db2.gz HPDPZVDBUKEEKU-UHFFFAOYSA-N 2 0 317.433 3.211 20 5 DGBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000879248923 624463826 /nfs/dbraw/zinc/46/38/26/624463826.db2.gz YWPHDQBQDJQIGR-OAHLLOKOSA-N 2 0 317.433 3.464 20 5 DGBDRP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788613559 625229858 /nfs/dbraw/zinc/22/98/58/625229858.db2.gz YEIIFHQWIWMTEN-LRDDRELGSA-N 2 0 322.453 3.194 20 5 DGBDRP CC(C)CC[NH+]1CCC(NCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000925310432 627729129 /nfs/dbraw/zinc/72/91/29/627729129.db2.gz AJXRZNOOEQLULD-UHFFFAOYSA-N 2 0 305.422 3.195 20 5 DGBDRP Cc1c(C[NH2+][C@H]2CC[NH2+]C[C@@H]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000925659014 627771705 /nfs/dbraw/zinc/77/17/05/627771705.db2.gz RUVCIUBAVPQZES-SJORKVTESA-N 2 0 317.433 3.161 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000843126028 630616296 /nfs/dbraw/zinc/61/62/96/630616296.db2.gz DWCPHHJHRUVWKE-ZDUSSCGKSA-N 2 0 323.824 3.070 20 5 DGBDRP Cc1cc(N2CCC[C@@H]([C@H](C)[NH3+])C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261958193 657257059 /nfs/dbraw/zinc/25/70/59/657257059.db2.gz XIYLZRDTLVRGNB-QWHCGFSZSA-N 2 0 314.389 3.015 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1-n1cc(CC[NH3+])c2ncccc21 ZINC001169710253 1081636353 /nfs/dbraw/zinc/63/63/53/1081636353.db2.gz HFBJRLLVPQCCOZ-UHFFFAOYSA-N 2 0 323.464 3.123 20 5 DGBDRP [NH2+]=C(Nc1ccc(-c2ccc([N+](=O)[O-])cc2)cc1)SCC[NH3+] ZINC001167912004 1084623594 /nfs/dbraw/zinc/62/35/94/1084623594.db2.gz IVBIUUQYTFSGHD-UHFFFAOYSA-N 2 0 316.386 3.300 20 5 DGBDRP CCCC[NH+](CCCC)CCC[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168974939 1092474527 /nfs/dbraw/zinc/47/45/27/1092474527.db2.gz SZMZQMVRERVCLD-IRXDYDNUSA-N 2 0 313.486 3.314 20 5 DGBDRP C[NH+](C)CC(C)(C)C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901615 1097268089 /nfs/dbraw/zinc/26/80/89/1097268089.db2.gz OZEBZOSWOVSDGI-MRXNPFEDSA-N 2 0 319.449 3.020 20 5 DGBDRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC001173228910 1097376216 /nfs/dbraw/zinc/37/62/16/1097376216.db2.gz NNCFITSFAZLLBD-DAYGRLMNSA-N 2 0 319.449 3.234 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246122343 1104395757 /nfs/dbraw/zinc/39/57/57/1104395757.db2.gz ADFGHKMLEJKRJE-GDBMZVCRSA-N 2 0 317.433 3.038 20 5 DGBDRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC001254550335 1106101651 /nfs/dbraw/zinc/10/16/51/1106101651.db2.gz HUWZARCSSSDCQK-INMHGKMJSA-N 2 0 319.449 3.234 20 5 DGBDRP C[C@H](C[NH2+][C@H]1Cc2ccc([N+](=O)[O-])cc2C1)CC(C)(C)CC[NH3+] ZINC001254580602 1106108248 /nfs/dbraw/zinc/10/82/48/1106108248.db2.gz HATGAEKUGAZACV-BBRMVZONSA-N 2 0 319.449 3.053 20 5 DGBDRP C[C@@H](C[NH2+][C@@H]1Cc2ccc([N+](=O)[O-])cc2C1)CC(C)(C)CC[NH3+] ZINC001254580604 1106108600 /nfs/dbraw/zinc/10/86/00/1106108600.db2.gz HATGAEKUGAZACV-CZUORRHYSA-N 2 0 319.449 3.053 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC1CC[NH+](C)CC1 ZINC000468630430 244056242 /nfs/dbraw/zinc/05/62/42/244056242.db2.gz HQTLJHHYLPYCPD-NTCAYCPXSA-N 2 0 317.433 3.320 20 5 DGBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000264391774 203896749 /nfs/dbraw/zinc/89/67/49/203896749.db2.gz ZEZGUPUCMBUAFP-CQSZACIVSA-N 2 0 323.437 3.204 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000468731989 533409999 /nfs/dbraw/zinc/40/99/99/533409999.db2.gz DVJBFVWLJHMOJO-KPJVXMDVSA-N 2 0 317.433 3.461 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000602020528 400404810 /nfs/dbraw/zinc/40/48/10/400404810.db2.gz LHPKIZFKSJPLOZ-IIAWOOMASA-N 2 0 305.422 3.023 20 5 DGBDRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc([N+](=O)[O-])cc1 ZINC000602022259 400406161 /nfs/dbraw/zinc/40/61/61/400406161.db2.gz SNBSXVFSZHNFSB-ZDUSSCGKSA-N 2 0 311.385 3.091 20 5 DGBDRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000592438260 400649519 /nfs/dbraw/zinc/64/95/19/400649519.db2.gz IAPATTBNGLNQEY-NWDGAFQWSA-N 2 0 303.362 3.070 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592493982 400658521 /nfs/dbraw/zinc/65/85/21/400658521.db2.gz YFEQXCANLCHRIM-OAGGEKHMSA-N 2 0 317.433 3.367 20 5 DGBDRP CCC[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000593324702 400819149 /nfs/dbraw/zinc/81/91/49/400819149.db2.gz YOVFRJNOSRUWRP-QGZVFWFLSA-N 2 0 305.422 3.415 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCCC[N@H+](C)C1 ZINC000599069313 400949203 /nfs/dbraw/zinc/94/92/03/400949203.db2.gz FZGOJRYROVDBEG-LSDHHAIUSA-N 2 0 305.422 3.286 20 5 DGBDRP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000599072931 400950866 /nfs/dbraw/zinc/95/08/66/400950866.db2.gz COILPYSFUZLKPZ-WMLDXEAASA-N 2 0 315.417 3.189 20 5 DGBDRP CC[NH+](CC)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000057847591 401031676 /nfs/dbraw/zinc/03/16/76/401031676.db2.gz IUBUFEWRDPFRCW-UHFFFAOYSA-N 2 0 319.449 3.191 20 5 DGBDRP C[N@@H+]1CCC[C@@H]2CN(C/C=C\c3ccccc3[N+](=O)[O-])CC[C@H]21 ZINC000255393958 401104831 /nfs/dbraw/zinc/10/48/31/401104831.db2.gz GJCKUFWFWRTEEF-BJESKFFQSA-N 2 0 315.417 3.024 20 5 DGBDRP CCC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000151111813 432219016 /nfs/dbraw/zinc/21/90/16/432219016.db2.gz PXDBTDDYQQRRES-LSDHHAIUSA-N 2 0 305.422 3.286 20 5 DGBDRP C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000346665663 264076311 /nfs/dbraw/zinc/07/63/11/264076311.db2.gz DGDVSDZDPSOOOE-OLZOCXBDSA-N 2 0 315.373 3.024 20 5 DGBDRP C[C@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@H]1[NH3+] ZINC000347106880 264157241 /nfs/dbraw/zinc/15/72/41/264157241.db2.gz MCOLTRHKXYRZEM-BLLLJJGKSA-N 2 0 315.373 3.024 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]CCC2=CC[NH2+]CC2)c2cc([N+](=O)[O-])ccc21 ZINC000423544555 273587426 /nfs/dbraw/zinc/58/74/26/273587426.db2.gz WYXVCCPGSVOOOW-QGZVFWFLSA-N 2 0 315.417 3.217 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000423376928 273748345 /nfs/dbraw/zinc/74/83/45/273748345.db2.gz JKHOSZSAXJREKB-BFHYXJOUSA-N 2 0 323.462 3.325 20 5 DGBDRP CC(C)[N@H+](C)CCC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000480187373 279354569 /nfs/dbraw/zinc/35/45/69/279354569.db2.gz CDIFINLTWJYIES-KRWDZBQOSA-N 2 0 319.449 3.236 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000420305410 433154344 /nfs/dbraw/zinc/15/43/44/433154344.db2.gz KDOVYMVVEDRNHP-WRFANHODSA-N 2 0 303.406 3.023 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000414173006 433438398 /nfs/dbraw/zinc/43/83/98/433438398.db2.gz FYBGVDHPXFQLGT-HUUCEWRRSA-N 2 0 305.422 3.286 20 5 DGBDRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449072417 433725698 /nfs/dbraw/zinc/72/56/98/433725698.db2.gz KDBRLDLRDJRAAU-HNNXBMFYSA-N 2 0 319.449 3.236 20 5 DGBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000414689812 433791395 /nfs/dbraw/zinc/79/13/95/433791395.db2.gz LVCOLRTTXYVQSM-HOCLYGCPSA-N 2 0 305.422 3.193 20 5 DGBDRP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414836523 433874569 /nfs/dbraw/zinc/87/45/69/433874569.db2.gz JNZDDJGUICYZHU-LBPRGKRZSA-N 2 0 319.430 3.268 20 5 DGBDRP CCC([NH3+])(CC)C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414812816 433855368 /nfs/dbraw/zinc/85/53/68/433855368.db2.gz RXICCJOOQJQHQK-HOCLYGCPSA-N 2 0 319.449 3.413 20 5 DGBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000414933991 433922820 /nfs/dbraw/zinc/92/28/20/433922820.db2.gz XNPPUKBLCFURAV-CHWSQXEVSA-N 2 0 315.373 3.214 20 5 DGBDRP CC(C)c1ccc(C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000414989500 433958089 /nfs/dbraw/zinc/95/80/89/433958089.db2.gz HFHYWUAPVUURJS-UKRRQHHQSA-N 2 0 305.422 3.325 20 5 DGBDRP O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000422785077 434000934 /nfs/dbraw/zinc/00/09/34/434000934.db2.gz JHHUHLCILQAIBL-IXDOHACOSA-N 2 0 317.433 3.038 20 5 DGBDRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000322820729 434261917 /nfs/dbraw/zinc/26/19/17/434261917.db2.gz CEKNZHNLJBETCJ-UCMJJCQDSA-N 2 0 303.406 3.261 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423213889 434292385 /nfs/dbraw/zinc/29/23/85/434292385.db2.gz KMGDNEBAAAPCHI-GZBFAFLISA-N 2 0 321.421 3.032 20 5 DGBDRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000423461312 434432398 /nfs/dbraw/zinc/43/23/98/434432398.db2.gz CCAGVUUIWDJWBS-MRRJBJDNSA-N 2 0 303.406 3.079 20 5 DGBDRP CC(C)c1ccc(CN(C)[C@@H]2CC[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000573486990 434903192 /nfs/dbraw/zinc/90/31/92/434903192.db2.gz DIIXBUDLWRORBA-WMLDXEAASA-N 2 0 319.449 3.490 20 5 DGBDRP CC(C)[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000523702274 434957398 /nfs/dbraw/zinc/95/73/98/434957398.db2.gz MFPOXRYNLDHZEI-UHFFFAOYSA-N 2 0 319.449 3.190 20 5 DGBDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000564973732 315216287 /nfs/dbraw/zinc/21/62/87/315216287.db2.gz PUBLCMIQVWXOIN-VXGBXAGGSA-N 2 0 303.362 3.070 20 5 DGBDRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000415024115 533869803 /nfs/dbraw/zinc/86/98/03/533869803.db2.gz OIXHLEBRMUPJCZ-GFCCVEGCSA-N 2 0 303.362 3.072 20 5 DGBDRP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CCCCC[NH+]1CCCC1 ZINC000584665444 547024065 /nfs/dbraw/zinc/02/40/65/547024065.db2.gz MZKAGEYCNSBDFF-KRWDZBQOSA-N 2 0 317.433 3.438 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@@H](n3ccnc3)C2)c1 ZINC000735492715 574704256 /nfs/dbraw/zinc/70/42/56/574704256.db2.gz SDMYVRZCDIGOTO-CQSZACIVSA-N 2 0 320.780 3.282 20 5 DGBDRP C[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])[C@@H]1CCC[NH3+] ZINC000852760263 620646681 /nfs/dbraw/zinc/64/66/81/620646681.db2.gz XGWHHKUYIAJIEH-IUODEOHRSA-N 2 0 309.385 3.073 20 5 DGBDRP CC(C)[NH+]1CCC([NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897463943 619130551 /nfs/dbraw/zinc/13/05/51/619130551.db2.gz CZCSFGDKJWTEGW-AWEZNQCLSA-N 2 0 305.422 3.161 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(C)(C)C[NH3+])CC1 ZINC000903790317 619811219 /nfs/dbraw/zinc/81/12/19/619811219.db2.gz BOPRVWNHBLXPCN-CYBMUJFWSA-N 2 0 305.422 3.353 20 5 DGBDRP [NH3+]CCC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000925490073 620987213 /nfs/dbraw/zinc/98/72/13/620987213.db2.gz ALYNGJZSFYFHOJ-GOSISDBHSA-N 2 0 313.401 3.207 20 5 DGBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000866282710 622084692 /nfs/dbraw/zinc/08/46/92/622084692.db2.gz PQYPIWNZIKKCBX-DAXOMENPSA-N 2 0 323.412 3.127 20 5 DGBDRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000768338068 622450904 /nfs/dbraw/zinc/45/09/04/622450904.db2.gz YKPAJTVYPCROJV-UHFFFAOYSA-N 2 0 313.401 3.288 20 5 DGBDRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000873252599 623091959 /nfs/dbraw/zinc/09/19/59/623091959.db2.gz SYIKGZRGEGKIEF-XCRHUMRWSA-N 2 0 311.385 3.011 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000873267245 623098092 /nfs/dbraw/zinc/09/80/92/623098092.db2.gz AJIVPCFODPNXES-OLZOCXBDSA-N 2 0 321.421 3.032 20 5 DGBDRP C[NH+]1CCC2(CC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)CC1 ZINC000878865406 624375584 /nfs/dbraw/zinc/37/55/84/624375584.db2.gz YHJWQQYGYGPYFT-UHFFFAOYSA-N 2 0 323.824 3.166 20 5 DGBDRP C[NH+](C)C1CCC([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000796839495 626088533 /nfs/dbraw/zinc/08/85/33/626088533.db2.gz PHFXLDLRLBPJNB-UHFFFAOYSA-N 2 0 311.813 3.211 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799177611 626277830 /nfs/dbraw/zinc/27/78/30/626277830.db2.gz YJFXKUONJITIIJ-HNNXBMFYSA-N 2 0 317.433 3.464 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC(C)(C)[NH3+] ZINC000925742451 627785894 /nfs/dbraw/zinc/78/58/94/627785894.db2.gz UFNRKMXAFPVBGW-LBPRGKRZSA-N 2 0 311.451 3.183 20 5 DGBDRP Cc1cc(N2CCC[C@H]([C@H](C)[NH3+])C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261958209 657257862 /nfs/dbraw/zinc/25/78/62/657257862.db2.gz XIYLZRDTLVRGNB-STQMWFEESA-N 2 0 314.389 3.015 20 5 DGBDRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC001576151928 1191533539 /nfs/dbraw/zinc/53/35/39/1191533539.db2.gz DWYUNMVSIBFDQD-YXWQFLTLSA-N 2 0 305.422 3.021 20 5 DGBDRP C[C@H](CC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])[NH+](C)C ZINC001658642125 1196283166 /nfs/dbraw/zinc/28/31/66/1196283166.db2.gz PWTYLCKZSXRBFJ-BFYDXBDKSA-N 2 0 319.449 3.236 20 5 DGBDRP CC[N@@H+]1CC[C@H](N(C)Cc2c(C)ccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC001663596025 1196910803 /nfs/dbraw/zinc/91/08/03/1196910803.db2.gz VUEPURWVOCGLFI-YOEHRIQHSA-N 2 0 319.449 3.374 20 5 DGBDRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1OCCC[N+](C)(C)C ZINC001224624839 1096248806 /nfs/dbraw/zinc/24/88/06/1096248806.db2.gz ZUPVSTJBIOPALF-MJGOQNOKSA-N 2 0 305.486 3.010 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246635500 1104638383 /nfs/dbraw/zinc/63/83/83/1104638383.db2.gz ROJSLIWYZXNGMU-MAUKXSAKSA-N 2 0 317.433 3.134 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001254548690 1106101140 /nfs/dbraw/zinc/10/11/40/1106101140.db2.gz KOEKONDCBPWAID-CVEARBPZSA-N 2 0 319.449 3.367 20 5 DGBDRP C[C@@H](C[NH2+][C@H]1Cc2ccc([N+](=O)[O-])cc2C1)CC(C)(C)CC[NH3+] ZINC001254580603 1106108506 /nfs/dbraw/zinc/10/85/06/1106108506.db2.gz HATGAEKUGAZACV-CJNGLKHVSA-N 2 0 319.449 3.053 20 5 DGBDRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC001320881463 1107175612 /nfs/dbraw/zinc/17/56/12/1107175612.db2.gz WJXJSWDHYMZTAP-RDTXWAMCSA-N 2 0 317.433 3.294 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000423279585 237838571 /nfs/dbraw/zinc/83/85/71/237838571.db2.gz ROGFCCZFMWFMSM-AEGPPILISA-N 2 0 321.421 3.162 20 5 DGBDRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000414933992 283584130 /nfs/dbraw/zinc/58/41/30/283584130.db2.gz XNPPUKBLCFURAV-OLZOCXBDSA-N 2 0 315.373 3.214 20 5 DGBDRP CCC[NH+]1CCC(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449133661 240032297 /nfs/dbraw/zinc/03/22/97/240032297.db2.gz ZKAWCDFFECUTLZ-HNNXBMFYSA-N 2 0 319.449 3.237 20 5 DGBDRP CCC[NH+]1CCC([NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000468620325 244057521 /nfs/dbraw/zinc/05/75/21/244057521.db2.gz JLVVNXKEZZRBNE-QINSGFPZSA-N 2 0 317.433 3.462 20 5 DGBDRP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000595043500 400086873 /nfs/dbraw/zinc/08/68/73/400086873.db2.gz GBPNJYSDROREES-HSBZDZAISA-N 2 0 321.421 3.127 20 5 DGBDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595304901 400123579 /nfs/dbraw/zinc/12/35/79/400123579.db2.gz DLPRWUYDLYWSKV-UHFFFAOYSA-N 2 0 323.412 3.286 20 5 DGBDRP C[NH+](C)CC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000611521956 400415589 /nfs/dbraw/zinc/41/55/89/400415589.db2.gz CYDDPPVAPLRMLT-MRXNPFEDSA-N 2 0 307.438 3.093 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)cc1[N+](=O)[O-] ZINC000596654897 400473016 /nfs/dbraw/zinc/47/30/16/400473016.db2.gz RBONJCPYSJOFEG-GXTWGEPZSA-N 2 0 309.410 3.018 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCC[NH2+]1 ZINC000591578080 400541453 /nfs/dbraw/zinc/54/14/53/400541453.db2.gz WFMMNBHJMVUHAO-KGLIPLIRSA-N 2 0 323.462 3.197 20 5 DGBDRP C[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@H]1CC[NH3+] ZINC000593316294 400817253 /nfs/dbraw/zinc/81/72/53/400817253.db2.gz OROGWYVSHCXZBH-ZTHSPGPESA-N 2 0 303.406 3.057 20 5 DGBDRP CC[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599072064 400950765 /nfs/dbraw/zinc/95/07/65/400950765.db2.gz XHNSTWHFDYCBIG-RHSMWYFYSA-N 2 0 305.422 3.367 20 5 DGBDRP C[N@@H+]1CC[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC000598965846 400915429 /nfs/dbraw/zinc/91/54/29/400915429.db2.gz NVDFVVQEPBAWNO-MRXNPFEDSA-N 2 0 319.449 3.380 20 5 DGBDRP Cc1ccc(C[NH2+]C[C@@H]2CCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000598997972 400924370 /nfs/dbraw/zinc/92/43/70/400924370.db2.gz AASLVAXIOYIQFY-INIZCTEOSA-N 2 0 303.406 3.010 20 5 DGBDRP [NH3+]C1(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCCC1 ZINC000594738035 401166149 /nfs/dbraw/zinc/16/61/49/401166149.db2.gz ATGZTKQSGUJSJX-ZBFHGGJFSA-N 2 0 317.433 3.167 20 5 DGBDRP Cc1cc(NCC(C)(C)C[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302181882 230145906 /nfs/dbraw/zinc/14/59/06/230145906.db2.gz NZJWIJOLCYNSCA-UHFFFAOYSA-N 2 0 316.405 3.451 20 5 DGBDRP C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000346642583 264071272 /nfs/dbraw/zinc/07/12/72/264071272.db2.gz MQQNPTJDMCYPIC-GXTWGEPZSA-N 2 0 315.373 3.024 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)cc1[N+](=O)[O-] ZINC000346827204 264104646 /nfs/dbraw/zinc/10/46/46/264104646.db2.gz HTRVSFTWZIJDKO-XIRDDKMYSA-N 2 0 317.433 3.277 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2cc([N+](=O)[O-])ccc21 ZINC000423479305 275860327 /nfs/dbraw/zinc/86/03/27/275860327.db2.gz MCJXNBMJRRWVKX-SUMWQHHRSA-N 2 0 317.433 3.439 20 5 DGBDRP CC1(C)C[C@H]([NH2+]C[C@@]2(C)CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc21 ZINC000423350995 275868161 /nfs/dbraw/zinc/86/81/61/275868161.db2.gz YIQYDOGPWVUVJF-WMZOPIPTSA-N 2 0 317.433 3.297 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000415014439 279254769 /nfs/dbraw/zinc/25/47/69/279254769.db2.gz MFNDUTHTUIUETI-BFYDXBDKSA-N 2 0 319.449 3.413 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000124361888 431891684 /nfs/dbraw/zinc/89/16/84/431891684.db2.gz LPVRNZOOMZMZJX-KGLIPLIRSA-N 2 0 303.406 3.038 20 5 DGBDRP Cc1nccn1CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000127414447 431971442 /nfs/dbraw/zinc/97/14/42/431971442.db2.gz QZOPCNSPNYIPEB-UHFFFAOYSA-N 2 0 314.389 3.154 20 5 DGBDRP C[C@H](NCc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185701705 432526080 /nfs/dbraw/zinc/52/60/80/432526080.db2.gz GDNMASZEYPHWQA-GOEBONIOSA-N 2 0 317.433 3.337 20 5 DGBDRP O=[N+]([O-])c1ccc(CN2CCC[C@H]([NH+]3CCCC3)CC2)c(F)c1 ZINC000267043620 432809177 /nfs/dbraw/zinc/80/91/77/432809177.db2.gz PKZNIMCQCSJLDR-HNNXBMFYSA-N 2 0 321.396 3.184 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1[N+](=O)[O-] ZINC000278412720 432894607 /nfs/dbraw/zinc/89/46/07/432894607.db2.gz HSIJHTSRWWPBFY-CQSZACIVSA-N 2 0 317.433 3.428 20 5 DGBDRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000414187214 433449044 /nfs/dbraw/zinc/44/90/44/433449044.db2.gz PRELIFLWUBFSJZ-KBXCAEBGSA-N 2 0 317.433 3.294 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421380235 433525681 /nfs/dbraw/zinc/52/56/81/433525681.db2.gz XVGIGCVXYTYZHJ-SDNWHVSQSA-N 2 0 317.433 3.461 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@@H]3C1)CCC2 ZINC000373024952 293252095 /nfs/dbraw/zinc/25/20/95/293252095.db2.gz ONHSDCXUXKYANI-IIDMSEBBSA-N 2 0 315.417 3.189 20 5 DGBDRP CC(C)[NH+]1CCC(N(C)Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000283418906 433721124 /nfs/dbraw/zinc/72/11/24/433721124.db2.gz FSOQRLDOTKKZCI-UHFFFAOYSA-N 2 0 309.385 3.039 20 5 DGBDRP CC(C)c1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1[N+](=O)[O-] ZINC000414981563 433954580 /nfs/dbraw/zinc/95/45/80/433954580.db2.gz YBAWBNZYOQJHHL-HNNXBMFYSA-N 2 0 305.422 3.340 20 5 DGBDRP CC[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[NH2+]1 ZINC000422926060 434112156 /nfs/dbraw/zinc/11/21/56/434112156.db2.gz WBFOPMSHTSFCSH-SJORKVTESA-N 2 0 305.422 3.038 20 5 DGBDRP CSC1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC[NH+](C)CC1 ZINC000353630307 434288865 /nfs/dbraw/zinc/28/88/65/434288865.db2.gz MOSFTARWXKMTKM-CYBMUJFWSA-N 2 0 323.462 3.073 20 5 DGBDRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000423284183 434337890 /nfs/dbraw/zinc/33/78/90/434337890.db2.gz WNHQDCPWHPUFMY-RRQGHBQHSA-N 2 0 303.406 3.079 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc21 ZINC000423283573 434341318 /nfs/dbraw/zinc/34/13/18/434341318.db2.gz XLLKFOKPUZVEGA-SUMWQHHRSA-N 2 0 317.433 3.297 20 5 DGBDRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000353750328 434394220 /nfs/dbraw/zinc/39/42/20/434394220.db2.gz HRJYMOLRGBTPNQ-GDBMZVCRSA-N 2 0 305.422 3.208 20 5 DGBDRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000519155155 435670751 /nfs/dbraw/zinc/67/07/51/435670751.db2.gz AICLJCRQGBNUMJ-NWDGAFQWSA-N 2 0 303.362 3.070 20 5 DGBDRP CC1(C)C[C@H]([NH2+]CCC[NH+]2CCCC2)c2cc([N+](=O)[O-])ccc21 ZINC000433158851 527741522 /nfs/dbraw/zinc/74/15/22/527741522.db2.gz CBQNWJQIXBKXTR-KRWDZBQOSA-N 2 0 317.433 3.393 20 5 DGBDRP COc1cc([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc([N+](=O)[O-])c1 ZINC000903189965 619737358 /nfs/dbraw/zinc/73/73/58/619737358.db2.gz MCFHNXGSEDFCSS-GRTSSRMGSA-N 2 0 321.421 3.127 20 5 DGBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCC[NH2+]C1 ZINC000903727504 619804767 /nfs/dbraw/zinc/80/47/67/619804767.db2.gz TZWCINJQDUUAJX-MRXNPFEDSA-N 2 0 305.422 3.195 20 5 DGBDRP [NH3+]CC1([C@@H]2CCCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000903815877 619814368 /nfs/dbraw/zinc/81/43/68/619814368.db2.gz TXCAZOMHRHYHLJ-KRWDZBQOSA-N 2 0 317.433 3.121 20 5 DGBDRP [NH3+]CC1([C@@H]2CCCCN2Cc2csc([N+](=O)[O-])c2)CCC1 ZINC000903813439 619818504 /nfs/dbraw/zinc/81/85/04/619818504.db2.gz GFLNGIARZBTVMQ-ZDUSSCGKSA-N 2 0 309.435 3.140 20 5 DGBDRP C[C@H]([NH2+]Cc1cc2c(s1)CC[NH2+]C2)c1ccc([N+](=O)[O-])cc1 ZINC000903987833 619852284 /nfs/dbraw/zinc/85/22/84/619852284.db2.gz KVCWPDXGGINIES-NSHDSACASA-N 2 0 317.414 3.153 20 5 DGBDRP [NH3+]CC[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000904406948 619920134 /nfs/dbraw/zinc/92/01/34/619920134.db2.gz YCQOBVWMQXXBNY-CYBMUJFWSA-N 2 0 315.373 3.026 20 5 DGBDRP CC(C)(C[NH3+])C1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000904442768 619923148 /nfs/dbraw/zinc/92/31/48/619923148.db2.gz HOTAONPXWVGUDO-FNORWQNLSA-N 2 0 317.433 3.305 20 5 DGBDRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000922848027 621108011 /nfs/dbraw/zinc/10/80/11/621108011.db2.gz KGGWQXGDXKUGLN-UHFFFAOYSA-N 2 0 303.406 3.091 20 5 DGBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000872083717 622795512 /nfs/dbraw/zinc/79/55/12/622795512.db2.gz NWJJQDVUUDZNLB-BZPMIXESSA-N 2 0 323.462 3.308 20 5 DGBDRP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000872254279 622868162 /nfs/dbraw/zinc/86/81/62/622868162.db2.gz YJHHAFULXRSAIE-LBPRGKRZSA-N 2 0 311.813 3.116 20 5 DGBDRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000873252598 623092117 /nfs/dbraw/zinc/09/21/17/623092117.db2.gz SYIKGZRGEGKIEF-RPVQJOFSSA-N 2 0 311.385 3.011 20 5 DGBDRP C[C@H]1CC2(C[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-])CC[NH2+]CC2 ZINC000818340690 628015633 /nfs/dbraw/zinc/01/56/33/628015633.db2.gz QNQQSOMGVDLEIA-LBPRGKRZSA-N 2 0 323.824 3.212 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843125602 630616251 /nfs/dbraw/zinc/61/62/51/630616251.db2.gz YNTZGUWENLZJOP-OLZOCXBDSA-N 2 0 323.824 3.070 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC([C@H]3CC[NH2+]C3)CC2)c1 ZINC000843127856 630617157 /nfs/dbraw/zinc/61/71/57/630617157.db2.gz UCHUIALQENCLPP-ZDUSSCGKSA-N 2 0 323.824 3.070 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CCCC[C@@]2(C[NH3+])C1 ZINC001576315826 1191559324 /nfs/dbraw/zinc/55/93/24/1191559324.db2.gz MWJCPQVUPAKYSK-CKEIUWERSA-N 2 0 303.406 3.107 20 5 DGBDRP C[C@@H](C[NH+](C)C)[C@@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001183065896 1083873687 /nfs/dbraw/zinc/87/36/87/1083873687.db2.gz RDVOLVZAVZIKIE-YJBOKZPZSA-N 2 0 319.449 3.190 20 5 DGBDRP O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]CC2CC[NH+](C3CCCCC3)CC2)C1 ZINC001168978004 1092456433 /nfs/dbraw/zinc/45/64/33/1092456433.db2.gz NNPJDIKXYKNWAF-SJORKVTESA-N 2 0 323.481 3.066 20 5 DGBDRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1OCC[N+](C)(C)C ZINC001224771288 1096282257 /nfs/dbraw/zinc/28/22/57/1096282257.db2.gz ILEDDAPFBUSQOZ-SFHVURJKSA-N 2 0 305.486 3.010 20 5 DGBDRP C[C@@H](C[N+](C)(C)C)OC[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001224826914 1096295397 /nfs/dbraw/zinc/29/53/97/1096295397.db2.gz STRKTNGDXSPNHC-HKUYNNGSSA-N 2 0 305.486 3.010 20 5 DGBDRP C[C@@H](C[N+](C)(C)C)Oc1ccc2ccccc2c1C[NH+](C)C ZINC001228441928 1097122000 /nfs/dbraw/zinc/12/20/00/1097122000.db2.gz OIJAYTLBVYKJRX-HNNXBMFYSA-N 2 0 301.454 3.375 20 5 DGBDRP CC[NH+](CC)CCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899259 1097267556 /nfs/dbraw/zinc/26/75/56/1097267556.db2.gz VVJSXGRWVWZJSZ-KRWDZBQOSA-N 2 0 319.449 3.164 20 5 DGBDRP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC001326075890 1103201444 /nfs/dbraw/zinc/20/14/44/1103201444.db2.gz MRIQIEMHNDQQJK-LBPRGKRZSA-N 2 0 319.430 3.411 20 5 DGBDRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC001329643396 1104358315 /nfs/dbraw/zinc/35/83/15/1104358315.db2.gz OEMAXGMWIJGANF-GFCCVEGCSA-N 2 0 309.385 3.116 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246635502 1104638020 /nfs/dbraw/zinc/63/80/20/1104638020.db2.gz ROJSLIWYZXNGMU-YJBOKZPZSA-N 2 0 317.433 3.134 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])n1cc(CC[NH3+])c2c[nH+]ccc21 ZINC001254545819 1106100767 /nfs/dbraw/zinc/10/07/67/1106100767.db2.gz DBOSTZKOUNGNTL-CYBMUJFWSA-N 2 0 324.384 3.249 20 5 DGBDRP Cc1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000092381063 185314961 /nfs/dbraw/zinc/31/49/61/185314961.db2.gz OMRUFBUHKXNWNI-UHFFFAOYSA-N 2 0 305.422 3.067 20 5 DGBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000415027545 237019592 /nfs/dbraw/zinc/01/95/92/237019592.db2.gz BBILSKHJTHIHNP-OHFALNGGSA-N 2 0 317.433 3.023 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000468602816 244057021 /nfs/dbraw/zinc/05/70/21/244057021.db2.gz ZTLUVFWPIWFRSR-PTNGSMBKSA-N 2 0 317.433 3.320 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000468648020 533410008 /nfs/dbraw/zinc/41/00/08/533410008.db2.gz MWOPCPYEUYZAIG-PNUWANSTSA-N 2 0 315.417 3.215 20 5 DGBDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000609133617 400142940 /nfs/dbraw/zinc/14/29/40/400142940.db2.gz MZOFQMSHZXAAOP-UHFFFAOYSA-N 2 0 305.422 3.147 20 5 DGBDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000315455229 400145288 /nfs/dbraw/zinc/14/52/88/400145288.db2.gz YTEDBCJIOZZLEB-AWEZNQCLSA-N 2 0 305.422 3.286 20 5 DGBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000596111351 400319710 /nfs/dbraw/zinc/31/97/10/400319710.db2.gz WEQZWCUXXOEWTI-DJIMGWMZSA-N 2 0 319.449 3.269 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)cc1[N+](=O)[O-] ZINC000602019738 400405214 /nfs/dbraw/zinc/40/52/14/400405214.db2.gz HCGCTDQWUBNZBY-YDHLFZDLSA-N 2 0 321.421 3.162 20 5 DGBDRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000602513697 400484439 /nfs/dbraw/zinc/48/44/39/400484439.db2.gz GTOSMMHIOLLQPH-INIZCTEOSA-N 2 0 319.449 3.382 20 5 DGBDRP C[C@H]1CCC[N@H+](CCCC[NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000602514073 400484832 /nfs/dbraw/zinc/48/48/32/400484832.db2.gz LDTQQTIOAYSTTO-INIZCTEOSA-N 2 0 319.449 3.239 20 5 DGBDRP C[N@H+](CCCC[NH+]1CCCCC1)Cc1ccccc1[N+](=O)[O-] ZINC000603111409 400643499 /nfs/dbraw/zinc/64/34/99/400643499.db2.gz QQRQPMXBSXUMAG-UHFFFAOYSA-N 2 0 305.422 3.293 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000075645039 400600400 /nfs/dbraw/zinc/60/04/00/400600400.db2.gz NYZQKBGODWEBBJ-CQSZACIVSA-N 2 0 305.422 3.320 20 5 DGBDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000592438264 400648755 /nfs/dbraw/zinc/64/87/55/400648755.db2.gz IAPATTBNGLNQEY-VXGBXAGGSA-N 2 0 303.362 3.070 20 5 DGBDRP Cc1ccc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000592433828 400648830 /nfs/dbraw/zinc/64/88/30/400648830.db2.gz ZADUROJDAPLGEH-IRXDYDNUSA-N 2 0 317.433 3.115 20 5 DGBDRP O=[N+]([O-])c1c(N[C@H]2CC[N@H+](CC3CC3)C2)ccc2cnccc21 ZINC000599043464 400936611 /nfs/dbraw/zinc/93/66/11/400936611.db2.gz RZCVRFNMEQDVBW-AWEZNQCLSA-N 2 0 312.373 3.039 20 5 DGBDRP CC[NH+]1CCC(C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000615721221 401143652 /nfs/dbraw/zinc/14/36/52/401143652.db2.gz AMHRZRGFIZPOLX-PTNGSMBKSA-N 2 0 317.433 3.320 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000364448478 287027908 /nfs/dbraw/zinc/02/79/08/287027908.db2.gz QKWZQFOJOPZPDI-OIISXLGYSA-N 2 0 317.433 3.132 20 5 DGBDRP Cc1cc(N2CCC[C@@H](CC[NH3+])C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261967469 165773230 /nfs/dbraw/zinc/77/32/30/165773230.db2.gz YNDPSNLSPNLFLP-ZDUSSCGKSA-N 2 0 314.389 3.017 20 5 DGBDRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000346678641 264078710 /nfs/dbraw/zinc/07/87/10/264078710.db2.gz MKOAXQBODSROGM-QWHCGFSZSA-N 2 0 315.373 3.024 20 5 DGBDRP Cc1cc(N2CCC[C@@H]([C@@H](C)[NH3+])C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261958164 274705340 /nfs/dbraw/zinc/70/53/40/274705340.db2.gz XIYLZRDTLVRGNB-CHWSQXEVSA-N 2 0 314.389 3.015 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH+](C)C ZINC000271106628 432330831 /nfs/dbraw/zinc/33/08/31/432330831.db2.gz GHGORYSYAOAHJE-ZDUSSCGKSA-N 2 0 311.451 3.007 20 5 DGBDRP Cc1nccn1C[C@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000178701370 432768971 /nfs/dbraw/zinc/76/89/71/432768971.db2.gz LSPCPDLRUGYTAX-OCCSQVGLSA-N 2 0 316.405 3.395 20 5 DGBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279214400 432946088 /nfs/dbraw/zinc/94/60/88/432946088.db2.gz YNSDUPQWDZYPLB-CXAGYDPISA-N 2 0 317.433 3.249 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]CCCC[N@H+](C)C2CC2)cccc1[N+](=O)[O-] ZINC000453396436 433152591 /nfs/dbraw/zinc/15/25/91/433152591.db2.gz ITPCNWSOELNPDA-CQSZACIVSA-N 2 0 305.422 3.428 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-] ZINC000414176438 433439899 /nfs/dbraw/zinc/43/98/99/433439899.db2.gz IZZIEPYUFDCJHZ-HUUCEWRRSA-N 2 0 305.422 3.286 20 5 DGBDRP CC[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000414188361 433449590 /nfs/dbraw/zinc/44/95/90/433449590.db2.gz QPAAMTNWANWQAR-WMLDXEAASA-N 2 0 305.422 3.367 20 5 DGBDRP CCCC[NH+]1CCC([NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449099337 433724035 /nfs/dbraw/zinc/72/40/35/433724035.db2.gz NGILIEDEQIZOBX-OAHLLOKOSA-N 2 0 319.449 3.380 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000414795284 433838665 /nfs/dbraw/zinc/83/86/65/433838665.db2.gz GMFVNEVABCKISN-KBMXLJTQSA-N 2 0 305.422 3.023 20 5 DGBDRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000414932222 433920486 /nfs/dbraw/zinc/92/04/86/433920486.db2.gz VNTYMHFAJNYSHQ-ORQFMDKSSA-N 2 0 317.433 3.166 20 5 DGBDRP CC(C)c1ccc(C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000414989501 433958808 /nfs/dbraw/zinc/95/88/08/433958808.db2.gz HFHYWUAPVUURJS-ZFWWWQNUSA-N 2 0 305.422 3.325 20 5 DGBDRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000422792657 434005777 /nfs/dbraw/zinc/00/57/77/434005777.db2.gz RHFVCGXTEZCQQK-GDBMZVCRSA-N 2 0 305.422 3.038 20 5 DGBDRP CN(CCC[N@H+](C)Cc1ccco1)Cc1ccccc1[N+](=O)[O-] ZINC000285746837 434055438 /nfs/dbraw/zinc/05/54/38/434055438.db2.gz RJPQCWWEZSMPLA-UHFFFAOYSA-N 2 0 317.389 3.142 20 5 DGBDRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423039440 434184674 /nfs/dbraw/zinc/18/46/74/434184674.db2.gz FLJUYYQRFJZIPK-UONOGXRCSA-N 2 0 311.813 3.040 20 5 DGBDRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417303268 434350252 /nfs/dbraw/zinc/35/02/52/434350252.db2.gz ADBWWXUDJSEIGF-SFHVURJKSA-N 2 0 315.417 3.214 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1[N+](=O)[O-] ZINC000423491513 434456323 /nfs/dbraw/zinc/45/63/23/434456323.db2.gz ZHLBOEFPHCZYBS-DZGCQCFKSA-N 2 0 321.421 3.176 20 5 DGBDRP Cc1ccc(CN2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000354077921 434606206 /nfs/dbraw/zinc/60/62/06/434606206.db2.gz KNIZUFASJSAXRL-KRWDZBQOSA-N 2 0 317.433 3.067 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000420324020 301865784 /nfs/dbraw/zinc/86/57/84/301865784.db2.gz AMDAQPVZSVTBPV-CQSZACIVSA-N 2 0 303.406 3.040 20 5 DGBDRP [NH3+]CCC[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000415060725 534621116 /nfs/dbraw/zinc/62/11/16/534621116.db2.gz XJPNTGFFIKMLFO-CQSZACIVSA-N 2 0 305.403 3.226 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000415069954 534887802 /nfs/dbraw/zinc/88/78/02/534887802.db2.gz PRWRVHKITSJWPP-YOEHRIQHSA-N 2 0 317.433 3.038 20 5 DGBDRP CC[N@@H+]1CCC[C@@H](C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000468621819 535526343 /nfs/dbraw/zinc/52/63/43/535526343.db2.gz ZCCAKTPYIUHCFN-MJSCBBHESA-N 2 0 317.433 3.320 20 5 DGBDRP C[C@H](C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000902428320 619634225 /nfs/dbraw/zinc/63/42/25/619634225.db2.gz BULKSIIIEWTMAI-DQYPLSBCSA-N 2 0 311.385 3.433 20 5 DGBDRP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCC([NH+](C)C)CC1 ZINC000866377245 622106552 /nfs/dbraw/zinc/10/65/52/622106552.db2.gz DVHDCKIOBHKHKK-JQRITLKVSA-N 2 0 323.412 3.127 20 5 DGBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000872033780 622764943 /nfs/dbraw/zinc/76/49/43/622764943.db2.gz JIRSKBKULCIGJB-LBPRGKRZSA-N 2 0 323.462 3.309 20 5 DGBDRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077667 622792668 /nfs/dbraw/zinc/79/26/68/622792668.db2.gz KVMRILWWSFYVCN-GFCCVEGCSA-N 2 0 309.385 3.259 20 5 DGBDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000801515047 626406515 /nfs/dbraw/zinc/40/65/15/626406515.db2.gz ULODNPPATTXUGF-UHFFFAOYSA-N 2 0 323.412 3.286 20 5 DGBDRP [NH3+]CCC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000925514035 627744989 /nfs/dbraw/zinc/74/49/89/627744989.db2.gz MHWYZXPMBDIQRX-KRWDZBQOSA-N 2 0 313.401 3.207 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@]13CCC[C@H]1[NH2+]CC3)CCC2 ZINC000925840054 627804501 /nfs/dbraw/zinc/80/45/01/627804501.db2.gz KBWOBBBLYPOUAP-KZNAEPCWSA-N 2 0 315.417 3.094 20 5 DGBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@]13CCC[C@H]1[NH2+]CC3)CCC2 ZINC000925840055 627804508 /nfs/dbraw/zinc/80/45/08/627804508.db2.gz KBWOBBBLYPOUAP-RCCFBDPRSA-N 2 0 315.417 3.094 20 5 DGBDRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000824913860 628705541 /nfs/dbraw/zinc/70/55/41/628705541.db2.gz GYZDWSQYDZMKTI-UHFFFAOYSA-N 2 0 313.829 3.458 20 5 DGBDRP C[N@H+](CC[C@H]1CCC[NH2+]C1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000842471778 630538742 /nfs/dbraw/zinc/53/87/42/630538742.db2.gz ZGUSGDGOXFURBA-GFCCVEGCSA-N 2 0 311.813 3.070 20 5 DGBDRP C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@H]1CC[NH3+] ZINC000844902655 630973348 /nfs/dbraw/zinc/97/33/48/630973348.db2.gz URDHPGHJYZCAIR-RISCZKNCSA-N 2 0 311.813 3.198 20 5 DGBDRP Cc1c(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC001335584992 1178933494 /nfs/dbraw/zinc/93/34/94/1178933494.db2.gz ZMKWKKKEASCJLL-BBWFWOEESA-N 2 0 317.433 3.065 20 5 DGBDRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC001576151925 1191533141 /nfs/dbraw/zinc/53/31/41/1191533141.db2.gz DWYUNMVSIBFDQD-AYDFFVQHSA-N 2 0 305.422 3.021 20 5 DGBDRP CC[NH+]1CCC(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC001660095936 1196444759 /nfs/dbraw/zinc/44/47/59/1196444759.db2.gz BFEIGTLWVZRINB-AWEZNQCLSA-N 2 0 305.422 3.020 20 5 DGBDRP C[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1OCCC[N+](C)(C)C ZINC001224618437 1096247821 /nfs/dbraw/zinc/24/78/21/1096247821.db2.gz HHBWPKGYRYSBCU-HKUYNNGSSA-N 2 0 305.486 3.010 20 5 DGBDRP C[N+](C)(C)CCCO[C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC001224621057 1096248903 /nfs/dbraw/zinc/24/89/03/1096248903.db2.gz JNQIJZZQABVNSN-XUVXKRRUSA-N 2 0 317.497 3.010 20 5 DGBDRP C[NH+](C)CC(C)(C)C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901614 1097268224 /nfs/dbraw/zinc/26/82/24/1097268224.db2.gz OZEBZOSWOVSDGI-INIZCTEOSA-N 2 0 319.449 3.020 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001173228675 1097375969 /nfs/dbraw/zinc/37/59/69/1097375969.db2.gz JMYPERSJPGVDEX-DOTOQJQBSA-N 2 0 319.449 3.367 20 5 DGBDRP CCC[N@H+](CCC[NH+](C)C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173231151 1097377707 /nfs/dbraw/zinc/37/77/07/1097377707.db2.gz JYFQOZIMIYYAOG-OAHLLOKOSA-N 2 0 307.438 3.190 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246635501 1104637920 /nfs/dbraw/zinc/63/79/20/1104637920.db2.gz ROJSLIWYZXNGMU-QAPCUYQASA-N 2 0 317.433 3.134 20 5 DGBDRP C[NH+](C)CCC1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000092380978 185314850 /nfs/dbraw/zinc/31/48/50/185314850.db2.gz IYZZFMIKNPRBNR-FNORWQNLSA-N 2 0 317.433 3.272 20 5 DGBDRP CCC[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000121197601 185762932 /nfs/dbraw/zinc/76/29/32/185762932.db2.gz NANWOUVACBYKRQ-KRWDZBQOSA-N 2 0 305.422 3.367 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1[N+](=O)[O-] ZINC000278412718 186486343 /nfs/dbraw/zinc/48/63/43/186486343.db2.gz HSIJHTSRWWPBFY-AWEZNQCLSA-N 2 0 317.433 3.428 20 5 DGBDRP Cc1ccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1[N+](=O)[O-] ZINC000415055879 237042662 /nfs/dbraw/zinc/04/26/62/237042662.db2.gz PFCMGFVCPOZMDG-QGZVFWFLSA-N 2 0 313.401 3.473 20 5 DGBDRP [NH3+]CCC[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000415060724 237046257 /nfs/dbraw/zinc/04/62/57/237046257.db2.gz XJPNTGFFIKMLFO-AWEZNQCLSA-N 2 0 305.403 3.226 20 5 DGBDRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000415042857 237025435 /nfs/dbraw/zinc/02/54/35/237025435.db2.gz RIOOQNYKRGMOHD-QWHCGFSZSA-N 2 0 315.373 3.072 20 5 DGBDRP CCCC[NH+]1CCC([NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449099335 240016926 /nfs/dbraw/zinc/01/69/26/240016926.db2.gz NGILIEDEQIZOBX-HNNXBMFYSA-N 2 0 319.449 3.380 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000468623400 244056515 /nfs/dbraw/zinc/05/65/15/244056515.db2.gz WNIUHHPSLSQZPB-PTNGSMBKSA-N 2 0 317.433 3.461 20 5 DGBDRP CC[NH+](CC)CCC[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000468636173 244057253 /nfs/dbraw/zinc/05/72/53/244057253.db2.gz XYFHDWIFIBVRKV-QINSGFPZSA-N 2 0 305.422 3.320 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)C1CC1 ZINC000423484867 285161951 /nfs/dbraw/zinc/16/19/51/285161951.db2.gz REPOROWSTZMMHO-IRXDYDNUSA-N 2 0 317.433 3.038 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000468650668 533384870 /nfs/dbraw/zinc/38/48/70/533384870.db2.gz VFKCSVCJGLXUJR-ZMTKHRCCSA-N 2 0 303.406 3.070 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595901632 400291118 /nfs/dbraw/zinc/29/11/18/400291118.db2.gz ZHNLDBQFDHOCOB-GDBMZVCRSA-N 2 0 317.433 3.367 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCC[NH2+]CC1 ZINC000591278476 400505754 /nfs/dbraw/zinc/50/57/54/400505754.db2.gz GEOOWJFVNXQSCS-BHYGNILZSA-N 2 0 317.433 3.038 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000591278477 400505782 /nfs/dbraw/zinc/50/57/82/400505782.db2.gz GEOOWJFVNXQSCS-UAGQMJEPSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000592438257 400649526 /nfs/dbraw/zinc/64/95/26/400649526.db2.gz IAPATTBNGLNQEY-NEPJUHHUSA-N 2 0 303.362 3.070 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592493981 400658171 /nfs/dbraw/zinc/65/81/71/400658171.db2.gz YFEQXCANLCHRIM-BZUAXINKSA-N 2 0 317.433 3.367 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000599071787 400950447 /nfs/dbraw/zinc/95/04/47/400950447.db2.gz SWIZXRNBOVTKAJ-CVEARBPZSA-N 2 0 319.449 3.237 20 5 DGBDRP CC[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599072063 400950487 /nfs/dbraw/zinc/95/04/87/400950487.db2.gz XHNSTWHFDYCBIG-PBHICJAKSA-N 2 0 305.422 3.367 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000599071788 400950836 /nfs/dbraw/zinc/95/08/36/400950836.db2.gz SWIZXRNBOVTKAJ-HOTGVXAUSA-N 2 0 319.449 3.237 20 5 DGBDRP C[NH+]1CCC2(CCC[N@@H+]2C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000616007418 401195661 /nfs/dbraw/zinc/19/56/61/401195661.db2.gz PSZKCCHNNVAOLT-DAXSKMNVSA-N 2 0 315.417 3.168 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)C2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000090217590 401263124 /nfs/dbraw/zinc/26/31/24/401263124.db2.gz WTPMAQQCQITYID-UONOGXRCSA-N 2 0 305.422 3.284 20 5 DGBDRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346655328 264073820 /nfs/dbraw/zinc/07/38/20/264073820.db2.gz FZHZFZKHIAWYTO-CHWSQXEVSA-N 2 0 315.373 3.024 20 5 DGBDRP C[N@H+]1CC=C(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000279144466 277023589 /nfs/dbraw/zinc/02/35/89/277023589.db2.gz SEGIHZMHQZLDET-KRWDZBQOSA-N 2 0 315.417 3.169 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000449218660 279381788 /nfs/dbraw/zinc/38/17/88/279381788.db2.gz KLEGOINMIHLQPT-CYBMUJFWSA-N 2 0 319.449 3.425 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152426886 432332882 /nfs/dbraw/zinc/33/28/82/432332882.db2.gz SQRNRFVDWRUYIO-KGLIPLIRSA-N 2 0 303.406 3.038 20 5 DGBDRP Cc1cc(NC[C@]2(C)CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261914485 432459523 /nfs/dbraw/zinc/45/95/23/432459523.db2.gz QQOGMXRWMLWEKB-QGZVFWFLSA-N 2 0 314.389 3.253 20 5 DGBDRP C[C@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000261787454 432451504 /nfs/dbraw/zinc/45/15/04/432451504.db2.gz UOMLJDWWVATJCR-QGZVFWFLSA-N 2 0 315.373 3.026 20 5 DGBDRP Cc1cc(NC[C@@]2(C)CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261914483 432459934 /nfs/dbraw/zinc/45/99/34/432459934.db2.gz QQOGMXRWMLWEKB-KRWDZBQOSA-N 2 0 314.389 3.253 20 5 DGBDRP Cc1nccn1C[C@H](C)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178705248 432768384 /nfs/dbraw/zinc/76/83/84/432768384.db2.gz MDAKYXKFRUGPBD-CHWSQXEVSA-N 2 0 302.378 3.087 20 5 DGBDRP Cc1nccn1C[C@@H](C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000178701378 432768740 /nfs/dbraw/zinc/76/87/40/432768740.db2.gz LSPCPDLRUGYTAX-GXTWGEPZSA-N 2 0 316.405 3.395 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c(Cl)c1 ZINC000278104201 432884566 /nfs/dbraw/zinc/88/45/66/432884566.db2.gz AKGAYCXUVLRZSK-UHFFFAOYSA-N 2 0 323.824 3.212 20 5 DGBDRP C[NH+](C)CCCC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278960556 432921855 /nfs/dbraw/zinc/92/18/55/432921855.db2.gz BGJZYJMAUXONNH-MRXNPFEDSA-N 2 0 305.422 3.249 20 5 DGBDRP Cc1c(C[N@H+]2CCC[C@@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000373115435 433095251 /nfs/dbraw/zinc/09/52/51/433095251.db2.gz KOKZOIZUQNXBMY-OAHLLOKOSA-N 2 0 314.389 3.016 20 5 DGBDRP C[N@H+](CCCC[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000453592932 433224382 /nfs/dbraw/zinc/22/43/82/433224382.db2.gz FYBMQCUNVPESBT-VURMDHGXSA-N 2 0 303.406 3.072 20 5 DGBDRP C[NH+]1CCC2(CCC[N@@H+]2C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000375507679 433482830 /nfs/dbraw/zinc/48/28/30/433482830.db2.gz PSZKCCHNNVAOLT-QPJJXVBHSA-N 2 0 315.417 3.168 20 5 DGBDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000414910440 433914272 /nfs/dbraw/zinc/91/42/72/433914272.db2.gz CVDZWDHZEPFCKU-KBPBESRZSA-N 2 0 315.373 3.214 20 5 DGBDRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC[NH2+]1 ZINC000414955899 433934654 /nfs/dbraw/zinc/93/46/54/433934654.db2.gz UWVSFLXZNJNNIH-WTTBNOFXSA-N 2 0 317.433 3.036 20 5 DGBDRP C[NH2+]CCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414858553 433889227 /nfs/dbraw/zinc/88/92/27/433889227.db2.gz JZAJWERHONVYJW-UHFFFAOYSA-N 2 0 305.403 3.022 20 5 DGBDRP CCC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423206388 434286287 /nfs/dbraw/zinc/28/62/87/434286287.db2.gz BYAURTLOWPIYOI-QRTARXTBSA-N 2 0 305.422 3.414 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000353647418 434297619 /nfs/dbraw/zinc/29/76/19/434297619.db2.gz RYXYNBWFAKFMPU-IUDNXUCKSA-N 2 0 305.422 3.427 20 5 DGBDRP C[C@H](C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21)C[NH+](C)C ZINC000417353444 434363713 /nfs/dbraw/zinc/36/37/13/434363713.db2.gz XHALQHYSTOLBJT-DYVFJYSZSA-N 2 0 305.422 3.150 20 5 DGBDRP CC1(C)C[C@H]([NH2+]CC2(C)CC[NH2+]CC2)c2cc([N+](=O)[O-])ccc21 ZINC000423329531 434366623 /nfs/dbraw/zinc/36/66/23/434366623.db2.gz MUXHOJJYXNVASO-INIZCTEOSA-N 2 0 317.433 3.297 20 5 DGBDRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000395746774 434417959 /nfs/dbraw/zinc/41/79/59/434417959.db2.gz XHOBWAKGMRORAW-UHFFFAOYSA-N 2 0 313.829 3.458 20 5 DGBDRP Cc1ccc([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-] ZINC000296059265 434495707 /nfs/dbraw/zinc/49/57/07/434495707.db2.gz VSPJKDPFXPJMBN-OHRKKDJYSA-N 2 0 303.406 3.179 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459777182 434715461 /nfs/dbraw/zinc/71/54/61/434715461.db2.gz KGDGDXQBKDZCOM-CVEARBPZSA-N 2 0 319.449 3.237 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459785456 434719492 /nfs/dbraw/zinc/71/94/92/434719492.db2.gz OORKCHZTHVMGHE-UVQBRAAOSA-N 2 0 317.433 3.320 20 5 DGBDRP CC(C)c1ccc(CN(C)[C@@H]2CC[N@H+](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000573486989 434902568 /nfs/dbraw/zinc/90/25/68/434902568.db2.gz DIIXBUDLWRORBA-RHSMWYFYSA-N 2 0 319.449 3.490 20 5 DGBDRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000536867825 435416724 /nfs/dbraw/zinc/41/67/24/435416724.db2.gz FJIOSDRFIUNMBH-IIDMSEBBSA-N 2 0 319.449 3.236 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000576742576 316162101 /nfs/dbraw/zinc/16/21/01/316162101.db2.gz VKUCKXQHLJBEFH-BAPRJRNISA-N 2 0 317.433 3.318 20 5 DGBDRP C[NH+](C)C1CCC([NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000583092838 324312813 /nfs/dbraw/zinc/31/28/13/324312813.db2.gz ALIIVCITVGCGCK-SEEARECTSA-N 2 0 303.406 3.045 20 5 DGBDRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000415018109 533874116 /nfs/dbraw/zinc/87/41/16/533874116.db2.gz GJLGRHOFMOLDOU-YCPHGPKFSA-N 2 0 305.422 3.023 20 5 DGBDRP CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CCC[NH2+]CC1 ZINC000435389973 527870814 /nfs/dbraw/zinc/87/08/14/527870814.db2.gz NRBZIAXWYXSQLY-IOBAAEILSA-N 2 0 303.406 3.072 20 5 DGBDRP CCC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000468627735 534947663 /nfs/dbraw/zinc/94/76/63/534947663.db2.gz ODYUWUDGEZMBSS-OBHPCNEJSA-N 2 0 317.433 3.320 20 5 DGBDRP O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000419694698 546803880 /nfs/dbraw/zinc/80/38/80/546803880.db2.gz QNOCMRPWCUOUBW-CABCVRRESA-N 2 0 323.824 3.007 20 5 DGBDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000894858419 618480152 /nfs/dbraw/zinc/48/01/52/618480152.db2.gz FSJJHQLOVHLHBD-GFCCVEGCSA-N 2 0 311.813 3.070 20 5 DGBDRP N[C@@H]1c2ccccc2C[C@H]1[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000902435530 619635836 /nfs/dbraw/zinc/63/58/36/619635836.db2.gz UOOJMXWVSOAVIE-IPMKNSEASA-N 2 0 323.396 3.187 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000903244875 619743564 /nfs/dbraw/zinc/74/35/64/619743564.db2.gz FWBAFUCHHCXDFS-XBVQOTNRSA-N 2 0 317.433 3.161 20 5 DGBDRP [NH3+]CC1([C@@H]2CCCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000903814146 619814528 /nfs/dbraw/zinc/81/45/28/619814528.db2.gz KOUQUQGRAAFUSM-INIZCTEOSA-N 2 0 303.406 3.078 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)cc1[N+](=O)[O-] ZINC000904412693 619920845 /nfs/dbraw/zinc/92/08/45/619920845.db2.gz WJQFCIPTVWPDNW-UKRRQHHQSA-N 2 0 305.422 3.135 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000904412694 619921115 /nfs/dbraw/zinc/92/11/15/619921115.db2.gz WJQFCIPTVWPDNW-ZFWWWQNUSA-N 2 0 305.422 3.135 20 5 DGBDRP CC(C)(C[NH3+])C1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000904442767 619923165 /nfs/dbraw/zinc/92/31/65/619923165.db2.gz HOTAONPXWVGUDO-ALCCZGGFSA-N 2 0 317.433 3.305 20 5 DGBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@](C[NH3+])(C(C)(C)C)C1 ZINC000866704659 622158166 /nfs/dbraw/zinc/15/81/66/622158166.db2.gz PYJRNJONWACTPX-GUYCJALGSA-N 2 0 305.422 3.353 20 5 DGBDRP CC[NH+]1CCC(CC[NH2+]Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000873062008 623028077 /nfs/dbraw/zinc/02/80/77/623028077.db2.gz NCONLEAHXWLCTO-UHFFFAOYSA-N 2 0 305.422 3.115 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000873115942 623039234 /nfs/dbraw/zinc/03/92/34/623039234.db2.gz WXUYITIKKFIUDX-UHFFFAOYSA-N 2 0 317.433 3.176 20 5 DGBDRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000873222886 623080349 /nfs/dbraw/zinc/08/03/49/623080349.db2.gz DIKZVVOTCHZZNJ-IWHGQQBYSA-N 2 0 317.433 3.305 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873264728 623097135 /nfs/dbraw/zinc/09/71/35/623097135.db2.gz QNZVGOYOISUYQF-TXCZRRACSA-N 2 0 317.433 3.036 20 5 DGBDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1c(F)cccc1[N+](=O)[O-])CC2 ZINC000879247317 624463394 /nfs/dbraw/zinc/46/33/94/624463394.db2.gz AOMAIMKSEWFOEE-UHFFFAOYSA-N 2 0 321.396 3.042 20 5 DGBDRP C[NH+]1CCC2(CCC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)CC1 ZINC000799177774 626277844 /nfs/dbraw/zinc/27/78/44/626277844.db2.gz DLUZSQXEJUATGZ-UHFFFAOYSA-N 2 0 321.396 3.042 20 5 DGBDRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000925881445 627811210 /nfs/dbraw/zinc/81/12/10/627811210.db2.gz BCFJDDKACJNRNP-DIECFANBSA-N 2 0 317.433 3.023 20 5 DGBDRP C[N@H+](CCCC[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000835062846 629841433 /nfs/dbraw/zinc/84/14/33/629841433.db2.gz SHQCDUWZLJHVNY-UHFFFAOYSA-N 2 0 311.813 3.212 20 5 DGBDRP [NH3+]CCCCCC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000843130094 630617468 /nfs/dbraw/zinc/61/74/68/630617468.db2.gz WUBHFJBUXQYHQW-NVXWUHKLSA-N 2 0 319.449 3.415 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]CCCCCC[NH3+])c2cc([N+](=O)[O-])ccc21 ZINC000843340793 630647266 /nfs/dbraw/zinc/64/72/66/630647266.db2.gz FEBLOXPNNRMTRQ-MRXNPFEDSA-N 2 0 305.422 3.426 20 5 DGBDRP CC[NH+]1CCC(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000084440089 660344732 /nfs/dbraw/zinc/34/47/32/660344732.db2.gz RMBITFYFPVVKEU-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000261996609 655657207 /nfs/dbraw/zinc/65/72/07/655657207.db2.gz UPBDXRMJRFINNP-XJKSGUPXSA-N 2 0 303.406 3.120 20 5 DGBDRP CC[NH+]1CCC(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000044517692 655810388 /nfs/dbraw/zinc/81/03/88/655810388.db2.gz YTDHUNZQBVTHKH-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP Cc1c(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)cccc1[N+](=O)[O-] ZINC001335584997 1178933606 /nfs/dbraw/zinc/93/36/06/1178933606.db2.gz ZMKWKKKEASCJLL-YESZJQIVSA-N 2 0 317.433 3.065 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC001574979670 1191462011 /nfs/dbraw/zinc/46/20/11/1191462011.db2.gz KXBJOFARSWDJOT-ZROIWOOFSA-N 2 0 311.385 3.247 20 5 DGBDRP CC1(C)[C@H]([NH3+])C[C@@H]1[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC001576384100 1191578096 /nfs/dbraw/zinc/57/80/96/1191578096.db2.gz UAAIWXQKOBVLCZ-JFOHDYCDSA-N 2 0 317.433 3.021 20 5 DGBDRP C[C@H](CC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])[NH+](C)C ZINC001658642127 1196283545 /nfs/dbraw/zinc/28/35/45/1196283545.db2.gz PWTYLCKZSXRBFJ-INMHGKMJSA-N 2 0 319.449 3.236 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1-n1ccc2cc(C[NH3+])cnc21 ZINC001167314592 1081949359 /nfs/dbraw/zinc/94/93/59/1081949359.db2.gz YEFZHOMQKTZXPF-UHFFFAOYSA-N 2 0 309.437 3.081 20 5 DGBDRP CC(C)(C)C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169000246 1092480942 /nfs/dbraw/zinc/48/09/42/1092480942.db2.gz XEWAADUMOSTXRU-YHUYYLMFSA-N 2 0 311.470 3.050 20 5 DGBDRP C[N+](C)(C)CCCO[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001224622957 1096249178 /nfs/dbraw/zinc/24/91/78/1096249178.db2.gz JGLCJNCKJJFKQL-ACDBMABISA-N 2 0 317.497 3.295 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001173221380 1097372258 /nfs/dbraw/zinc/37/22/58/1097372258.db2.gz MTZPMCPNYIEQEX-HLIUYOAVSA-N 2 0 305.422 3.023 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC001202750237 1104204267 /nfs/dbraw/zinc/20/42/67/1104204267.db2.gz POTBMDDIDBMHNM-UHFFFAOYSA-N 2 0 310.357 3.149 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001329499956 1104285078 /nfs/dbraw/zinc/28/50/78/1104285078.db2.gz XHWYJLJDCRJUMT-OAHLLOKOSA-N 2 0 317.433 3.430 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246122344 1104395668 /nfs/dbraw/zinc/39/56/68/1104395668.db2.gz ADFGHKMLEJKRJE-GOEBONIOSA-N 2 0 317.433 3.038 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246604617 1104620329 /nfs/dbraw/zinc/62/03/29/1104620329.db2.gz HEMIFNNKUBMUFM-YJBOKZPZSA-N 2 0 317.433 3.134 20 5 DGBDRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000278391263 214138429 /nfs/dbraw/zinc/13/84/29/214138429.db2.gz FUZOPEHLDRDDKY-ZDUSSCGKSA-N 2 0 303.406 3.120 20 5 DGBDRP CC[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000423422403 529621840 /nfs/dbraw/zinc/62/18/40/529621840.db2.gz LAZYQJAKWUYJEX-ZQIUZPCESA-N 2 0 305.422 3.401 20 5 DGBDRP CC[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000272482324 209890845 /nfs/dbraw/zinc/89/08/45/209890845.db2.gz BFBRHUCFGBQYSD-INIZCTEOSA-N 2 0 305.422 3.367 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000415050325 237033479 /nfs/dbraw/zinc/03/34/79/237033479.db2.gz YMMFDNVMESXOSF-JSGCOSHPSA-N 2 0 315.373 3.072 20 5 DGBDRP C[C@H](CC[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000449237115 240083724 /nfs/dbraw/zinc/08/37/24/240083724.db2.gz AQXGCJXFWLCRTP-JKSUJKDBSA-N 2 0 319.449 3.380 20 5 DGBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000449296732 240117744 /nfs/dbraw/zinc/11/77/44/240117744.db2.gz CVWRYYBRXLPETA-ODIFPOPNSA-N 2 0 317.433 3.132 20 5 DGBDRP CC[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000171141321 432106054 /nfs/dbraw/zinc/10/60/54/432106054.db2.gz WMNQGWBTSAMJIQ-WMLDXEAASA-N 2 0 305.422 3.367 20 5 DGBDRP CCC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000121211725 284191335 /nfs/dbraw/zinc/19/13/35/284191335.db2.gz IUWMMRAFSUEMDI-YOEHRIQHSA-N 2 0 305.422 3.367 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000602020470 400404943 /nfs/dbraw/zinc/40/49/43/400404943.db2.gz LWOVJBSUDUJMNK-JDFRZJQESA-N 2 0 303.406 3.079 20 5 DGBDRP CCC[NH+]1CCC([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000591260866 400504967 /nfs/dbraw/zinc/50/49/67/400504967.db2.gz KDPZAODQFUEDOT-UHFFFAOYSA-N 2 0 319.449 3.382 20 5 DGBDRP Cc1ccc([C@H](C)NC[C@H]2CCCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000599069292 400949171 /nfs/dbraw/zinc/94/91/71/400949171.db2.gz FBUASXQCMCUMCV-LSDHHAIUSA-N 2 0 305.422 3.286 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000593733978 400900401 /nfs/dbraw/zinc/90/04/01/400900401.db2.gz PULSOORDLKZPOF-ZQIUZPCESA-N 2 0 303.406 3.025 20 5 DGBDRP CN(CCC[NH+]1CCCC1)c1ccc2cnccc2c1[N+](=O)[O-] ZINC000599075050 400952289 /nfs/dbraw/zinc/95/22/89/400952289.db2.gz RLVWCWJLQUZDNW-UHFFFAOYSA-N 2 0 314.389 3.065 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000420305409 292296991 /nfs/dbraw/zinc/29/69/91/292296991.db2.gz KDOVYMVVEDRNHP-PYTWLRIVSA-N 2 0 303.406 3.023 20 5 DGBDRP CC(C)(C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000360181228 286437453 /nfs/dbraw/zinc/43/74/53/286437453.db2.gz PXQRQTSDXIKKET-CLFYSBASSA-N 2 0 317.433 3.320 20 5 DGBDRP [NH3+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000347060170 264149858 /nfs/dbraw/zinc/14/98/58/264149858.db2.gz XOBMCCMMDVEWNW-ZDUSSCGKSA-N 2 0 315.373 3.026 20 5 DGBDRP O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000347168295 264169080 /nfs/dbraw/zinc/16/90/80/264169080.db2.gz MINSGPNPQQKNTI-AATOQMJSSA-N 2 0 315.417 3.072 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000332026978 275868926 /nfs/dbraw/zinc/86/89/26/275868926.db2.gz RYRGOXCHQUGWRS-HSMVNMDESA-N 2 0 303.406 3.177 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]C2CCC([NH3+])CC2)c2cc([N+](=O)[O-])ccc21 ZINC000331870922 278368632 /nfs/dbraw/zinc/36/86/32/278368632.db2.gz BBHITVZWPWPIJC-ZEPSKSRBSA-N 2 0 303.406 3.177 20 5 DGBDRP Cc1cc(NCC2(C)CC[NH2+]CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261903824 280626069 /nfs/dbraw/zinc/62/60/69/280626069.db2.gz PEWUMVGCLFMCQE-UHFFFAOYSA-N 2 0 314.389 3.253 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000124362356 431891497 /nfs/dbraw/zinc/89/14/97/431891497.db2.gz LPVRNZOOMZMZJX-ZIAGYGMSSA-N 2 0 303.406 3.038 20 5 DGBDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000249060406 432336046 /nfs/dbraw/zinc/33/60/46/432336046.db2.gz ZVVNQBWJLWCNMK-KDOFPFPSSA-N 2 0 317.433 3.294 20 5 DGBDRP Cc1cc(NCC[C@@H]2CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000261611576 432433707 /nfs/dbraw/zinc/43/37/07/432433707.db2.gz BDOGDZMEJCAHLN-ZDUSSCGKSA-N 2 0 314.389 3.253 20 5 DGBDRP C[C@@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000261787450 432451217 /nfs/dbraw/zinc/45/12/17/432451217.db2.gz UOMLJDWWVATJCR-KRWDZBQOSA-N 2 0 315.373 3.026 20 5 DGBDRP C[NH+]1CCC(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192830469 432418508 /nfs/dbraw/zinc/41/85/08/432418508.db2.gz CBURKWMEPFAXFQ-GOSISDBHSA-N 2 0 317.433 3.294 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C[NH+](C)C ZINC000425924543 433374693 /nfs/dbraw/zinc/37/46/93/433374693.db2.gz PPPLCZUDKJXANU-HLLBOEOZSA-N 2 0 319.449 3.093 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c(Cl)c1 ZINC000414780931 433830886 /nfs/dbraw/zinc/83/08/86/433830886.db2.gz MDZLNHUMWXGATH-STQMWFEESA-N 2 0 323.824 3.070 20 5 DGBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284182749 433854886 /nfs/dbraw/zinc/85/48/86/433854886.db2.gz RCUXYNALHSWIMZ-ZIAGYGMSSA-N 2 0 322.453 3.338 20 5 DGBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCCC1 ZINC000414846470 433879992 /nfs/dbraw/zinc/87/99/92/433879992.db2.gz SNHTZRSZVRYAST-CQSZACIVSA-N 2 0 305.422 3.167 20 5 DGBDRP CC(C)c1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1[N+](=O)[O-] ZINC000414981565 433954430 /nfs/dbraw/zinc/95/44/30/433954430.db2.gz YBAWBNZYOQJHHL-OAHLLOKOSA-N 2 0 305.422 3.340 20 5 DGBDRP O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000423010052 434163011 /nfs/dbraw/zinc/16/30/11/434163011.db2.gz FRKXWBXLSVJXFH-RCCFBDPRSA-N 2 0 317.433 3.038 20 5 DGBDRP [NH3+]C1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCCC1 ZINC000423185730 434273704 /nfs/dbraw/zinc/27/37/04/434273704.db2.gz VZMGAINTQYWZOP-MRXNPFEDSA-N 2 0 317.433 3.167 20 5 DGBDRP CCC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423206389 434284796 /nfs/dbraw/zinc/28/47/96/434284796.db2.gz BYAURTLOWPIYOI-UNEWFSDZSA-N 2 0 305.422 3.414 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCC([NH3+])CC1 ZINC000423210435 434285549 /nfs/dbraw/zinc/28/55/49/434285549.db2.gz GHCUFHBWNTYJBD-ROKHWSDSSA-N 2 0 323.462 3.325 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+]CC2(C)CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000423339532 434369514 /nfs/dbraw/zinc/36/95/14/434369514.db2.gz VHCZYSMYYJLNBD-CYBMUJFWSA-N 2 0 321.421 3.034 20 5 DGBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417331966 434358656 /nfs/dbraw/zinc/35/86/56/434358656.db2.gz WSFYCZAKVHKGCX-KDOFPFPSSA-N 2 0 317.433 3.294 20 5 DGBDRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000353750330 434399281 /nfs/dbraw/zinc/39/92/81/434399281.db2.gz HRJYMOLRGBTPNQ-GOEBONIOSA-N 2 0 305.422 3.208 20 5 DGBDRP CCC[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423452624 434432849 /nfs/dbraw/zinc/43/28/49/434432849.db2.gz ZIMAKTJDVZCCSE-RCCFBDPRSA-N 2 0 317.433 3.414 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000560897083 435195335 /nfs/dbraw/zinc/19/53/35/435195335.db2.gz SWCZJZNRAOGQLU-LSDHHAIUSA-N 2 0 305.422 3.286 20 5 DGBDRP CN(CCC[NH+](C)C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000572683006 435855666 /nfs/dbraw/zinc/85/56/66/435855666.db2.gz BTNNEFWSHNFGFN-UHFFFAOYSA-N 2 0 317.389 3.238 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000541881697 314045773 /nfs/dbraw/zinc/04/57/73/314045773.db2.gz GTHFGNQCKHTYDJ-AWEZNQCLSA-N 2 0 305.422 3.286 20 5 DGBDRP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000566473730 315350582 /nfs/dbraw/zinc/35/05/82/315350582.db2.gz CNAHUVBJSNUBRN-KRWDZBQOSA-N 2 0 315.417 3.046 20 5 DGBDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000581285693 324099058 /nfs/dbraw/zinc/09/90/58/324099058.db2.gz NPKMHIBEGJXLMI-AWEZNQCLSA-N 2 0 305.422 3.286 20 5 DGBDRP C[N@H+](CCCC[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000894806761 618463397 /nfs/dbraw/zinc/46/33/97/618463397.db2.gz KQNKMQDZLFTEQJ-UHFFFAOYSA-N 2 0 311.813 3.212 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1)c1ccccc1[N+](=O)[O-] ZINC000902428004 619634303 /nfs/dbraw/zinc/63/43/03/619634303.db2.gz AEEAVTXEHFKDMC-BSWAZPDLSA-N 2 0 317.433 3.209 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000902432709 619634946 /nfs/dbraw/zinc/63/49/46/619634946.db2.gz WSRXGWAPKIXHJV-MGPQQGTHSA-N 2 0 305.422 3.194 20 5 DGBDRP [NH3+]CC1([C@@H]2CCCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])CCC1 ZINC000903815922 619814274 /nfs/dbraw/zinc/81/42/74/619814274.db2.gz VOAQGWAHLYZZOK-INIZCTEOSA-N 2 0 303.406 3.078 20 5 DGBDRP CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@]1(C)CCC[NH2+]C1 ZINC000904313176 619912293 /nfs/dbraw/zinc/91/22/93/619912293.db2.gz SDTOFBYHQLVKJK-KRWDZBQOSA-N 2 0 305.422 3.195 20 5 DGBDRP CC(C)c1ccc(C[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000904412691 619921195 /nfs/dbraw/zinc/92/11/95/619921195.db2.gz WJQFCIPTVWPDNW-DZGCQCFKSA-N 2 0 305.422 3.135 20 5 DGBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000872027455 622759709 /nfs/dbraw/zinc/75/97/09/622759709.db2.gz DPYWVKDYDHQKBM-GFCCVEGCSA-N 2 0 311.451 3.309 20 5 DGBDRP Cc1c(C[NH2+]C2CCC(C[NH+](C)C)CC2)cccc1[N+](=O)[O-] ZINC000873096861 623034751 /nfs/dbraw/zinc/03/47/51/623034751.db2.gz YTHDETFRCOKSIK-UHFFFAOYSA-N 2 0 305.422 3.113 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@@H]1CCCC[N@@H+](C)C1 ZINC000873141761 623047936 /nfs/dbraw/zinc/04/79/36/623047936.db2.gz KIPVTNVHHDVSHF-HNNXBMFYSA-N 2 0 305.422 3.033 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1[N+](=O)[O-] ZINC000873259719 623095433 /nfs/dbraw/zinc/09/54/33/623095433.db2.gz KHKPESWHTSUPQO-LUYZLQTOSA-N 2 0 303.406 3.084 20 5 DGBDRP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788504470 625200102 /nfs/dbraw/zinc/20/01/02/625200102.db2.gz RAEPSRQJHWHDKP-NSHDSACASA-N 2 0 320.437 3.137 20 5 DGBDRP C[NH+]1CCC2(CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)CC1 ZINC000798957511 626262350 /nfs/dbraw/zinc/26/23/50/626262350.db2.gz YQNGNXKSYNNVPU-UHFFFAOYSA-N 2 0 321.396 3.042 20 5 DGBDRP CCC[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000925801106 627796999 /nfs/dbraw/zinc/79/69/99/627796999.db2.gz UCTFFMUZIQHTEY-UNEWFSDZSA-N 2 0 305.422 3.271 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cccc1[N+](=O)[O-] ZINC000817949968 627972376 /nfs/dbraw/zinc/97/23/76/627972376.db2.gz VARWGUGTGYNEMB-CQSZACIVSA-N 2 0 313.401 3.255 20 5 DGBDRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000817963509 627976953 /nfs/dbraw/zinc/97/69/53/627976953.db2.gz SQGPUOUDSUFIPD-NWDGAFQWSA-N 2 0 314.389 3.048 20 5 DGBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000261996599 657276184 /nfs/dbraw/zinc/27/61/84/657276184.db2.gz UPBDXRMJRFINNP-CJNGLKHVSA-N 2 0 303.406 3.120 20 5 DGBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1C[C@@H]2CCCC[C@]2(C[NH3+])C1 ZINC001579734925 1191989876 /nfs/dbraw/zinc/98/98/76/1191989876.db2.gz SZTLKAOYJZAUKM-YJBOKZPZSA-N 2 0 317.433 3.163 20 5 DGBDRP CC[N@@H+]1CC[C@@H](N(C)Cc2c(C)ccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC001663596023 1196910260 /nfs/dbraw/zinc/91/02/60/1196910260.db2.gz VUEPURWVOCGLFI-RHSMWYFYSA-N 2 0 319.449 3.374 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1-n1cnc2ccc(C[NH3+])cc21 ZINC001168844087 1092384851 /nfs/dbraw/zinc/38/48/51/1092384851.db2.gz IRQKOXCYZUTGBM-UHFFFAOYSA-N 2 0 309.437 3.081 20 5 DGBDRP [NH3+]CCCCCCCCCCC[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168985070 1092462636 /nfs/dbraw/zinc/46/26/36/1092462636.db2.gz CPYAOSKCTWZKQW-IRXDYDNUSA-N 2 0 313.486 3.491 20 5 DGBDRP [NH3+]CCCCCCCCCCC[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168985069 1092462833 /nfs/dbraw/zinc/46/28/33/1092462833.db2.gz CPYAOSKCTWZKQW-IAGOWNOFSA-N 2 0 313.486 3.491 20 5 DGBDRP [NH3+]CCCCCCCCCCC[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168985072 1092463031 /nfs/dbraw/zinc/46/30/31/1092463031.db2.gz CPYAOSKCTWZKQW-SJORKVTESA-N 2 0 313.486 3.491 20 5 DGBDRP CCCC[NH+](CCCC)CCC[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168974940 1092475099 /nfs/dbraw/zinc/47/50/99/1092475099.db2.gz SZMZQMVRERVCLD-SJORKVTESA-N 2 0 313.486 3.314 20 5 DGBDRP [NH3+][C@H]1CC[C@H]([N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C2CCCCC2)CC1 ZINC001168998323 1092479295 /nfs/dbraw/zinc/47/92/95/1092479295.db2.gz LHMKKGZDHUHXDP-AHCXZYCDSA-N 2 0 323.481 3.336 20 5 DGBDRP CC(C)(C)C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169000243 1092481009 /nfs/dbraw/zinc/48/10/09/1092481009.db2.gz XEWAADUMOSTXRU-KLHDSHLOSA-N 2 0 311.470 3.050 20 5 DGBDRP [NH3+]C[C@@H]1CCCC[N@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001206633114 1092766623 /nfs/dbraw/zinc/76/66/23/1092766623.db2.gz TVVKBDNGOWTWKB-HNNXBMFYSA-N 2 0 320.440 3.344 20 5 DGBDRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1OCCC[N+](C)(C)C ZINC001224624840 1096249071 /nfs/dbraw/zinc/24/90/71/1096249071.db2.gz ZUPVSTJBIOPALF-PKOBYXMFSA-N 2 0 305.486 3.010 20 5 DGBDRP [NH3+]CCCCCCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172903321 1097269342 /nfs/dbraw/zinc/26/93/42/1097269342.db2.gz QDCDKPFCQGGETF-KRWDZBQOSA-N 2 0 319.449 3.341 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001173221383 1097371837 /nfs/dbraw/zinc/37/18/37/1097371837.db2.gz MTZPMCPNYIEQEX-VQCLRJIVSA-N 2 0 305.422 3.023 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001173224124 1097374025 /nfs/dbraw/zinc/37/40/25/1097374025.db2.gz MFAFVCRKYHDHEA-CQSZACIVSA-N 2 0 317.433 3.119 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246604615 1104619954 /nfs/dbraw/zinc/61/99/54/1104619954.db2.gz HEMIFNNKUBMUFM-MAUKXSAKSA-N 2 0 317.433 3.134 20 5 DGBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254580243 1106108601 /nfs/dbraw/zinc/10/86/01/1106108601.db2.gz BPRVZIOJDPMDKP-PBHICJAKSA-N 2 0 319.449 3.162 20 5 DGBDRP CCC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423332285 283928504 /nfs/dbraw/zinc/92/85/04/283928504.db2.gz PGWVXFNEVBEULG-INIZCTEOSA-N 2 0 305.422 3.415 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000468654498 244058300 /nfs/dbraw/zinc/05/83/00/244058300.db2.gz YHKUJIKMLACUKA-DDITZMBXSA-N 2 0 317.433 3.320 20 5 DGBDRP C[NH+](C)CCC1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255439387 285156185 /nfs/dbraw/zinc/15/61/85/285156185.db2.gz IYZZFMIKNPRBNR-ALCCZGGFSA-N 2 0 317.433 3.272 20 5 DGBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000468648019 533409824 /nfs/dbraw/zinc/40/98/24/533409824.db2.gz MWOPCPYEUYZAIG-KPJVXMDVSA-N 2 0 315.417 3.215 20 5 DGBDRP CC[C@@H]([NH2+]CC1CC[NH+](CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000314583929 292890416 /nfs/dbraw/zinc/89/04/16/292890416.db2.gz APJWHDNGGCVYMK-QGZVFWFLSA-N 2 0 305.422 3.367 20 5 DGBDRP Cc1ccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000093688456 400253372 /nfs/dbraw/zinc/25/33/72/400253372.db2.gz OFEYTTXBOABHES-UHFFFAOYSA-N 2 0 319.449 3.457 20 5 DGBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000595900364 400290804 /nfs/dbraw/zinc/29/08/04/400290804.db2.gz DHBBOCMLZPQGCV-PBHICJAKSA-N 2 0 317.433 3.367 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)c2cc([N+](=O)[O-])ccc21 ZINC000602022245 400406200 /nfs/dbraw/zinc/40/62/00/400406200.db2.gz SCCRJXIZSDBTEQ-DCGLDWPTSA-N 2 0 317.433 3.424 20 5 DGBDRP CC1(C)C[C@@H]([NH2+][C@H]2CC[C@H](C[NH3+])CC2)c2cc([N+](=O)[O-])ccc21 ZINC000602022246 400406260 /nfs/dbraw/zinc/40/62/60/400406260.db2.gz SCCRJXIZSDBTEQ-PBFPGSCMSA-N 2 0 317.433 3.424 20 5 DGBDRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000602513699 400484308 /nfs/dbraw/zinc/48/43/08/400484308.db2.gz GTOSMMHIOLLQPH-MRXNPFEDSA-N 2 0 319.449 3.382 20 5 DGBDRP CCC[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000591579376 400543070 /nfs/dbraw/zinc/54/30/70/400543070.db2.gz UNKLRDSENACBNU-CVEARBPZSA-N 2 0 303.406 3.168 20 5 DGBDRP Cc1c(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000592492866 400658275 /nfs/dbraw/zinc/65/82/75/400658275.db2.gz FCQGMTXYBLWDQK-NVXWUHKLSA-N 2 0 317.433 3.115 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]CCC2CC[NH2+]CC2)c2cc([N+](=O)[O-])ccc21 ZINC000593322460 400817922 /nfs/dbraw/zinc/81/79/22/400817922.db2.gz NIGBKGDXKBNDLM-QGZVFWFLSA-N 2 0 317.433 3.297 20 5 DGBDRP Cc1c([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cccc1[N+](=O)[O-] ZINC000593319780 400818501 /nfs/dbraw/zinc/81/85/01/400818501.db2.gz PJYWPAOZIBUPOD-GFCCVEGCSA-N 2 0 317.364 3.352 20 5 DGBDRP CC[N@@H+]1CCC[C@@H]1CNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000599015122 400927543 /nfs/dbraw/zinc/92/75/43/400927543.db2.gz FTHIJJSOWHVNLD-CYBMUJFWSA-N 2 0 300.362 3.039 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)C2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000090217591 401263036 /nfs/dbraw/zinc/26/30/36/401263036.db2.gz WTPMAQQCQITYID-KBPBESRZSA-N 2 0 305.422 3.284 20 5 DGBDRP C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000346665665 264076412 /nfs/dbraw/zinc/07/64/12/264076412.db2.gz DGDVSDZDPSOOOE-QWHCGFSZSA-N 2 0 315.373 3.024 20 5 DGBDRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000346678642 264078356 /nfs/dbraw/zinc/07/83/56/264078356.db2.gz MKOAXQBODSROGM-STQMWFEESA-N 2 0 315.373 3.024 20 5 DGBDRP C[C@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@@H]1[NH3+] ZINC000347106885 264157670 /nfs/dbraw/zinc/15/76/70/264157670.db2.gz MCOLTRHKXYRZEM-LRDDRELGSA-N 2 0 315.373 3.024 20 5 DGBDRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000414932346 274957785 /nfs/dbraw/zinc/95/77/85/274957785.db2.gz VNTYMHFAJNYSHQ-SIXLDLHFSA-N 2 0 317.433 3.166 20 5 DGBDRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000423547763 288072215 /nfs/dbraw/zinc/07/22/15/288072215.db2.gz QDWQYMCNXPXKGQ-DLTWYDFYSA-N 2 0 303.406 3.024 20 5 DGBDRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423444023 279255258 /nfs/dbraw/zinc/25/52/58/279255258.db2.gz WDGNOCDLONROID-WBMJQRKESA-N 2 0 305.422 3.424 20 5 DGBDRP CC[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000272482330 280185318 /nfs/dbraw/zinc/18/53/18/280185318.db2.gz BFBRHUCFGBQYSD-MRXNPFEDSA-N 2 0 305.422 3.367 20 5 DGBDRP O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000261661041 432439075 /nfs/dbraw/zinc/43/90/75/432439075.db2.gz GEVWKZGBRWUCDU-OKZBNKHCSA-N 2 0 317.433 3.038 20 5 DGBDRP Cc1nccn1C[C@@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000178701390 432768923 /nfs/dbraw/zinc/76/89/23/432768923.db2.gz LSPCPDLRUGYTAX-JSGCOSHPSA-N 2 0 316.405 3.395 20 5 DGBDRP O=[N+]([O-])c1ccc(CN2CCC[C@@H]([NH+]3CCCC3)CC2)c(F)c1 ZINC000267043621 432808494 /nfs/dbraw/zinc/80/84/94/432808494.db2.gz PKZNIMCQCSJLDR-OAHLLOKOSA-N 2 0 321.396 3.184 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@H]2CCC[C@@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000332026992 432964869 /nfs/dbraw/zinc/96/48/69/432964869.db2.gz RYRGOXCHQUGWRS-WQGACYEGSA-N 2 0 303.406 3.177 20 5 DGBDRP C[N@H+](CCCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000453396455 433152883 /nfs/dbraw/zinc/15/28/83/433152883.db2.gz IWUQMOZWPLXOBW-SFHVURJKSA-N 2 0 317.433 3.436 20 5 DGBDRP C[NH+](C)C1CCC([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000421375620 433519472 /nfs/dbraw/zinc/51/94/72/433519472.db2.gz QQSAHKZXLACAPP-ALCCZGGFSA-N 2 0 303.406 3.070 20 5 DGBDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000414909910 433912136 /nfs/dbraw/zinc/91/21/36/433912136.db2.gz CQRNGXFRQRSFAT-KBPBESRZSA-N 2 0 315.373 3.214 20 5 DGBDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000414909913 433913354 /nfs/dbraw/zinc/91/33/54/433913354.db2.gz CQRNGXFRQRSFAT-UONOGXRCSA-N 2 0 315.373 3.214 20 5 DGBDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000414933995 433920955 /nfs/dbraw/zinc/92/09/55/433920955.db2.gz XNPPUKBLCFURAV-STQMWFEESA-N 2 0 315.373 3.214 20 5 DGBDRP C[NH2+]CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414858706 433885715 /nfs/dbraw/zinc/88/57/15/433885715.db2.gz KSJISYYKUJLNEC-UHFFFAOYSA-N 2 0 305.403 3.022 20 5 DGBDRP C[C@@H](C[C@H]1CCCCC[NH2+]1)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000422792658 434006333 /nfs/dbraw/zinc/00/63/33/434006333.db2.gz RHFVCGXTEZCQQK-GOEBONIOSA-N 2 0 305.422 3.038 20 5 DGBDRP CN(Cc1cc(Cl)ccc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000285627219 434018906 /nfs/dbraw/zinc/01/89/06/434018906.db2.gz WVUOUHZZTSXSFP-YIONKMFJSA-N 2 0 323.824 3.305 20 5 DGBDRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422918509 434105530 /nfs/dbraw/zinc/10/55/30/434105530.db2.gz IJPOJLRWFHNFPY-SJORKVTESA-N 2 0 305.422 3.167 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]CC2(C)CC[NH2+]CC2)c2cc([N+](=O)[O-])ccc21 ZINC000423329539 434364121 /nfs/dbraw/zinc/36/41/21/434364121.db2.gz MUXHOJJYXNVASO-MRXNPFEDSA-N 2 0 317.433 3.297 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc21 ZINC000423283570 434338670 /nfs/dbraw/zinc/33/86/70/434338670.db2.gz XLLKFOKPUZVEGA-CXAGYDPISA-N 2 0 317.433 3.297 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000423376931 434392636 /nfs/dbraw/zinc/39/26/36/434392636.db2.gz JKHOSZSAXJREKB-MJBXVCDLSA-N 2 0 323.462 3.325 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000423426056 434418407 /nfs/dbraw/zinc/41/84/07/434418407.db2.gz OXRRRRSEZYHJTR-DEYYWGMASA-N 2 0 317.433 3.327 20 5 DGBDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cc1[N+](=O)[O-] ZINC000423431935 434421275 /nfs/dbraw/zinc/42/12/75/434421275.db2.gz VVBKKSIWXDTRES-KKUMJFAQSA-N 2 0 305.422 3.319 20 5 DGBDRP CCOc1ccc([C@@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1[N+](=O)[O-] ZINC000423491515 434453833 /nfs/dbraw/zinc/45/38/33/434453833.db2.gz ZHLBOEFPHCZYBS-UKRRQHHQSA-N 2 0 321.421 3.176 20 5 DGBDRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000424380353 295301181 /nfs/dbraw/zinc/30/11/81/295301181.db2.gz WXRKTGWGRCQRDZ-RKTXRCNFSA-N 2 0 317.433 3.166 20 5 DGBDRP C[N@H+](CCCC[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])C1CC1 ZINC000567519794 435326784 /nfs/dbraw/zinc/32/67/84/435326784.db2.gz QRIFJYORGJPHQG-INIZCTEOSA-N 2 0 303.406 3.046 20 5 DGBDRP CC[N@@H+]1CC[C@H](N(C)C/C=C/c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000539818648 435569501 /nfs/dbraw/zinc/56/95/01/435569501.db2.gz CAVPKYIISJLVPQ-OJJSLQOQSA-N 2 0 317.433 3.413 20 5 DGBDRP CC[N@@H+]1CC[C@H](N(C)C/C=C\c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000539818649 435569985 /nfs/dbraw/zinc/56/99/85/435569985.db2.gz CAVPKYIISJLVPQ-OWWQLCIYSA-N 2 0 317.433 3.413 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000581647201 324140523 /nfs/dbraw/zinc/14/05/23/324140523.db2.gz LVZRMIKPMMGLIU-CQSZACIVSA-N 2 0 317.433 3.428 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CCC[NH2+]C1CC1 ZINC000415069953 534887707 /nfs/dbraw/zinc/88/77/07/534887707.db2.gz PRWRVHKITSJWPP-WMLDXEAASA-N 2 0 317.433 3.038 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000415008084 528100550 /nfs/dbraw/zinc/10/05/50/528100550.db2.gz MIIABVRAQFMGEK-DLBZAZTESA-N 2 0 317.433 3.196 20 5 DGBDRP C[C@@H](C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000897461114 619130164 /nfs/dbraw/zinc/13/01/64/619130164.db2.gz LKLAAONDUYWXBY-UONOGXRCSA-N 2 0 305.422 3.161 20 5 DGBDRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1)c1ccccc1[N+](=O)[O-] ZINC000902428005 619634310 /nfs/dbraw/zinc/63/43/10/619634310.db2.gz AEEAVTXEHFKDMC-MWQQHZPXSA-N 2 0 317.433 3.209 20 5 DGBDRP COc1cc([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc([N+](=O)[O-])c1 ZINC000903189966 619737332 /nfs/dbraw/zinc/73/73/32/619737332.db2.gz MCFHNXGSEDFCSS-LRVUVFPRSA-N 2 0 321.421 3.127 20 5 DGBDRP [NH3+]CC1([C@H]2CCCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)CCC1 ZINC000903814181 619814385 /nfs/dbraw/zinc/81/43/85/619814385.db2.gz LAEOLIMKJJAIEL-MRXNPFEDSA-N 2 0 303.406 3.078 20 5 DGBDRP CC(C)([NH3+])CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000903938548 619838057 /nfs/dbraw/zinc/83/80/57/619838057.db2.gz FZZNMAGFASAKRD-UHFFFAOYSA-N 2 0 303.362 3.072 20 5 DGBDRP CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@]1(C)CCC[NH2+]C1 ZINC000904313177 619912204 /nfs/dbraw/zinc/91/22/04/619912204.db2.gz SDTOFBYHQLVKJK-QGZVFWFLSA-N 2 0 305.422 3.195 20 5 DGBDRP Cc1c(C[NH2+]Cc2cccc(C[NH+](C)C)c2)cccc1[N+](=O)[O-] ZINC000873009131 623016391 /nfs/dbraw/zinc/01/63/91/623016391.db2.gz SYLIZRWJXTXSSV-UHFFFAOYSA-N 2 0 313.401 3.255 20 5 DGBDRP O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)c(F)c1 ZINC000873232810 623085747 /nfs/dbraw/zinc/08/57/47/623085747.db2.gz NQODGYAEKOSASE-INIZCTEOSA-N 2 0 321.396 3.136 20 5 DGBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873264727 623097084 /nfs/dbraw/zinc/09/70/84/623097084.db2.gz QNZVGOYOISUYQF-DIECFANBSA-N 2 0 317.433 3.036 20 5 DGBDRP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788613557 625229554 /nfs/dbraw/zinc/22/95/54/625229554.db2.gz YEIIFHQWIWMTEN-BLLLJJGKSA-N 2 0 322.453 3.194 20 5 DGBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000841084287 630406107 /nfs/dbraw/zinc/40/61/07/630406107.db2.gz ZGZUYEIJWFJEBZ-HAQNSBGRSA-N 2 0 311.813 3.103 20 5 DGBDRP O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c1 ZINC000843125823 630616580 /nfs/dbraw/zinc/61/65/80/630616580.db2.gz JHOFBBMNXKYEDL-OLZOCXBDSA-N 2 0 323.824 3.070 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1NCC12CC[NH+](CC1)CC2 ZINC001169796908 1081657585 /nfs/dbraw/zinc/65/75/85/1081657585.db2.gz USPIQOVNWYZRGA-UHFFFAOYSA-N 2 0 302.486 3.181 20 5 DGBDRP CC[N+](C)(C)Cc1ccccc1NC[C@H]1CCC[NH2+]C[C@@H]1C ZINC001162456337 1089741689 /nfs/dbraw/zinc/74/16/89/1089741689.db2.gz HWDJDUXFRFHXBP-DLBZAZTESA-N 2 0 304.502 3.331 20 5 DGBDRP CCC(CC)[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169000827 1092481278 /nfs/dbraw/zinc/48/12/78/1092481278.db2.gz YTZXZNVCXWKSHP-NXNVCVFFSA-N 2 0 311.470 3.192 20 5 DGBDRP C[NH+](C)CCCCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899952 1097267657 /nfs/dbraw/zinc/26/76/57/1097267657.db2.gz QIVFMQNUTZCUQJ-QGZVFWFLSA-N 2 0 319.449 3.164 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCN(C2CCCC2)C1 ZINC001173221178 1097371988 /nfs/dbraw/zinc/37/19/88/1097371988.db2.gz LFUKPVNAKMIEMC-GOEBONIOSA-N 2 0 317.433 3.132 20 5 DGBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCN(CC(C)(C)C)C1 ZINC001173222608 1097372990 /nfs/dbraw/zinc/37/29/90/1097372990.db2.gz XMLMEAIQRDCRCO-HOCLYGCPSA-N 2 0 319.449 3.236 20 5 DGBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001173228676 1097376377 /nfs/dbraw/zinc/37/63/77/1097376377.db2.gz JMYPERSJPGVDEX-NVXWUHKLSA-N 2 0 319.449 3.367 20 5 DGBDRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC001320881462 1107175074 /nfs/dbraw/zinc/17/50/74/1107175074.db2.gz WJXJSWDHYMZTAP-KSSFIOAISA-N 2 0 317.433 3.294 20 5 DGBDRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000423547757 529660577 /nfs/dbraw/zinc/66/05/77/529660577.db2.gz QDWQYMCNXPXKGQ-ANQUJSFKSA-N 2 0 303.406 3.024 20 5 DGBDRP C[NH+]1CCC(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000168126963 432067840 /nfs/dbraw/zinc/06/78/40/432067840.db2.gz HNLNETWIKVBOHH-UHFFFAOYSA-N 2 0 311.813 3.070 20 5 DGBDRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000193507141 201066514 /nfs/dbraw/zinc/06/65/14/201066514.db2.gz HAAIYCMPDPDLNL-GUYCJALGSA-N 2 0 303.406 3.120 20 5 DGBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414908283 285161442 /nfs/dbraw/zinc/16/14/42/285161442.db2.gz RLZNYZIDBDKXNV-USXIJHARSA-N 2 0 317.433 3.038 20 5 DGBDRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000121793595 195347902 /nfs/dbraw/zinc/34/79/02/195347902.db2.gz XNXZUKOGAMTYFX-CQSZACIVSA-N 2 0 305.422 3.367 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000468731991 533384277 /nfs/dbraw/zinc/38/42/77/533384277.db2.gz DVJBFVWLJHMOJO-QYRJGMMTSA-N 2 0 317.433 3.461 20 5 DGBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000468654499 533384914 /nfs/dbraw/zinc/38/49/14/533384914.db2.gz YHKUJIKMLACUKA-IZNAZMGOSA-N 2 0 317.433 3.320 20 5 DGBDRP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000595052969 400091151 /nfs/dbraw/zinc/09/11/51/400091151.db2.gz UOYNQVWTRPXLSA-ZDUSSCGKSA-N 2 0 321.421 3.128 20 5 DGBDRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000602575628 400501778 /nfs/dbraw/zinc/50/17/78/400501778.db2.gz TWFGCRRXQIXNCQ-QGZVFWFLSA-N 2 0 319.449 3.095 20 5 DGBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCC1 ZINC000596649316 400472082 /nfs/dbraw/zinc/47/20/82/400472082.db2.gz YPDJRTPSKSKEQR-CYBMUJFWSA-N 2 0 323.462 3.327 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])NC[C@H]1CCCC[NH2+]1 ZINC000591578081 400541225 /nfs/dbraw/zinc/54/12/25/400541225.db2.gz WFMMNBHJMVUHAO-UONOGXRCSA-N 2 0 323.462 3.197 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@H+](CCCC2CC[NH2+]CC2)C2CC2)cc1 ZINC000592494339 400658136 /nfs/dbraw/zinc/65/81/36/400658136.db2.gz QTHYQHVPNYTUOX-UHFFFAOYSA-N 2 0 317.433 3.339 20 5 DGBDRP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000599072929 400950066 /nfs/dbraw/zinc/95/00/66/400950066.db2.gz COILPYSFUZLKPZ-PBHICJAKSA-N 2 0 315.417 3.189 20 5 DGBDRP CCC[N@@H+]1CC[C@H](Nc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599110232 400961188 /nfs/dbraw/zinc/96/11/88/400961188.db2.gz MGLQDKJCIINEAR-ZDUSSCGKSA-N 2 0 300.362 3.039 20 5 DGBDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)C1 ZINC000247147042 432205965 /nfs/dbraw/zinc/20/59/65/432205965.db2.gz SRMFLWRBHMRNAF-RHSMWYFYSA-N 2 0 305.422 3.367 20 5 DGBDRP Cc1cc(NCC[N@@H+](C)C(C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302181959 230147345 /nfs/dbraw/zinc/14/73/45/230147345.db2.gz OCTZBEQEIDKZSV-UHFFFAOYSA-N 2 0 302.378 3.204 20 5 DGBDRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000346642586 264071034 /nfs/dbraw/zinc/07/10/34/264071034.db2.gz MQQNPTJDMCYPIC-TZMCWYRMSA-N 2 0 315.373 3.024 20 5 DGBDRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346655334 264073475 /nfs/dbraw/zinc/07/34/75/264073475.db2.gz FZHZFZKHIAWYTO-STQMWFEESA-N 2 0 315.373 3.024 20 5 DGBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000449296733 274231411 /nfs/dbraw/zinc/23/14/11/274231411.db2.gz CVWRYYBRXLPETA-OOHWJJMZSA-N 2 0 317.433 3.132 20 5 DGBDRP Cn1c2ccccc2nc1CCC[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000124390686 431892805 /nfs/dbraw/zinc/89/28/05/431892805.db2.gz KHUQDQWWSSAOQL-UHFFFAOYSA-N 2 0 324.384 3.204 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000420314452 281021317 /nfs/dbraw/zinc/02/13/17/281021317.db2.gz KXPMRBPXBVTJOE-HOCLYGCPSA-N 2 0 317.433 3.286 20 5 DGBDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192720816 432405080 /nfs/dbraw/zinc/40/50/80/432405080.db2.gz ZVVNQBWJLWCNMK-RDTXWAMCSA-N 2 0 317.433 3.294 20 5 DGBDRP C[N@@H+]1CCC[C@H]1CCN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154396769 432496702 /nfs/dbraw/zinc/49/67/02/432496702.db2.gz MGAFNJJNGIROOX-HNNXBMFYSA-N 2 0 303.406 3.044 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000332026982 432964974 /nfs/dbraw/zinc/96/49/74/432964974.db2.gz RYRGOXCHQUGWRS-MKBNYLNASA-N 2 0 303.406 3.177 20 5 DGBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000420338159 433170438 /nfs/dbraw/zinc/17/04/38/433170438.db2.gz PCYBNCONONJADV-KDOFPFPSSA-N 2 0 317.433 3.428 20 5 DGBDRP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c(Cl)c1 ZINC000414780928 433829976 /nfs/dbraw/zinc/82/99/76/433829976.db2.gz MDZLNHUMWXGATH-CHWSQXEVSA-N 2 0 323.824 3.070 20 5 DGBDRP CC(C)c1ccc(C[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000414864456 433892837 /nfs/dbraw/zinc/89/28/37/433892837.db2.gz YPVMELXUKJJOOX-HIFRSBDPSA-N 2 0 305.422 3.196 20 5 DGBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000415027547 433969774 /nfs/dbraw/zinc/96/97/74/433969774.db2.gz BBILSKHJTHIHNP-TXCZRRACSA-N 2 0 317.433 3.023 20 5 DGBDRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000422937385 434121347 /nfs/dbraw/zinc/12/13/47/434121347.db2.gz GINJJSNLFGEZFC-NWDGAFQWSA-N 2 0 314.389 3.169 20 5 DGBDRP O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000423010051 434161685 /nfs/dbraw/zinc/16/16/85/434161685.db2.gz FRKXWBXLSVJXFH-OKZBNKHCSA-N 2 0 317.433 3.038 20 5 DGBDRP [NH3+]C1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCCC1 ZINC000423185729 434272664 /nfs/dbraw/zinc/27/26/64/434272664.db2.gz VZMGAINTQYWZOP-INIZCTEOSA-N 2 0 317.433 3.167 20 5 DGBDRP O=[N+]([O-])c1cccc([C@@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2)c1 ZINC000423347370 434374620 /nfs/dbraw/zinc/37/46/20/434374620.db2.gz QGPJSXRIMMUOTF-IBGZPJMESA-N 2 0 323.396 3.194 20 5 DGBDRP CC1(C)C[C@@H]([NH2+]C[C@]2(C)CCC[NH2+]C2)c2cc([N+](=O)[O-])ccc21 ZINC000423350994 434380573 /nfs/dbraw/zinc/38/05/73/434380573.db2.gz YIQYDOGPWVUVJF-SJLPKXTDSA-N 2 0 317.433 3.297 20 5 DGBDRP CC1(C)C[C@H]([NH2+][C@@H]2CC[C@H](C[NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000423514479 434472321 /nfs/dbraw/zinc/47/23/21/434472321.db2.gz SGGWCYZEVHZDKA-OZVIIMIRSA-N 2 0 303.406 3.034 20 5 DGBDRP CC(C)c1ccc(CN(C)[C@H]2CC[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000573486991 434903139 /nfs/dbraw/zinc/90/31/39/434903139.db2.gz DIIXBUDLWRORBA-YOEHRIQHSA-N 2 0 319.449 3.490 20 5 DGBDRP Cc1c(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000524156126 434970626 /nfs/dbraw/zinc/97/06/26/434970626.db2.gz LBEICSOHYBORQT-UHFFFAOYSA-N 2 0 319.449 3.455 20 5 DGBDRP CC(C)[NH2+]CCC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000568381420 435427866 /nfs/dbraw/zinc/42/78/66/435427866.db2.gz LBVJATLKYWNPSO-RDJZCZTQSA-N 2 0 319.449 3.284 20 5 DGBDRP [NH3+]C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435395885 534691243 /nfs/dbraw/zinc/69/12/43/534691243.db2.gz VQTHSSXGVCXOHN-GFCCVEGCSA-N 2 0 317.414 3.104 20 5 DGBDRP C[NH+](C)C1CCC([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000894978160 618505606 /nfs/dbraw/zinc/50/56/06/618505606.db2.gz KUHOHCRLEHTIBT-UHFFFAOYSA-N 2 0 311.813 3.211 20 5 DGBDRP CCC1([NH3+])CC[NH+]([C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000925756612 618601146 /nfs/dbraw/zinc/60/11/46/618601146.db2.gz MQLSWLWRFMSINI-QGZVFWFLSA-N 2 0 317.433 3.119 20 5 DGBDRP C[C@@H](C[NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-] ZINC000903244734 619743445 /nfs/dbraw/zinc/74/34/45/619743445.db2.gz CIQIZAPINBNGPR-KBPBESRZSA-N 2 0 305.422 3.018 20 5 DGBDRP CC(C)([NH3+])CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000903939211 619834252 /nfs/dbraw/zinc/83/42/52/619834252.db2.gz VTKHJPKLKHBXPD-UHFFFAOYSA-N 2 0 303.362 3.072 20 5 DGBDRP Cc1ccc([C@@H](C)[NH2+]CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1[N+](=O)[O-] ZINC000923376702 621180139 /nfs/dbraw/zinc/18/01/39/621180139.db2.gz DTTJVWKSRSTBPP-ZBSSRIJBSA-N 2 0 317.433 3.475 20 5 DGBDRP CC(C)[NH+]1CCC(CC[NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000865715444 621982059 /nfs/dbraw/zinc/98/20/59/621982059.db2.gz SGPABYMLUQVHOB-UHFFFAOYSA-N 2 0 305.422 3.195 20 5 DGBDRP Cc1c(C[N@@H+]2CC[C@@](C[NH3+])(C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000866702985 622158043 /nfs/dbraw/zinc/15/80/43/622158043.db2.gz FZVBEOLITDKDRE-KRWDZBQOSA-N 2 0 305.422 3.100 20 5 DGBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@](C[NH3+])(C(C)(C)C)C1 ZINC000866704660 622158088 /nfs/dbraw/zinc/15/80/88/622158088.db2.gz PYJRNJONWACTPX-SUMWQHHRSA-N 2 0 305.422 3.353 20 5 DGBDRP Cc1c(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cccc1[N+](=O)[O-] ZINC000873139508 623047019 /nfs/dbraw/zinc/04/70/19/623047019.db2.gz CHTVMDLCOMKXTH-UHFFFAOYSA-N 2 0 317.433 3.115 20 5 DGBDRP CCOc1ccc([C@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000873270800 623099400 /nfs/dbraw/zinc/09/94/00/623099400.db2.gz AJIVPCFODPNXES-STQMWFEESA-N 2 0 321.421 3.032 20 5 DGBDRP CCC[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000925801105 627796925 /nfs/dbraw/zinc/79/69/25/627796925.db2.gz UCTFFMUZIQHTEY-FRFSOERESA-N 2 0 305.422 3.271 20 5 DGBDRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000925803228 627797642 /nfs/dbraw/zinc/79/76/42/627797642.db2.gz OCJIISSEKJGXFR-PBFPGSCMSA-N 2 0 317.433 3.152 20 5 DGBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925882294 627811663 /nfs/dbraw/zinc/81/16/63/627811663.db2.gz KFOWGOPFHSPQJJ-RDBSUJKOSA-N 2 0 323.462 3.183 20 5 DGBDRP CC[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cccc([N+](=O)[O-])c1 ZINC000817949977 627972123 /nfs/dbraw/zinc/97/21/23/627972123.db2.gz VMINUACIQSBCQQ-GOSISDBHSA-N 2 0 313.401 3.337 20 5 DGBDRP C[C@H]1CC2(C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl)CC[NH2+]CC2 ZINC000818340395 628015522 /nfs/dbraw/zinc/01/55/22/628015522.db2.gz LSXFUMLXCUXYKV-LBPRGKRZSA-N 2 0 323.824 3.212 20 5 DGBDRP C[NH+](C)CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000102419358 630104485 /nfs/dbraw/zinc/10/44/85/630104485.db2.gz SOWQRMPBNUBJPO-UHFFFAOYSA-N 2 0 319.430 3.365 20 5 DGBDRP [NH3+]C1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000843107615 630614481 /nfs/dbraw/zinc/61/44/81/630614481.db2.gz TYXWUGVPVPLDNM-UHFFFAOYSA-N 2 0 315.373 3.214 20 5 DGBDRP [NH3+]C1CCC([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000843107107 630614563 /nfs/dbraw/zinc/61/45/63/630614563.db2.gz QFILTLWPPOPRFX-UHFFFAOYSA-N 2 0 315.373 3.214 20 5 DGBDRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC001200783820 1180904924 /nfs/dbraw/zinc/90/49/24/1180904924.db2.gz HWYGNPQDBWVQMF-UHFFFAOYSA-N 2 0 305.422 3.115 20 5 DGBDRP