smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000133055380 205353458 /nfs/dbraw/zinc/35/34/58/205353458.db2.gz QJJTZOSCXIUCHU-DNVCBOLYSA-N 2 1 347.459 3.136 20 5 EGBDMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]21 ZINC000346848812 156162494 /nfs/dbraw/zinc/16/24/94/156162494.db2.gz RLMORLSAEQEMGL-FHLIZLRMSA-N 2 1 341.411 3.414 20 5 EGBDMP Cc1c([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000278385807 268000757 /nfs/dbraw/zinc/00/07/57/268000757.db2.gz CNVGXATZDRWYFW-HOCLYGCPSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1c([C@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000278385807 268000761 /nfs/dbraw/zinc/00/07/61/268000761.db2.gz CNVGXATZDRWYFW-HOCLYGCPSA-N 2 1 335.448 3.055 20 5 EGBDMP CC[N@@H+]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000279609671 275343792 /nfs/dbraw/zinc/34/37/92/275343792.db2.gz XGUMQDTWKJUFKR-ABAIWWIYSA-N 2 1 345.365 3.434 20 5 EGBDMP CC[N@H+]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000279609671 275343794 /nfs/dbraw/zinc/34/37/94/275343794.db2.gz XGUMQDTWKJUFKR-ABAIWWIYSA-N 2 1 345.365 3.434 20 5 EGBDMP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000414982669 309112837 /nfs/dbraw/zinc/11/28/37/309112837.db2.gz YUWBGJJMWKNDGS-KRWDZBQOSA-N 2 1 329.400 3.333 20 5 EGBDMP O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)C1CC1 ZINC000119648492 454210374 /nfs/dbraw/zinc/21/03/74/454210374.db2.gz AEAVNCBPPONIFA-SFHVURJKSA-N 2 1 329.444 3.132 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000152865120 454735685 /nfs/dbraw/zinc/73/56/85/454735685.db2.gz UGUSMMHSVRWPLY-KGLIPLIRSA-N 2 1 333.432 3.128 20 5 EGBDMP CC[C@@H]([NH2+]CCCCN1CC[NH+](CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000154503276 454902283 /nfs/dbraw/zinc/90/22/83/454902283.db2.gz XAVZIXPJDBAXEW-LJQANCHMSA-N 2 1 348.491 3.053 20 5 EGBDMP C[NH+](C)C[C@H]1CC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000114479759 454957044 /nfs/dbraw/zinc/95/70/44/454957044.db2.gz IGOVPODMRSQGGL-OAHLLOKOSA-N 2 1 336.435 3.330 20 5 EGBDMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000114479759 454957047 /nfs/dbraw/zinc/95/70/47/454957047.db2.gz IGOVPODMRSQGGL-OAHLLOKOSA-N 2 1 336.435 3.330 20 5 EGBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000178708219 454967743 /nfs/dbraw/zinc/96/77/43/454967743.db2.gz ZXNNEAZOQDYPKY-LSDHHAIUSA-N 2 1 330.432 3.347 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@]4(CC[NH2+]C4)C3)o2)cc1 ZINC000261695350 455930072 /nfs/dbraw/zinc/93/00/72/455930072.db2.gz BEYPQJVBRINYGP-GOSISDBHSA-N 2 1 327.384 3.040 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@]4(CC[NH2+]C4)C3)o2)cc1 ZINC000261695350 455930076 /nfs/dbraw/zinc/93/00/76/455930076.db2.gz BEYPQJVBRINYGP-GOSISDBHSA-N 2 1 327.384 3.040 20 5 EGBDMP C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000283278367 456749989 /nfs/dbraw/zinc/74/99/89/456749989.db2.gz WZQAONPYUPQOFK-DZGCQCFKSA-N 2 1 335.423 3.477 20 5 EGBDMP C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000283278367 456749993 /nfs/dbraw/zinc/74/99/93/456749993.db2.gz WZQAONPYUPQOFK-DZGCQCFKSA-N 2 1 335.423 3.477 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000470179017 458621220 /nfs/dbraw/zinc/62/12/20/458621220.db2.gz RDYALZYMKDJVMY-QIPHDZALSA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000470179017 458621227 /nfs/dbraw/zinc/62/12/27/458621227.db2.gz RDYALZYMKDJVMY-QIPHDZALSA-N 2 1 329.444 3.416 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000595900353 459480641 /nfs/dbraw/zinc/48/06/41/459480641.db2.gz CYVUYKNKNAABHA-CQSZACIVSA-N 2 1 337.851 3.460 20 5 EGBDMP C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602847291 460158177 /nfs/dbraw/zinc/15/81/77/460158177.db2.gz VTLRGXMWIIOLAC-HNNXBMFYSA-N 2 1 326.400 3.263 20 5 EGBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000872022698 1296665879 /nfs/dbraw/zinc/66/58/79/1296665879.db2.gz YPFGQZGCSLZPDH-OLZOCXBDSA-N 2 1 335.473 3.452 20 5 EGBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000872022698 1296665892 /nfs/dbraw/zinc/66/58/92/1296665892.db2.gz YPFGQZGCSLZPDH-OLZOCXBDSA-N 2 1 335.473 3.452 20 5 EGBDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788525024 1305962196 /nfs/dbraw/zinc/96/21/96/1305962196.db2.gz AVCZHKAHUDWWIB-GJZGRUSLSA-N 2 1 334.464 3.340 20 5 EGBDMP C[C@H](C[N+](C)(C)C)Oc1ccc2c(n1)C[N@@H+](Cc1ccccc1)CC2 ZINC001229056264 1375753042 /nfs/dbraw/zinc/75/30/42/1375753042.db2.gz LNONREIMJSZDCO-QGZVFWFLSA-N 2 1 340.491 3.113 20 5 EGBDMP C[C@H](C[N+](C)(C)C)Oc1ccc2c(n1)C[N@H+](Cc1ccccc1)CC2 ZINC001229056264 1375753070 /nfs/dbraw/zinc/75/30/70/1375753070.db2.gz LNONREIMJSZDCO-QGZVFWFLSA-N 2 1 340.491 3.113 20 5 EGBDMP C[C@@H]1CCCC[N@@H+]1CCCNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001156928252 1380731220 /nfs/dbraw/zinc/73/12/20/1380731220.db2.gz JPOUZSOJFMSFNT-INDWDQIESA-N 2 1 347.463 3.199 20 5 EGBDMP C[C@@H]1CCCC[N@H+]1CCCNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001156928252 1380731225 /nfs/dbraw/zinc/73/12/25/1380731225.db2.gz JPOUZSOJFMSFNT-INDWDQIESA-N 2 1 347.463 3.199 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169000868 1384084060 /nfs/dbraw/zinc/08/40/60/1384084060.db2.gz YZEXOACFLYXCER-NXWXRZEISA-N 2 1 349.450 3.343 20 5 EGBDMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169030346 1384094444 /nfs/dbraw/zinc/09/44/44/1384094444.db2.gz YXZDQJHTPKXTLT-UYAOXDASSA-N 2 1 345.487 3.418 20 5 EGBDMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000125498389 205013181 /nfs/dbraw/zinc/01/31/81/205013181.db2.gz OSFKCGHQVJEGCZ-AWEZNQCLSA-N 2 1 329.400 3.238 20 5 EGBDMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000125498389 205013185 /nfs/dbraw/zinc/01/31/85/205013185.db2.gz OSFKCGHQVJEGCZ-AWEZNQCLSA-N 2 1 329.400 3.238 20 5 EGBDMP C[C@@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000344633076 144202135 /nfs/dbraw/zinc/20/21/35/144202135.db2.gz QSBVAVYWRILRAS-HIFRSBDPSA-N 2 1 329.400 3.427 20 5 EGBDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000344633076 144202137 /nfs/dbraw/zinc/20/21/37/144202137.db2.gz QSBVAVYWRILRAS-HIFRSBDPSA-N 2 1 329.400 3.427 20 5 EGBDMP CC1(C)C[C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279075015 275301769 /nfs/dbraw/zinc/30/17/69/275301769.db2.gz MBMRLJBLLSZWAX-ACJLOTCBSA-N 2 1 329.444 3.391 20 5 EGBDMP CC[NH+](CC)CCO[C@H]1CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000350227878 276328344 /nfs/dbraw/zinc/32/83/44/276328344.db2.gz WTBSWPFOSNWXCG-CVEARBPZSA-N 2 1 335.448 3.089 20 5 EGBDMP CC[NH+](CC)CCO[C@@H]1CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000350227882 279110281 /nfs/dbraw/zinc/11/02/81/279110281.db2.gz WTBSWPFOSNWXCG-HZPDHXFCSA-N 2 1 335.448 3.089 20 5 EGBDMP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000414982181 309112719 /nfs/dbraw/zinc/11/27/19/309112719.db2.gz YPAYTQOHCUMMJA-QGZVFWFLSA-N 2 1 329.400 3.333 20 5 EGBDMP C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1C[NH3+] ZINC000415126981 309122296 /nfs/dbraw/zinc/12/22/96/309122296.db2.gz MREUZMYRPOFKOS-ZFWWWQNUSA-N 2 1 329.400 3.272 20 5 EGBDMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1C[NH3+] ZINC000415127353 309122361 /nfs/dbraw/zinc/12/23/61/309122361.db2.gz MULBDEBFZMPWEQ-KBPBESRZSA-N 2 1 329.400 3.272 20 5 EGBDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000449212953 310044989 /nfs/dbraw/zinc/04/49/89/310044989.db2.gz UMSMKTSIXNDRNB-SJORKVTESA-N 2 1 333.476 3.483 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000153037845 454755058 /nfs/dbraw/zinc/75/50/58/454755058.db2.gz DFNVFSLILITDQQ-LSDHHAIUSA-N 2 1 335.448 3.376 20 5 EGBDMP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000178037424 454928946 /nfs/dbraw/zinc/92/89/46/454928946.db2.gz YLUZKVIDHRSCHL-UXLLHSPISA-N 2 1 349.475 3.443 20 5 EGBDMP Cc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000278375611 455834254 /nfs/dbraw/zinc/83/42/54/455834254.db2.gz CCOKUQKLIUWBRC-HZPDHXFCSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000278375611 455834260 /nfs/dbraw/zinc/83/42/60/455834260.db2.gz CCOKUQKLIUWBRC-HZPDHXFCSA-N 2 1 335.448 3.055 20 5 EGBDMP C[N@H+]1CC[C@@H]2[C@H](CCCN2c2ccnc3ccc([N+](=O)[O-])cc32)C1 ZINC000601131934 460723893 /nfs/dbraw/zinc/72/38/93/460723893.db2.gz RVXXHXFZODSMIA-CXAGYDPISA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@@H+]1CC[C@@H]2[C@H](CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601131934 460723899 /nfs/dbraw/zinc/72/38/99/460723899.db2.gz RVXXHXFZODSMIA-CXAGYDPISA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@H+]1CC[C@@H]2[C@H](CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601131934 460723906 /nfs/dbraw/zinc/72/39/06/460723906.db2.gz RVXXHXFZODSMIA-CXAGYDPISA-N 2 1 326.400 3.064 20 5 EGBDMP Cc1cc(N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302106444 456289696 /nfs/dbraw/zinc/28/96/96/456289696.db2.gz XUGUDIHNBQUNBJ-KDOFPFPSSA-N 2 1 340.427 3.372 20 5 EGBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1c[nH+]cn1C ZINC000530354900 458753266 /nfs/dbraw/zinc/75/32/66/458753266.db2.gz CUCDLENJWLPWML-CYBMUJFWSA-N 2 1 334.445 3.031 20 5 EGBDMP [NH3+]CC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000442921367 459061890 /nfs/dbraw/zinc/06/18/90/459061890.db2.gz MUIKZGNEOGKACZ-CQSZACIVSA-N 2 1 329.400 3.416 20 5 EGBDMP [NH3+]CC[C@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000442921486 459062130 /nfs/dbraw/zinc/06/21/30/459062130.db2.gz NLYPQJITSVRHJG-CYBMUJFWSA-N 2 1 346.456 3.279 20 5 EGBDMP CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC000595506481 459329074 /nfs/dbraw/zinc/32/90/74/459329074.db2.gz CYZLZSCVYGVEFU-LJQANCHMSA-N 2 1 347.459 3.300 20 5 EGBDMP CC(C)[N@@H+](C)CC1CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000524156128 459349661 /nfs/dbraw/zinc/34/96/61/459349661.db2.gz LWCHWROGTGPEOV-UHFFFAOYSA-N 2 1 335.448 3.026 20 5 EGBDMP O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCC[NH2+]CC2)c2ccccc2)c1 ZINC000591578269 459406193 /nfs/dbraw/zinc/40/61/93/459406193.db2.gz JCGZNGJXYMQISE-PKOBYXMFSA-N 2 1 325.412 3.416 20 5 EGBDMP O=[N+]([O-])c1ccc(C[NH+]2CCN(c3cc[nH+]c4ccccc43)CC2)cc1 ZINC000582871460 459441284 /nfs/dbraw/zinc/44/12/84/459441284.db2.gz ARTFFVGUMFAZBT-UHFFFAOYSA-N 2 1 348.406 3.465 20 5 EGBDMP COc1ccc(C[N@@H+](C)CCCC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000603109442 460244709 /nfs/dbraw/zinc/24/47/09/460244709.db2.gz AZKJGGKDVLRRNY-UHFFFAOYSA-N 2 1 335.448 3.301 20 5 EGBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000872022697 1296665409 /nfs/dbraw/zinc/66/54/09/1296665409.db2.gz YPFGQZGCSLZPDH-CHWSQXEVSA-N 2 1 335.473 3.452 20 5 EGBDMP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000872022697 1296665423 /nfs/dbraw/zinc/66/54/23/1296665423.db2.gz YPFGQZGCSLZPDH-CHWSQXEVSA-N 2 1 335.473 3.452 20 5 EGBDMP C[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788509334 1305958629 /nfs/dbraw/zinc/95/86/29/1305958629.db2.gz XBPATACYNHTYDG-OAHLLOKOSA-N 2 1 342.443 3.350 20 5 EGBDMP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000817906917 1319458548 /nfs/dbraw/zinc/45/85/48/1319458548.db2.gz GXPUZUNSKPUAFY-SNVBAGLBSA-N 2 1 334.807 3.261 20 5 EGBDMP C[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CCC([NH3+])CC1 ZINC000843055669 1321462789 /nfs/dbraw/zinc/46/27/89/1321462789.db2.gz KEKIQAJLHJOWBZ-UHFFFAOYSA-N 2 1 342.237 3.059 20 5 EGBDMP C[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CCC([NH3+])CC1 ZINC000843055669 1321462793 /nfs/dbraw/zinc/46/27/93/1321462793.db2.gz KEKIQAJLHJOWBZ-UHFFFAOYSA-N 2 1 342.237 3.059 20 5 EGBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866259076 1330086727 /nfs/dbraw/zinc/08/67/27/1330086727.db2.gz GMVJZWNTUJTLNC-QWHCGFSZSA-N 2 1 334.395 3.096 20 5 EGBDMP NCC[N@@H+](Cc1ccccc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172895196 1384872994 /nfs/dbraw/zinc/87/29/94/1384872994.db2.gz ATLDGFQGNQTFFS-LJQANCHMSA-N 2 1 339.439 3.303 20 5 EGBDMP [NH3+]CC[N@@H+](Cc1ccccc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172895196 1384872999 /nfs/dbraw/zinc/87/29/99/1384872999.db2.gz ATLDGFQGNQTFFS-LJQANCHMSA-N 2 1 339.439 3.303 20 5 EGBDMP C[NH+](C)[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901174 1384874098 /nfs/dbraw/zinc/87/40/98/1384874098.db2.gz KJBCWFXPMNENGT-NEWSRXKRSA-N 2 1 331.460 3.305 20 5 EGBDMP C[NH+]1CCC2(CC[N@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C2)CC1 ZINC001172921769 1384880000 /nfs/dbraw/zinc/88/00/00/1384880000.db2.gz SLNQPXKWBIAFDA-SFHVURJKSA-N 2 1 343.471 3.260 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)o1 ZINC001319841506 1386329407 /nfs/dbraw/zinc/32/94/07/1386329407.db2.gz JACQXDRSFNUDMZ-TXEJJXNPSA-N 2 1 347.802 3.159 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[N@@H+]2C[C@H]3C[NH2+]C[C@H]3C2)o1 ZINC001319841506 1386329410 /nfs/dbraw/zinc/32/94/10/1386329410.db2.gz JACQXDRSFNUDMZ-TXEJJXNPSA-N 2 1 347.802 3.159 20 5 EGBDMP COc1ccc(CNCCC[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000119400832 275189980 /nfs/dbraw/zinc/18/99/80/275189980.db2.gz VLVUQJQMVIYVBH-UHFFFAOYSA-N 2 1 343.427 3.215 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCc3[nH+]ccn3C2)cc1[N+](=O)[O-] ZINC000278934838 275288985 /nfs/dbraw/zinc/28/89/85/275288985.db2.gz JMUMTAHKOBLJQJ-KBPBESRZSA-N 2 1 344.415 3.103 20 5 EGBDMP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000414978134 309112455 /nfs/dbraw/zinc/11/24/55/309112455.db2.gz SFRHUPYJFCGNPN-QGZVFWFLSA-N 2 1 329.400 3.333 20 5 EGBDMP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CC[NH2+]C2CCCCCC2)n1 ZINC000423282993 309393921 /nfs/dbraw/zinc/39/39/21/309393921.db2.gz VNUIAPHYJUAKCD-DLBZAZTESA-N 2 1 349.479 3.177 20 5 EGBDMP [NH3+]C[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000423513113 309403934 /nfs/dbraw/zinc/40/39/34/309403934.db2.gz VEAMXDPACOEGIU-NXHRZFHOSA-N 2 1 331.460 3.413 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H](N[C@@H](C)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245418520 455293009 /nfs/dbraw/zinc/29/30/09/455293009.db2.gz AVSXQXSQTZTOES-BXWFABGCSA-N 2 1 349.475 3.382 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245418520 455293015 /nfs/dbraw/zinc/29/30/15/455293015.db2.gz AVSXQXSQTZTOES-BXWFABGCSA-N 2 1 349.475 3.382 20 5 EGBDMP C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185723479 455605973 /nfs/dbraw/zinc/60/59/73/455605973.db2.gz UPZFKNOMHIPFLB-HOTGVXAUSA-N 2 1 347.459 3.216 20 5 EGBDMP C[N@@H+]1CCC[C@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC[C@H]21 ZINC000601130633 460722521 /nfs/dbraw/zinc/72/25/21/460722521.db2.gz NDQHDBLGZCGAPN-SUMWQHHRSA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@H+]1CCC[C@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC[C@H]21 ZINC000601130633 460722525 /nfs/dbraw/zinc/72/25/25/460722525.db2.gz NDQHDBLGZCGAPN-SUMWQHHRSA-N 2 1 326.400 3.064 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000311076013 456585138 /nfs/dbraw/zinc/58/51/38/456585138.db2.gz AOBRSEKRSHHBFU-IBGZPJMESA-N 2 1 339.439 3.249 20 5 EGBDMP C[C@@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000347070004 457214859 /nfs/dbraw/zinc/21/48/59/457214859.db2.gz PCKKGRIZNQAYCR-HIFRSBDPSA-N 2 1 329.400 3.414 20 5 EGBDMP C[C@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000347145781 457256285 /nfs/dbraw/zinc/25/62/85/457256285.db2.gz YGWDPDKCOYPJQZ-DZGCQCFKSA-N 2 1 329.400 3.414 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)o1 ZINC000427138856 457948530 /nfs/dbraw/zinc/94/85/30/457948530.db2.gz ZNULIDBAUYLQBF-CJNGLKHVSA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)o1 ZINC000427138856 457948538 /nfs/dbraw/zinc/94/85/38/457948538.db2.gz ZNULIDBAUYLQBF-CJNGLKHVSA-N 2 1 327.384 3.039 20 5 EGBDMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1[NH3+] ZINC000435373294 458124393 /nfs/dbraw/zinc/12/43/93/458124393.db2.gz DGJZOMYZBXCHMR-MLGOLLRUSA-N 2 1 331.441 3.492 20 5 EGBDMP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[NH2+]C[C@H]1c1ccccc1 ZINC000423503485 458444825 /nfs/dbraw/zinc/44/48/25/458444825.db2.gz FURXPMBXXUEVJK-AYOQOUSVSA-N 2 1 339.439 3.261 20 5 EGBDMP CN1CC[C@H]2CC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000495087708 458797328 /nfs/dbraw/zinc/79/73/28/458797328.db2.gz KXWMKZNMUWQWEB-KBXCAEBGSA-N 2 1 341.411 3.381 20 5 EGBDMP CN1CC[C@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000495087708 458797336 /nfs/dbraw/zinc/79/73/36/458797336.db2.gz KXWMKZNMUWQWEB-KBXCAEBGSA-N 2 1 341.411 3.381 20 5 EGBDMP O=[N+]([O-])c1ncccc1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000885954215 1303295803 /nfs/dbraw/zinc/29/58/03/1303295803.db2.gz QTBSVMAIONXANU-UHFFFAOYSA-N 2 1 332.448 3.078 20 5 EGBDMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788525026 1305963084 /nfs/dbraw/zinc/96/30/84/1305963084.db2.gz AVCZHKAHUDWWIB-HUUCEWRRSA-N 2 1 334.464 3.340 20 5 EGBDMP C[C@@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788541161 1305967375 /nfs/dbraw/zinc/96/73/75/1305967375.db2.gz XALXFMJGTMRPLC-RBSFLKMASA-N 2 1 334.464 3.196 20 5 EGBDMP c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CC[C@@H](N2CC[NH2+]CC2)C1 ZINC000843123245 1321473213 /nfs/dbraw/zinc/47/32/13/1321473213.db2.gz PQAOLTJEDAQLSQ-HXUWFJFHSA-N 2 1 345.490 3.473 20 5 EGBDMP CCC[N@@H+](CCN1CC[NH+](CC)CC1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000344190977 164123034 /nfs/dbraw/zinc/12/30/34/164123034.db2.gz YJFCIKOKGMLRMY-KRWDZBQOSA-N 2 1 348.491 3.005 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCc3[nH+]ccn3C2)cc1[N+](=O)[O-] ZINC000278934845 275288974 /nfs/dbraw/zinc/28/89/74/275288974.db2.gz JMUMTAHKOBLJQJ-KGLIPLIRSA-N 2 1 344.415 3.103 20 5 EGBDMP C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC[NH2+]C1 ZINC000414851407 309105458 /nfs/dbraw/zinc/10/54/58/309105458.db2.gz JDVZOZLSLQUHIO-ZIAGYGMSSA-N 2 1 329.400 3.333 20 5 EGBDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000449212952 310044973 /nfs/dbraw/zinc/04/49/73/310044973.db2.gz UMSMKTSIXNDRNB-IRXDYDNUSA-N 2 1 333.476 3.483 20 5 EGBDMP Cc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000162854885 454804531 /nfs/dbraw/zinc/80/45/31/454804531.db2.gz OYSIRHURNKFESV-BBWFWOEESA-N 2 1 349.475 3.443 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+](C)C3CC[NH2+]CC3)o2)c([N+](=O)[O-])c1 ZINC000435382460 458130992 /nfs/dbraw/zinc/13/09/92/458130992.db2.gz DDJWPKQNAXSSLB-UHFFFAOYSA-N 2 1 345.399 3.047 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+](C)C3CC[NH2+]CC3)o2)c([N+](=O)[O-])c1 ZINC000435382460 458131001 /nfs/dbraw/zinc/13/10/01/458131001.db2.gz DDJWPKQNAXSSLB-UHFFFAOYSA-N 2 1 345.399 3.047 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000567907533 459188241 /nfs/dbraw/zinc/18/82/41/459188241.db2.gz KUAYDNZPAGAYGM-QMDZLVRISA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000567907533 459188247 /nfs/dbraw/zinc/18/82/47/459188247.db2.gz KUAYDNZPAGAYGM-QMDZLVRISA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000567907533 459188252 /nfs/dbraw/zinc/18/82/52/459188252.db2.gz KUAYDNZPAGAYGM-QMDZLVRISA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000567907533 459188255 /nfs/dbraw/zinc/18/82/55/459188255.db2.gz KUAYDNZPAGAYGM-QMDZLVRISA-N 2 1 329.444 3.416 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000765977678 1302361543 /nfs/dbraw/zinc/36/15/43/1302361543.db2.gz RWZITGDAQHXARU-CRAIPNDOSA-N 2 1 347.459 3.197 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@H](CC[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000904404739 1317843187 /nfs/dbraw/zinc/84/31/87/1317843187.db2.gz FHOAPUSBZSLSPX-ZDUSSCGKSA-N 2 1 345.399 3.034 20 5 EGBDMP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000906517289 1318112269 /nfs/dbraw/zinc/11/22/69/1318112269.db2.gz LYJNTAHFEGVZGP-HDJSIYSDSA-N 2 1 331.347 3.106 20 5 EGBDMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000866262009 1330087070 /nfs/dbraw/zinc/08/70/70/1330087070.db2.gz ZBVHAYIFKNUXIZ-LSDHHAIUSA-N 2 1 337.439 3.375 20 5 EGBDMP [NH3+]C[C@H]1C[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)C[C@@H]1O ZINC001206530962 1371085458 /nfs/dbraw/zinc/08/54/58/1371085458.db2.gz YEVSKFUKBWMCNS-DJJJIMSYSA-N 2 1 340.854 3.398 20 5 EGBDMP CC(C)[N@@H+]1CC[C@@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)[C@@H](C)C1 ZINC001163367475 1383033386 /nfs/dbraw/zinc/03/33/86/1383033386.db2.gz ZIGAZBCHRLKWDG-AFDQWNBZSA-N 2 1 347.463 3.053 20 5 EGBDMP CC(C)[N@H+]1CC[C@@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)[C@@H](C)C1 ZINC001163367475 1383033390 /nfs/dbraw/zinc/03/33/90/1383033390.db2.gz ZIGAZBCHRLKWDG-AFDQWNBZSA-N 2 1 347.463 3.053 20 5 EGBDMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169030345 1384094897 /nfs/dbraw/zinc/09/48/97/1384094897.db2.gz YXZDQJHTPKXTLT-QUCCMNQESA-N 2 1 345.487 3.418 20 5 EGBDMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169046376 1384100367 /nfs/dbraw/zinc/10/03/67/1384100367.db2.gz LNHRGAQQGKTICD-QFBILLFUSA-N 2 1 349.450 3.167 20 5 EGBDMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169046376 1384100369 /nfs/dbraw/zinc/10/03/69/1384100369.db2.gz LNHRGAQQGKTICD-QFBILLFUSA-N 2 1 349.450 3.167 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)o1 ZINC001319841507 1386329584 /nfs/dbraw/zinc/32/95/84/1386329584.db2.gz JACQXDRSFNUDMZ-VXGBXAGGSA-N 2 1 347.802 3.159 20 5 EGBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178696281 232385792 /nfs/dbraw/zinc/38/57/92/232385792.db2.gz SFXUOVJFCZTSGK-KSSFIOAISA-N 2 1 342.443 3.347 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)o1 ZINC000352539774 285159207 /nfs/dbraw/zinc/15/92/07/285159207.db2.gz CNOPZAUAGPYHRX-LJQANCHMSA-N 2 1 341.411 3.430 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@]3(CC[NH2+]C3)C2)o1 ZINC000352539774 285159211 /nfs/dbraw/zinc/15/92/11/285159211.db2.gz CNOPZAUAGPYHRX-LJQANCHMSA-N 2 1 341.411 3.430 20 5 EGBDMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]21 ZINC000346836760 156158893 /nfs/dbraw/zinc/15/88/93/156158893.db2.gz VOBVDRLQLHLROF-JCGIZDLHSA-N 2 1 341.411 3.414 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000349155597 156368777 /nfs/dbraw/zinc/36/87/77/156368777.db2.gz WBVXVLYRAKDHSO-HFQYIWAZSA-N 2 1 326.400 3.221 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000372449965 157333476 /nfs/dbraw/zinc/33/34/76/157333476.db2.gz OBAYXWJYPLNRFM-IMJJTQAJSA-N 2 1 333.432 3.271 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000372449965 157333478 /nfs/dbraw/zinc/33/34/78/157333478.db2.gz OBAYXWJYPLNRFM-IMJJTQAJSA-N 2 1 333.432 3.271 20 5 EGBDMP C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000294297725 308207943 /nfs/dbraw/zinc/20/79/43/308207943.db2.gz NBYCUINBDDTDRK-LZWOXQAQSA-N 2 1 346.475 3.481 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]4C[NH2+]C[C@H]4C3)s2)cc1 ZINC000579719031 325150792 /nfs/dbraw/zinc/15/07/92/325150792.db2.gz RGVOJRUPEQIOPY-CABCVRRESA-N 2 1 343.452 3.365 20 5 EGBDMP C[N@@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000271874911 455795476 /nfs/dbraw/zinc/79/54/76/455795476.db2.gz YUJBFBYESHZCGJ-UHFFFAOYSA-N 2 1 327.384 3.206 20 5 EGBDMP [NH3+]CCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000359470458 457086211 /nfs/dbraw/zinc/08/62/11/457086211.db2.gz FENDNHZDOLTHBJ-IZZDOVSWSA-N 2 1 325.412 3.459 20 5 EGBDMP C[C@@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435369946 458123088 /nfs/dbraw/zinc/12/30/88/458123088.db2.gz GVPLOVIVPVINJF-CHWSQXEVSA-N 2 1 331.441 3.492 20 5 EGBDMP C[C@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435374015 458124490 /nfs/dbraw/zinc/12/44/90/458124490.db2.gz PAAOFCJLAFHTRR-JSGCOSHPSA-N 2 1 331.441 3.492 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000611516355 460384287 /nfs/dbraw/zinc/38/42/87/460384287.db2.gz LHADSLKKRLHNMT-HNNXBMFYSA-N 2 1 326.400 3.181 20 5 EGBDMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886040793 1303331054 /nfs/dbraw/zinc/33/10/54/1303331054.db2.gz DIYMFPJEPVKCKT-MRXNPFEDSA-N 2 1 346.475 3.466 20 5 EGBDMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886040793 1303331059 /nfs/dbraw/zinc/33/10/59/1303331059.db2.gz DIYMFPJEPVKCKT-MRXNPFEDSA-N 2 1 346.475 3.466 20 5 EGBDMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776580611 1304174037 /nfs/dbraw/zinc/17/40/37/1304174037.db2.gz XFRVAFYMWSQFIT-IBGZPJMESA-N 2 1 349.475 3.072 20 5 EGBDMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)CC1 ZINC001205579157 1370799015 /nfs/dbraw/zinc/79/90/15/1370799015.db2.gz KWZQREKQXYREHI-FQEVSTJZSA-N 2 1 338.430 3.436 20 5 EGBDMP C[NH+](C)/C=C/c1cc(NC2CCC(C[NH+](C)C)CC2)ncc1[N+](=O)[O-] ZINC001163301647 1383016253 /nfs/dbraw/zinc/01/62/53/1383016253.db2.gz NCZSWQWFUVNLCS-MDZDMXLPSA-N 2 1 347.463 3.054 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168999444 1384082619 /nfs/dbraw/zinc/08/26/19/1384082619.db2.gz TZIGSGGGULBMOM-CADBVGFASA-N 2 1 331.460 3.204 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169000869 1384084363 /nfs/dbraw/zinc/08/43/63/1384084363.db2.gz YZEXOACFLYXCER-OWYHZJEWSA-N 2 1 349.450 3.343 20 5 EGBDMP CC1([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC[NH+](Cc2ccccc2)CC1 ZINC001169006797 1384085799 /nfs/dbraw/zinc/08/57/99/1384085799.db2.gz ZCPHEALURJMGIL-MSOLQXFVSA-N 2 1 331.460 3.076 20 5 EGBDMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169049140 1384100610 /nfs/dbraw/zinc/10/06/10/1384100610.db2.gz VZMXLPZCCOBEHL-QFBILLFUSA-N 2 1 349.450 3.167 20 5 EGBDMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169049140 1384100612 /nfs/dbraw/zinc/10/06/12/1384100612.db2.gz VZMXLPZCCOBEHL-QFBILLFUSA-N 2 1 349.450 3.167 20 5 EGBDMP COc1ccc(C[C@@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c([N+](=O)[O-])c1 ZINC001170317962 1384289744 /nfs/dbraw/zinc/28/97/44/1384289744.db2.gz MZDPOUMGLHRHJA-DZUCGIPZSA-N 2 1 347.459 3.139 20 5 EGBDMP COc1ccc(C[C@@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1 ZINC001170317962 1384289745 /nfs/dbraw/zinc/28/97/45/1384289745.db2.gz MZDPOUMGLHRHJA-DZUCGIPZSA-N 2 1 347.459 3.139 20 5 EGBDMP CCC[N@@H+](CCC[NH+](C)C)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170353808 1384299073 /nfs/dbraw/zinc/29/90/73/1384299073.db2.gz FIPWDGPVXGVRKA-OAHLLOKOSA-N 2 1 337.464 3.198 20 5 EGBDMP C[N@@H+](CC1CC[NH+](C)CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908110 1384875456 /nfs/dbraw/zinc/87/54/56/1384875456.db2.gz AVLIAAISAOLEPW-SFHVURJKSA-N 2 1 331.460 3.116 20 5 EGBDMP C[N@@H+](CCC[NH+]1CCCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910462 1384876155 /nfs/dbraw/zinc/87/61/55/1384876155.db2.gz ALODKAWPSHRODD-GOSISDBHSA-N 2 1 331.460 3.260 20 5 EGBDMP O=[N+]([O-])c1cccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000192924387 153266896 /nfs/dbraw/zinc/26/68/96/153266896.db2.gz VRYKOXNVMSIIQQ-GOSISDBHSA-N 2 1 325.412 3.207 20 5 EGBDMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@H]12 ZINC000346821587 156152987 /nfs/dbraw/zinc/15/29/87/156152987.db2.gz IUEWYBKHYQTBEX-RRQGHBQHSA-N 2 1 327.384 3.024 20 5 EGBDMP O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CC[NH2+]C2CCCCCC2)n1 ZINC000423282996 309393973 /nfs/dbraw/zinc/39/39/73/309393973.db2.gz VNUIAPHYJUAKCD-SJORKVTESA-N 2 1 349.479 3.177 20 5 EGBDMP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000449101612 310037157 /nfs/dbraw/zinc/03/71/57/310037157.db2.gz FYYISUNYANEUIZ-YESZJQIVSA-N 2 1 349.475 3.005 20 5 EGBDMP CC[NH+](CC)CCO[C@H]1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490030514 311130279 /nfs/dbraw/zinc/13/02/79/311130279.db2.gz LVRNYVNYTPLMKS-AEFFLSMTSA-N 2 1 349.475 3.397 20 5 EGBDMP C[C@@H]1CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000255288371 455863365 /nfs/dbraw/zinc/86/33/65/455863365.db2.gz QXCFVDDCZXEJEN-MTWCHYJXSA-N 2 1 326.400 3.388 20 5 EGBDMP C[C@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000347069994 457215303 /nfs/dbraw/zinc/21/53/03/457215303.db2.gz PCKKGRIZNQAYCR-DZGCQCFKSA-N 2 1 329.400 3.414 20 5 EGBDMP CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000435377773 458126909 /nfs/dbraw/zinc/12/69/09/458126909.db2.gz ATNGUDUHGCRMJU-INIZCTEOSA-N 2 1 340.427 3.143 20 5 EGBDMP CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000435377773 458126913 /nfs/dbraw/zinc/12/69/13/458126913.db2.gz ATNGUDUHGCRMJU-INIZCTEOSA-N 2 1 340.427 3.143 20 5 EGBDMP CC[N@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000495431168 458854415 /nfs/dbraw/zinc/85/44/15/458854415.db2.gz BBEQUAKWYCWIBD-WFASDCNBSA-N 2 1 325.840 3.111 20 5 EGBDMP O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CCC[NH2+]CC2)c2ccccc2)c1 ZINC000591578266 459406611 /nfs/dbraw/zinc/40/66/11/459406611.db2.gz JCGZNGJXYMQISE-HKUYNNGSSA-N 2 1 325.412 3.416 20 5 EGBDMP C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C[NH+]1CCCCC1 ZINC000761522977 1301490426 /nfs/dbraw/zinc/49/04/26/1301490426.db2.gz OGKVSLWADBYBAW-ZDUSSCGKSA-N 2 1 325.840 3.460 20 5 EGBDMP C[C@H]([NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788541157 1305966858 /nfs/dbraw/zinc/96/68/58/1305966858.db2.gz XALXFMJGTMRPLC-KFWWJZLASA-N 2 1 334.464 3.196 20 5 EGBDMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168998252 1384082681 /nfs/dbraw/zinc/08/26/81/1384082681.db2.gz KNPVVEUXIYVFMP-OTWHNJEPSA-N 2 1 345.487 3.322 20 5 EGBDMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168998252 1384082684 /nfs/dbraw/zinc/08/26/84/1384082684.db2.gz KNPVVEUXIYVFMP-OTWHNJEPSA-N 2 1 345.487 3.322 20 5 EGBDMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169046374 1384100270 /nfs/dbraw/zinc/10/02/70/1384100270.db2.gz LNHRGAQQGKTICD-APWZRJJASA-N 2 1 349.450 3.167 20 5 EGBDMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169046374 1384100272 /nfs/dbraw/zinc/10/02/72/1384100272.db2.gz LNHRGAQQGKTICD-APWZRJJASA-N 2 1 349.450 3.167 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000246840479 141038129 /nfs/dbraw/zinc/03/81/29/141038129.db2.gz ORESVFSAKUYRPP-LPHOPBHVSA-N 2 1 329.444 3.086 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000246840479 141038132 /nfs/dbraw/zinc/03/81/32/141038132.db2.gz ORESVFSAKUYRPP-LPHOPBHVSA-N 2 1 329.444 3.086 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000246840479 141038136 /nfs/dbraw/zinc/03/81/36/141038136.db2.gz ORESVFSAKUYRPP-LPHOPBHVSA-N 2 1 329.444 3.086 20 5 EGBDMP Cc1nn(-c2ccncc2)cc1CN1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000346213660 141181822 /nfs/dbraw/zinc/18/18/22/141181822.db2.gz YOLZOFQUGZCRJE-UHFFFAOYSA-N 2 1 349.394 3.042 20 5 EGBDMP C[C@H]1C[N@H+](CCC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000278379272 275255773 /nfs/dbraw/zinc/25/57/73/275255773.db2.gz CXRCKPJZBHNEAY-KXBFYZLASA-N 2 1 347.459 3.063 20 5 EGBDMP C[C@H]1C[N@@H+](CCC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000278379272 275255775 /nfs/dbraw/zinc/25/57/75/275255775.db2.gz CXRCKPJZBHNEAY-KXBFYZLASA-N 2 1 347.459 3.063 20 5 EGBDMP CCC[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cccc([N+](=O)[O-])c1 ZINC000278941326 275289685 /nfs/dbraw/zinc/28/96/85/275289685.db2.gz KDZMGACJKADKKL-WMLDXEAASA-N 2 1 328.416 3.485 20 5 EGBDMP C[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000279616038 275344234 /nfs/dbraw/zinc/34/42/34/275344234.db2.gz XTVOJSBKMPCBPV-MFKMUULPSA-N 2 1 331.338 3.186 20 5 EGBDMP C[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1C ZINC000279616038 275344235 /nfs/dbraw/zinc/34/42/35/275344235.db2.gz XTVOJSBKMPCBPV-MFKMUULPSA-N 2 1 331.338 3.186 20 5 EGBDMP Cc1cc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000295949798 308378001 /nfs/dbraw/zinc/37/80/01/308378001.db2.gz IMWXQNPUJIWXCA-AGUYFDCRSA-N 2 1 326.400 3.489 20 5 EGBDMP C[C@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCC[NH2+]C1 ZINC000414847639 309105354 /nfs/dbraw/zinc/10/53/54/309105354.db2.gz FWIIMTCMRPHSSV-ZFWWWQNUSA-N 2 1 329.400 3.333 20 5 EGBDMP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000414928602 309109888 /nfs/dbraw/zinc/10/98/88/309109888.db2.gz QIKRQFUREOXYJB-STQMWFEESA-N 2 1 332.429 3.078 20 5 EGBDMP Cn1ccnc1C[C@H]1CCCN(Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000119576706 454205101 /nfs/dbraw/zinc/20/51/01/454205101.db2.gz UWBGKSTWQWVFAM-CYBMUJFWSA-N 2 1 348.834 3.436 20 5 EGBDMP CC[C@H]([NH2+]CCCCN1CC[NH+](CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000154503185 454902180 /nfs/dbraw/zinc/90/21/80/454902180.db2.gz XAVZIXPJDBAXEW-IBGZPJMESA-N 2 1 348.491 3.053 20 5 EGBDMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000245468230 455309405 /nfs/dbraw/zinc/30/94/05/455309405.db2.gz SUAGQLDGADRDOI-OWCLPIDISA-N 2 1 335.448 3.135 20 5 EGBDMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000271873365 455794791 /nfs/dbraw/zinc/79/47/91/455794791.db2.gz NKBNYZCSAKTSNC-WMZOPIPTSA-N 2 1 329.444 3.158 20 5 EGBDMP C[NH+]1CCC([C@H]2CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000290574208 456369979 /nfs/dbraw/zinc/36/99/79/456369979.db2.gz UANRJTBIDHEGCM-JXTAAOLFSA-N 2 1 329.444 3.272 20 5 EGBDMP CC(C)[N@H+](C)CC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000555974712 458922103 /nfs/dbraw/zinc/92/21/03/458922103.db2.gz QNWPTCDWXBFIQZ-UHFFFAOYSA-N 2 1 345.447 3.023 20 5 EGBDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000555974712 458922107 /nfs/dbraw/zinc/92/21/07/458922107.db2.gz QNWPTCDWXBFIQZ-UHFFFAOYSA-N 2 1 345.447 3.023 20 5 EGBDMP C[NH+](C)C1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCC1 ZINC000480137905 459183932 /nfs/dbraw/zinc/18/39/32/459183932.db2.gz MENPZEAFBFNHCD-QGZVFWFLSA-N 2 1 331.460 3.380 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)s1 ZINC000574638089 459845776 /nfs/dbraw/zinc/84/57/76/459845776.db2.gz KVERDKRFHFOTIK-KBPBESRZSA-N 2 1 343.452 3.365 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3C2)s1 ZINC000574638089 459845780 /nfs/dbraw/zinc/84/57/80/459845780.db2.gz KVERDKRFHFOTIK-KBPBESRZSA-N 2 1 343.452 3.365 20 5 EGBDMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000599070098 460150157 /nfs/dbraw/zinc/15/01/57/460150157.db2.gz KUODJMAQTKOPFQ-QAPCUYQASA-N 2 1 331.460 3.237 20 5 EGBDMP CC[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000610818837 460241667 /nfs/dbraw/zinc/24/16/67/460241667.db2.gz HMCOQGQIUZJESO-RTBURBONSA-N 2 1 347.459 3.279 20 5 EGBDMP C[NH+](C)CC1(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCCC1 ZINC000761532221 1301491294 /nfs/dbraw/zinc/49/12/94/1301491294.db2.gz CFDKCJDNYZLSST-UHFFFAOYSA-N 2 1 325.840 3.460 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000798956643 1310463828 /nfs/dbraw/zinc/46/38/28/1310463828.db2.gz IAVBQBDXIPMONK-UHFFFAOYSA-N 2 1 347.459 3.301 20 5 EGBDMP O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001168982912 1384078624 /nfs/dbraw/zinc/07/86/24/1384078624.db2.gz JEWSWXIUMXEFRN-LJDSDSDDSA-N 2 1 343.471 3.217 20 5 EGBDMP C[N@@H+](CC1CC[NH+](C)CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908108 1384875331 /nfs/dbraw/zinc/87/53/31/1384875331.db2.gz AVLIAAISAOLEPW-GOSISDBHSA-N 2 1 331.460 3.116 20 5 EGBDMP C[C@@H]1C[N@H+](CCC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000278379266 275255761 /nfs/dbraw/zinc/25/57/61/275255761.db2.gz CXRCKPJZBHNEAY-DNVCBOLYSA-N 2 1 347.459 3.063 20 5 EGBDMP C[C@@H]1C[N@@H+](CCC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000278379266 275255762 /nfs/dbraw/zinc/25/57/62/275255762.db2.gz CXRCKPJZBHNEAY-DNVCBOLYSA-N 2 1 347.459 3.063 20 5 EGBDMP C[NH+](C)CCC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000116368513 307483741 /nfs/dbraw/zinc/48/37/41/307483741.db2.gz HZZREJMGLRWPEC-UHFFFAOYSA-N 2 1 325.840 3.412 20 5 EGBDMP C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC[NH2+]C1 ZINC000414851405 309105460 /nfs/dbraw/zinc/10/54/60/309105460.db2.gz JDVZOZLSLQUHIO-UONOGXRCSA-N 2 1 329.400 3.333 20 5 EGBDMP C[C@]1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCC[NH2+]C1 ZINC000414897058 309107978 /nfs/dbraw/zinc/10/79/78/309107978.db2.gz DAOWRIKRPUYJOJ-SFHVURJKSA-N 2 1 329.400 3.334 20 5 EGBDMP C[C@]1(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCC[NH2+]C1 ZINC000414896455 309108031 /nfs/dbraw/zinc/10/80/31/309108031.db2.gz BVVCHYHJGBGZLZ-SFHVURJKSA-N 2 1 329.400 3.334 20 5 EGBDMP COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[NH2+][C@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000414954679 309111323 /nfs/dbraw/zinc/11/13/23/309111323.db2.gz SWIUDUYNEBKMNT-CHWSQXEVSA-N 2 1 345.399 3.094 20 5 EGBDMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090523376 454315811 /nfs/dbraw/zinc/31/58/11/454315811.db2.gz VITCAPWANQBMSX-KYNGSXCRSA-N 2 1 347.459 3.013 20 5 EGBDMP Cc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000162854769 454804737 /nfs/dbraw/zinc/80/47/37/454804737.db2.gz OYSIRHURNKFESV-IXDOHACOSA-N 2 1 349.475 3.443 20 5 EGBDMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178039635 454929438 /nfs/dbraw/zinc/92/94/38/454929438.db2.gz OCPBTNRUOPHABC-XHSDSOJGSA-N 2 1 335.448 3.135 20 5 EGBDMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000271873362 455795001 /nfs/dbraw/zinc/79/50/01/455795001.db2.gz NKBNYZCSAKTSNC-SJLPKXTDSA-N 2 1 329.444 3.158 20 5 EGBDMP Cc1cc(N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302106446 456289278 /nfs/dbraw/zinc/28/92/78/456289278.db2.gz XUGUDIHNBQUNBJ-RDTXWAMCSA-N 2 1 340.427 3.372 20 5 EGBDMP C[C@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000347073664 457217814 /nfs/dbraw/zinc/21/78/14/457217814.db2.gz RUPLYEULISAQDP-UONOGXRCSA-N 2 1 329.400 3.414 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@@]4(CC[NH2+]C4)C3)o2)c1 ZINC000352545218 457454292 /nfs/dbraw/zinc/45/42/92/457454292.db2.gz HGYCBVBOJSMIJP-IBGZPJMESA-N 2 1 341.411 3.430 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)o2)c1 ZINC000352545218 457454298 /nfs/dbraw/zinc/45/42/98/457454298.db2.gz HGYCBVBOJSMIJP-IBGZPJMESA-N 2 1 341.411 3.430 20 5 EGBDMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435386949 458131734 /nfs/dbraw/zinc/13/17/34/458131734.db2.gz ZGMLHZHZAUGVGA-ZDUSSCGKSA-N 2 1 331.441 3.365 20 5 EGBDMP CN1CC[C@H]2CC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@H]2C1 ZINC000495087710 458796757 /nfs/dbraw/zinc/79/67/57/458796757.db2.gz KXWMKZNMUWQWEB-KSSFIOAISA-N 2 1 341.411 3.381 20 5 EGBDMP CN1CC[C@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@H]2C1 ZINC000495087710 458796761 /nfs/dbraw/zinc/79/67/61/458796761.db2.gz KXWMKZNMUWQWEB-KSSFIOAISA-N 2 1 341.411 3.381 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000567907532 459188860 /nfs/dbraw/zinc/18/88/60/459188860.db2.gz KUAYDNZPAGAYGM-KZIRBZLESA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000567907532 459188864 /nfs/dbraw/zinc/18/88/64/459188864.db2.gz KUAYDNZPAGAYGM-KZIRBZLESA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000567907532 459188868 /nfs/dbraw/zinc/18/88/68/459188868.db2.gz KUAYDNZPAGAYGM-KZIRBZLESA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000567907532 459188872 /nfs/dbraw/zinc/18/88/72/459188872.db2.gz KUAYDNZPAGAYGM-KZIRBZLESA-N 2 1 329.444 3.416 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592433672 459599781 /nfs/dbraw/zinc/59/97/81/459599781.db2.gz PEXDCNMOCBTFAM-HOTGVXAUSA-N 2 1 347.459 3.205 20 5 EGBDMP C[N@H+](CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CCCC1 ZINC000133302284 1293741337 /nfs/dbraw/zinc/74/13/37/1293741337.db2.gz ZJJNZYJSHXDTGE-UHFFFAOYSA-N 2 1 346.475 3.028 20 5 EGBDMP C[N@@H+](CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CCCC1 ZINC000133302284 1293741338 /nfs/dbraw/zinc/74/13/38/1293741338.db2.gz ZJJNZYJSHXDTGE-UHFFFAOYSA-N 2 1 346.475 3.028 20 5 EGBDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788525023 1305963112 /nfs/dbraw/zinc/96/31/12/1305963112.db2.gz AVCZHKAHUDWWIB-CABCVRRESA-N 2 1 334.464 3.340 20 5 EGBDMP C[NH+]1CCC2(CCC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)CC1 ZINC000799178260 1310500814 /nfs/dbraw/zinc/50/08/14/1310500814.db2.gz JHRDAONZXMSHJG-UHFFFAOYSA-N 2 1 344.415 3.044 20 5 EGBDMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815559752 1319014579 /nfs/dbraw/zinc/01/45/79/1319014579.db2.gz PFVOASKBXZMGHK-CABCVRRESA-N 2 1 334.464 3.482 20 5 EGBDMP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)cc1Cl ZINC000843127257 1321474269 /nfs/dbraw/zinc/47/42/69/1321474269.db2.gz PCPIFSKDNDETND-LSDHHAIUSA-N 2 1 337.851 3.460 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168999445 1384082742 /nfs/dbraw/zinc/08/27/42/1384082742.db2.gz TZIGSGGGULBMOM-MKXGPGLRSA-N 2 1 331.460 3.204 20 5 EGBDMP C[N@@H+](Cc1ccccc1)C1CC[NH+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169022545 1384092260 /nfs/dbraw/zinc/09/22/60/1384092260.db2.gz CSWAZHYFUUMAPA-PKOBYXMFSA-N 2 1 331.460 3.028 20 5 EGBDMP COc1ccc(C[C@H](C)[NH2+][C@@H]2CC[N@H+](C(C)C)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170329325 1384292831 /nfs/dbraw/zinc/29/28/31/1384292831.db2.gz OMYPATNMJDHEOF-RLFYNMQTSA-N 2 1 349.475 3.243 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CC2 ZINC001172912951 1384876954 /nfs/dbraw/zinc/87/69/54/1384876954.db2.gz SAXNDFYRBZOKJB-INIZCTEOSA-N 2 1 329.444 3.059 20 5 EGBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192824221 239902198 /nfs/dbraw/zinc/90/21/98/239902198.db2.gz ZWNAGBAZERFJFB-ACJLOTCBSA-N 2 1 328.416 3.403 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000344792446 533408411 /nfs/dbraw/zinc/40/84/11/533408411.db2.gz MSIMUQPFQXIPFF-HNRFISLBSA-N 2 1 328.416 3.429 20 5 EGBDMP C[C@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000344633080 144202436 /nfs/dbraw/zinc/20/24/36/144202436.db2.gz QSBVAVYWRILRAS-ZFWWWQNUSA-N 2 1 329.400 3.427 20 5 EGBDMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000344633080 144202437 /nfs/dbraw/zinc/20/24/37/144202437.db2.gz QSBVAVYWRILRAS-ZFWWWQNUSA-N 2 1 329.400 3.427 20 5 EGBDMP COCCC[NH+]1CCC([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000159133227 225155110 /nfs/dbraw/zinc/15/51/10/225155110.db2.gz YAIZFXVZVQCZBR-OAHLLOKOSA-N 2 1 335.448 3.055 20 5 EGBDMP CC[NH+](CC)CCO[C@H]1CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000350227880 279110843 /nfs/dbraw/zinc/11/08/43/279110843.db2.gz WTBSWPFOSNWXCG-HOTGVXAUSA-N 2 1 335.448 3.089 20 5 EGBDMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C[C@@H]12 ZINC000414670814 309094638 /nfs/dbraw/zinc/09/46/38/309094638.db2.gz NAVKNEBUQHJFKF-DAXOMENPSA-N 2 1 343.452 3.492 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)o1 ZINC000414766579 309099503 /nfs/dbraw/zinc/09/95/03/309099503.db2.gz HXZPBNUNOJXDIO-GASCZTMLSA-N 2 1 341.411 3.286 20 5 EGBDMP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000414928598 309109876 /nfs/dbraw/zinc/10/98/76/309109876.db2.gz QIKRQFUREOXYJB-OLZOCXBDSA-N 2 1 332.429 3.078 20 5 EGBDMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C[NH3+] ZINC000415126980 309122419 /nfs/dbraw/zinc/12/24/19/309122419.db2.gz MREUZMYRPOFKOS-UKRRQHHQSA-N 2 1 329.400 3.272 20 5 EGBDMP C[NH2+]CCC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000346659608 457099052 /nfs/dbraw/zinc/09/90/52/457099052.db2.gz VAVSMMGRYIPMOC-UHFFFAOYSA-N 2 1 343.374 3.018 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2nccn2C)C1 ZINC000373113177 458400485 /nfs/dbraw/zinc/40/04/85/458400485.db2.gz SGKMQKLTVWTGEY-AWEZNQCLSA-N 2 1 344.415 3.107 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000470179016 458621710 /nfs/dbraw/zinc/62/17/10/458621710.db2.gz RDYALZYMKDJVMY-MUMAZLPKSA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000470179016 458621712 /nfs/dbraw/zinc/62/17/12/458621712.db2.gz RDYALZYMKDJVMY-MUMAZLPKSA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000470170698 458622046 /nfs/dbraw/zinc/62/20/46/458622046.db2.gz ZFIGHXAIUJNREK-NZCNEKLBSA-N 2 1 329.444 3.414 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000470170698 458622052 /nfs/dbraw/zinc/62/20/52/458622052.db2.gz ZFIGHXAIUJNREK-NZCNEKLBSA-N 2 1 329.444 3.414 20 5 EGBDMP CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[C@H]1[NH3+] ZINC000592427535 459598548 /nfs/dbraw/zinc/59/85/48/459598548.db2.gz AMIIYOQNZAZLEF-CZUORRHYSA-N 2 1 329.400 3.414 20 5 EGBDMP COc1ccc(C[NH2+]CCC[N@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000127454965 1293565013 /nfs/dbraw/zinc/56/50/13/1293565013.db2.gz UXQYSVKGEKUKGP-UHFFFAOYSA-N 2 1 335.448 3.348 20 5 EGBDMP COc1ccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000127454965 1293565018 /nfs/dbraw/zinc/56/50/18/1293565018.db2.gz UXQYSVKGEKUKGP-UHFFFAOYSA-N 2 1 335.448 3.348 20 5 EGBDMP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000765845223 1302338868 /nfs/dbraw/zinc/33/88/68/1302338868.db2.gz NPPNDQRHMDOPRS-IBGZPJMESA-N 2 1 347.459 3.015 20 5 EGBDMP Cc1c([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cccc1[N+](=O)[O-] ZINC000765976377 1302361152 /nfs/dbraw/zinc/36/11/52/1302361152.db2.gz OEOOBJLBKNFFNS-DOTOQJQBSA-N 2 1 347.459 3.197 20 5 EGBDMP CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C[NH+]1CCCC1 ZINC000792197434 1309143089 /nfs/dbraw/zinc/14/30/89/1309143089.db2.gz WDGUYSHCKRJDIO-UHFFFAOYSA-N 2 1 325.840 3.460 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001168982914 1384078829 /nfs/dbraw/zinc/07/88/29/1384078829.db2.gz JEWSWXIUMXEFRN-WAPOTWQKSA-N 2 1 343.471 3.217 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168997733 1384082564 /nfs/dbraw/zinc/08/25/64/1384082564.db2.gz FGAOFLODUARSPD-OWYHZJEWSA-N 2 1 349.450 3.343 20 5 EGBDMP COc1ccc(C[C@H](C)[N@H+]2CCCC[C@H](CCC[NH3+])C2)c([N+](=O)[O-])c1 ZINC001170326144 1384291572 /nfs/dbraw/zinc/29/15/72/1384291572.db2.gz FKCKVXYARBCGTP-JKSUJKDBSA-N 2 1 349.475 3.375 20 5 EGBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000178708229 232393877 /nfs/dbraw/zinc/39/38/77/232393877.db2.gz ZXNNEAZOQDYPKY-HUUCEWRRSA-N 2 1 330.432 3.347 20 5 EGBDMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@H]21 ZINC000346848814 156162455 /nfs/dbraw/zinc/16/24/55/156162455.db2.gz RLMORLSAEQEMGL-ZTFGCOKTSA-N 2 1 341.411 3.414 20 5 EGBDMP C[C@@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000347073661 274240599 /nfs/dbraw/zinc/24/05/99/274240599.db2.gz RUPLYEULISAQDP-KGLIPLIRSA-N 2 1 329.400 3.414 20 5 EGBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000414172162 309064613 /nfs/dbraw/zinc/06/46/13/309064613.db2.gz FBMYVLHMTSTYBA-QAPCUYQASA-N 2 1 331.460 3.237 20 5 EGBDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294297728 308207966 /nfs/dbraw/zinc/20/79/66/308207966.db2.gz NBYCUINBDDTDRK-OFQRWUPVSA-N 2 1 346.475 3.481 20 5 EGBDMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C[C@@H]12 ZINC000414669466 309094695 /nfs/dbraw/zinc/09/46/95/309094695.db2.gz KOASZKSHRQENJV-KBRIMQKVSA-N 2 1 343.452 3.492 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CCCC2 ZINC000417331899 309202064 /nfs/dbraw/zinc/20/20/64/309202064.db2.gz WOTFJISLTJNDKU-IFXJQAMLSA-N 2 1 329.444 3.436 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000536858822 314150368 /nfs/dbraw/zinc/15/03/68/314150368.db2.gz SIEDCJJGNUDLLX-IXDOHACOSA-N 2 1 349.475 3.443 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)o1 ZINC000261939859 455974130 /nfs/dbraw/zinc/97/41/30/455974130.db2.gz DNNVPQNIYISFDI-SFHVURJKSA-N 2 1 327.384 3.040 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@]3(CC[NH2+]C3)C2)o1 ZINC000261939859 455974137 /nfs/dbraw/zinc/97/41/37/455974137.db2.gz DNNVPQNIYISFDI-SFHVURJKSA-N 2 1 327.384 3.040 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@H]([C@@H](C)[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000435368637 458120217 /nfs/dbraw/zinc/12/02/17/458120217.db2.gz BXWKQNSRQJZGHH-OLZOCXBDSA-N 2 1 345.399 3.033 20 5 EGBDMP CN1CC[C@@H]2CC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000495087711 458796718 /nfs/dbraw/zinc/79/67/18/458796718.db2.gz KXWMKZNMUWQWEB-RDTXWAMCSA-N 2 1 341.411 3.381 20 5 EGBDMP CN1CC[C@@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000495087711 458796722 /nfs/dbraw/zinc/79/67/22/458796722.db2.gz KXWMKZNMUWQWEB-RDTXWAMCSA-N 2 1 341.411 3.381 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000567907531 459188179 /nfs/dbraw/zinc/18/81/79/459188179.db2.gz KUAYDNZPAGAYGM-JVCXIRSZSA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000567907531 459188184 /nfs/dbraw/zinc/18/81/84/459188184.db2.gz KUAYDNZPAGAYGM-JVCXIRSZSA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000567907531 459188190 /nfs/dbraw/zinc/18/81/90/459188190.db2.gz KUAYDNZPAGAYGM-JVCXIRSZSA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000567907531 459188194 /nfs/dbraw/zinc/18/81/94/459188194.db2.gz KUAYDNZPAGAYGM-JVCXIRSZSA-N 2 1 329.444 3.416 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1 ZINC000593736237 459967410 /nfs/dbraw/zinc/96/74/10/459967410.db2.gz KHQKOXUBOXQTHN-GGXPGOJBSA-N 2 1 347.459 3.183 20 5 EGBDMP C[N@@H+]1CCC[C@@]2(CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)C1 ZINC000601169678 460739978 /nfs/dbraw/zinc/73/99/78/460739978.db2.gz PCIZDFPQFRFIGZ-GOSISDBHSA-N 2 1 326.400 3.065 20 5 EGBDMP C[N@H+]1CCC[C@@]2(CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)C1 ZINC000601169678 460739984 /nfs/dbraw/zinc/73/99/84/460739984.db2.gz PCIZDFPQFRFIGZ-GOSISDBHSA-N 2 1 326.400 3.065 20 5 EGBDMP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000178037415 533942968 /nfs/dbraw/zinc/94/29/68/533942968.db2.gz YLUZKVIDHRSCHL-HLLBOEOZSA-N 2 1 349.475 3.443 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000152865310 528596066 /nfs/dbraw/zinc/59/60/66/528596066.db2.gz UGUSMMHSVRWPLY-ZIAGYGMSSA-N 2 1 333.432 3.128 20 5 EGBDMP C[C@@H]1CN(c2cc[nH+]cc2)CCN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000884853995 1303000498 /nfs/dbraw/zinc/00/04/98/1303000498.db2.gz YYOKCPNAKAPNTN-CQSZACIVSA-N 2 1 349.394 3.253 20 5 EGBDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000788673903 1305994112 /nfs/dbraw/zinc/99/41/12/1305994112.db2.gz YVVKTFPLDFVWMG-LSDHHAIUSA-N 2 1 334.464 3.196 20 5 EGBDMP C[N@H+](Cc1c2ccccc2c(Cl)c2ccccc21)C[C@@H](O)C[NH3+] ZINC000841091858 1321217195 /nfs/dbraw/zinc/21/71/95/1321217195.db2.gz HTXNSVAGKAPSTF-ZDUSSCGKSA-N 2 1 328.843 3.398 20 5 EGBDMP CC1(C)C[C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279075017 275301664 /nfs/dbraw/zinc/30/16/64/275301664.db2.gz MBMRLJBLLSZWAX-FZKQIMNGSA-N 2 1 329.444 3.391 20 5 EGBDMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C[C@H]12 ZINC000414669471 309094671 /nfs/dbraw/zinc/09/46/71/309094671.db2.gz KOASZKSHRQENJV-XOKHGSTOSA-N 2 1 343.452 3.492 20 5 EGBDMP CCc1ccc([C@@H]([NH2+]CC2=CC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423348154 309396326 /nfs/dbraw/zinc/39/63/26/309396326.db2.gz RWPFHCYZXXTDSE-IBGZPJMESA-N 2 1 341.411 3.349 20 5 EGBDMP Cn1ccnc1C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000179435532 455047152 /nfs/dbraw/zinc/04/71/52/455047152.db2.gz QOJDXPIZZJPBMM-ZDUSSCGKSA-N 2 1 348.834 3.436 20 5 EGBDMP Cn1ccnc1C[C@@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000179435532 455047156 /nfs/dbraw/zinc/04/71/56/455047156.db2.gz QOJDXPIZZJPBMM-ZDUSSCGKSA-N 2 1 348.834 3.436 20 5 EGBDMP C[C@@H]1CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000255288370 455863689 /nfs/dbraw/zinc/86/36/89/455863689.db2.gz QXCFVDDCZXEJEN-CLUARGJDSA-N 2 1 326.400 3.388 20 5 EGBDMP C[N@@H+]1CCCC12CCN(c1cc[nH+]c3ccc([N+](=O)[O-])cc31)CC2 ZINC000601136319 460726146 /nfs/dbraw/zinc/72/61/46/460726146.db2.gz CUKUWDYLKPPQEF-UHFFFAOYSA-N 2 1 326.400 3.208 20 5 EGBDMP C[N@H+]1CCCC12CCN(c1cc[nH+]c3ccc([N+](=O)[O-])cc31)CC2 ZINC000601136319 460726148 /nfs/dbraw/zinc/72/61/48/460726148.db2.gz CUKUWDYLKPPQEF-UHFFFAOYSA-N 2 1 326.400 3.208 20 5 EGBDMP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000430134657 458407583 /nfs/dbraw/zinc/40/75/83/458407583.db2.gz REQXWBQRBJRBBE-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000430134657 458407585 /nfs/dbraw/zinc/40/75/85/458407585.db2.gz REQXWBQRBJRBBE-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000430134657 458407588 /nfs/dbraw/zinc/40/75/88/458407588.db2.gz REQXWBQRBJRBBE-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000430134657 458407590 /nfs/dbraw/zinc/40/75/90/458407590.db2.gz REQXWBQRBJRBBE-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC000432369821 458726842 /nfs/dbraw/zinc/72/68/42/458726842.db2.gz XIAQUSKELMGPSC-MOKGIYGOSA-N 2 1 347.459 3.089 20 5 EGBDMP C[N@H+](CCC[NH3+])Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000582845479 459437366 /nfs/dbraw/zinc/43/73/66/459437366.db2.gz XMVTXKHMEWDWHX-UHFFFAOYSA-N 2 1 333.363 3.307 20 5 EGBDMP C[N@@H+](CCC[NH3+])Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000582845479 459437373 /nfs/dbraw/zinc/43/73/73/459437373.db2.gz XMVTXKHMEWDWHX-UHFFFAOYSA-N 2 1 333.363 3.307 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592492592 459613407 /nfs/dbraw/zinc/61/34/07/459613407.db2.gz BGIIZXHSFZDHPD-ZIAGYGMSSA-N 2 1 337.851 3.460 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000599070624 460150027 /nfs/dbraw/zinc/15/00/27/460150027.db2.gz MBEIKPSISYKULF-LSDHHAIUSA-N 2 1 335.448 3.376 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000599070624 460150029 /nfs/dbraw/zinc/15/00/29/460150029.db2.gz MBEIKPSISYKULF-LSDHHAIUSA-N 2 1 335.448 3.376 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000191473355 528861779 /nfs/dbraw/zinc/86/17/79/528861779.db2.gz SLWCDRKGZBPICP-UHFFFAOYSA-N 2 1 330.432 3.308 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000191473355 528861783 /nfs/dbraw/zinc/86/17/83/528861783.db2.gz SLWCDRKGZBPICP-UHFFFAOYSA-N 2 1 330.432 3.308 20 5 EGBDMP O=[N+]([O-])c1cc(C[N@@H+]2CCCN(c3cc[nH+]cc3)CC2)ccc1Cl ZINC000878748394 1300172612 /nfs/dbraw/zinc/17/26/12/1300172612.db2.gz WIYMVMCSNDADGE-UHFFFAOYSA-N 2 1 346.818 3.356 20 5 EGBDMP O=[N+]([O-])c1cc(C[N@H+]2CCCN(c3cc[nH+]cc3)CC2)ccc1Cl ZINC000878748394 1300172615 /nfs/dbraw/zinc/17/26/15/1300172615.db2.gz WIYMVMCSNDADGE-UHFFFAOYSA-N 2 1 346.818 3.356 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1 ZINC000843127902 1321474083 /nfs/dbraw/zinc/47/40/83/1321474083.db2.gz UICDNCUMXDJEDY-UONOGXRCSA-N 2 1 337.851 3.460 20 5 EGBDMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172904519 1384875483 /nfs/dbraw/zinc/87/54/83/1384875483.db2.gz XXEANJBEKCQZNU-CADBVGFASA-N 2 1 343.471 3.447 20 5 EGBDMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172904519 1384875484 /nfs/dbraw/zinc/87/54/84/1384875484.db2.gz XXEANJBEKCQZNU-CADBVGFASA-N 2 1 343.471 3.447 20 5 EGBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178696307 232386874 /nfs/dbraw/zinc/38/68/74/232386874.db2.gz SFXUOVJFCZTSGK-KBXCAEBGSA-N 2 1 342.443 3.347 20 5 EGBDMP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000268540925 252007153 /nfs/dbraw/zinc/00/71/53/252007153.db2.gz KWRLTHKBTWWYKK-MRXNPFEDSA-N 2 1 347.459 3.312 20 5 EGBDMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000268540925 252007156 /nfs/dbraw/zinc/00/71/56/252007156.db2.gz KWRLTHKBTWWYKK-MRXNPFEDSA-N 2 1 347.459 3.312 20 5 EGBDMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]12 ZINC000346821582 156149894 /nfs/dbraw/zinc/14/98/94/156149894.db2.gz IUEWYBKHYQTBEX-IAOVAPTHSA-N 2 1 327.384 3.024 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000414195402 309066291 /nfs/dbraw/zinc/06/62/91/309066291.db2.gz UUSOJPOZHOJYRC-GJZGRUSLSA-N 2 1 335.448 3.376 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3C[C@H](C[NH3+])C[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000414655983 309093799 /nfs/dbraw/zinc/09/37/99/309093799.db2.gz DYEXMJBACXTTFK-STQMWFEESA-N 2 1 345.399 3.033 20 5 EGBDMP CCc1ccc([C@H]([NH2+]CC2=CC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423348155 309396453 /nfs/dbraw/zinc/39/64/53/309396453.db2.gz RWPFHCYZXXTDSE-LJQANCHMSA-N 2 1 341.411 3.349 20 5 EGBDMP C[N@@H+]1CC=C(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000271866071 455792626 /nfs/dbraw/zinc/79/26/26/455792626.db2.gz WFNGPNQLCDHJJM-UHFFFAOYSA-N 2 1 327.384 3.206 20 5 EGBDMP C[N@H+]1CC[C@H]2[C@H](CCCN2c2ccnc3ccc([N+](=O)[O-])cc32)C1 ZINC000601131937 460724174 /nfs/dbraw/zinc/72/41/74/460724174.db2.gz RVXXHXFZODSMIA-DYVFJYSZSA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@@H+]1CC[C@H]2[C@H](CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601131937 460724180 /nfs/dbraw/zinc/72/41/80/460724180.db2.gz RVXXHXFZODSMIA-DYVFJYSZSA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@H+]1CC[C@H]2[C@H](CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601131937 460724187 /nfs/dbraw/zinc/72/41/87/460724187.db2.gz RVXXHXFZODSMIA-DYVFJYSZSA-N 2 1 326.400 3.064 20 5 EGBDMP CCC[N@@H+](CCN1CC[NH+](CC)CC1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000344162851 456803155 /nfs/dbraw/zinc/80/31/55/456803155.db2.gz ZIRQDKOCVRFGLR-QGZVFWFLSA-N 2 1 348.491 3.005 20 5 EGBDMP C[C@@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435374017 458124779 /nfs/dbraw/zinc/12/47/79/458124779.db2.gz PAAOFCJLAFHTRR-TZMCWYRMSA-N 2 1 331.441 3.492 20 5 EGBDMP C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC[NH2+]CC1 ZINC000435432043 458144831 /nfs/dbraw/zinc/14/48/31/458144831.db2.gz HGHALUDDCPUFRK-AWEZNQCLSA-N 2 1 329.400 3.429 20 5 EGBDMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494489889 458687908 /nfs/dbraw/zinc/68/79/08/458687908.db2.gz BOQVKUQQEOVLRD-JRPNMDOOSA-N 2 1 345.365 3.432 20 5 EGBDMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494489889 458687911 /nfs/dbraw/zinc/68/79/11/458687911.db2.gz BOQVKUQQEOVLRD-JRPNMDOOSA-N 2 1 345.365 3.432 20 5 EGBDMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494489890 458688580 /nfs/dbraw/zinc/68/85/80/458688580.db2.gz BOQVKUQQEOVLRD-UEKVPHQBSA-N 2 1 345.365 3.432 20 5 EGBDMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494489890 458688586 /nfs/dbraw/zinc/68/85/86/458688586.db2.gz BOQVKUQQEOVLRD-UEKVPHQBSA-N 2 1 345.365 3.432 20 5 EGBDMP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000595026560 459220712 /nfs/dbraw/zinc/22/07/12/459220712.db2.gz PPFUGEFHZJPWDJ-ZDUSSCGKSA-N 2 1 332.404 3.239 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cc1[N+](=O)[O-] ZINC000593323631 459842392 /nfs/dbraw/zinc/84/23/92/459842392.db2.gz RNYHVYLWIAINQW-GFCCVEGCSA-N 2 1 347.390 3.442 20 5 EGBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C1CC[NH+](CCOC(C)C)CC1 ZINC000873070403 1297258988 /nfs/dbraw/zinc/25/89/88/1297258988.db2.gz RWDKQRCUWWSSFN-UHFFFAOYSA-N 2 1 349.475 3.191 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000878744572 1300171655 /nfs/dbraw/zinc/17/16/55/1300171655.db2.gz UUZYLNKEIPOXFO-UHFFFAOYSA-N 2 1 346.818 3.356 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000878744572 1300171660 /nfs/dbraw/zinc/17/16/60/1300171660.db2.gz UUZYLNKEIPOXFO-UHFFFAOYSA-N 2 1 346.818 3.356 20 5 EGBDMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccnc1[N+](=O)[O-] ZINC000886302260 1303428334 /nfs/dbraw/zinc/42/83/34/1303428334.db2.gz IUMKJXQDQRXCGI-UHFFFAOYSA-N 2 1 328.416 3.074 20 5 EGBDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccnc1[N+](=O)[O-] ZINC000886302260 1303428337 /nfs/dbraw/zinc/42/83/37/1303428337.db2.gz IUMKJXQDQRXCGI-UHFFFAOYSA-N 2 1 328.416 3.074 20 5 EGBDMP CCC[N@@H+]1CCC[C@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000797113381 1310143411 /nfs/dbraw/zinc/14/34/11/1310143411.db2.gz AOUFXSOXNCZIKQ-IBGZPJMESA-N 2 1 346.475 3.028 20 5 EGBDMP CCC[N@H+]1CCC[C@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000797113381 1310143416 /nfs/dbraw/zinc/14/34/16/1310143416.db2.gz AOUFXSOXNCZIKQ-IBGZPJMESA-N 2 1 346.475 3.028 20 5 EGBDMP C[NH+](C)C1(CNc2cc3cccnc3c3ncccc23)CC[NH+](C)CC1 ZINC001164213593 1383166776 /nfs/dbraw/zinc/16/67/76/1383166776.db2.gz XPWVWMPLORTNQR-UHFFFAOYSA-N 2 1 349.482 3.221 20 5 EGBDMP C[NH+](C)C1(CNc2ccc([N+](=O)[O-])c3ccccc23)CC[NH+](C)CC1 ZINC001164216426 1383167030 /nfs/dbraw/zinc/16/70/30/1383167030.db2.gz AMZKDEIJYOVMNV-UHFFFAOYSA-N 2 1 342.443 3.186 20 5 EGBDMP COc1ccc(C[C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170307593 1384287232 /nfs/dbraw/zinc/28/72/32/1384287232.db2.gz HWVSWCMQCWLLRE-HOTGVXAUSA-N 2 1 349.475 3.389 20 5 EGBDMP C[C@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000344633075 144202454 /nfs/dbraw/zinc/20/24/54/144202454.db2.gz QSBVAVYWRILRAS-DZGCQCFKSA-N 2 1 329.400 3.427 20 5 EGBDMP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000344633075 144202455 /nfs/dbraw/zinc/20/24/55/144202455.db2.gz QSBVAVYWRILRAS-DZGCQCFKSA-N 2 1 329.400 3.427 20 5 EGBDMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]21 ZINC000346848813 156163142 /nfs/dbraw/zinc/16/31/42/156163142.db2.gz RLMORLSAEQEMGL-JCGIZDLHSA-N 2 1 341.411 3.414 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CCCC2 ZINC000417331895 309202039 /nfs/dbraw/zinc/20/20/39/309202039.db2.gz WOTFJISLTJNDKU-AUUYWEPGSA-N 2 1 329.444 3.436 20 5 EGBDMP C[C@H]1C[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000435368843 458120714 /nfs/dbraw/zinc/12/07/14/458120714.db2.gz CESIZNXTLUBVFU-QWHCGFSZSA-N 2 1 331.441 3.492 20 5 EGBDMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1[NH3+] ZINC000435373295 458124565 /nfs/dbraw/zinc/12/45/65/458124565.db2.gz DGJZOMYZBXCHMR-WBMJQRKESA-N 2 1 331.441 3.492 20 5 EGBDMP C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC[C@@H]1CCCC[NH+]1C ZINC000441330104 458921496 /nfs/dbraw/zinc/92/14/96/458921496.db2.gz LGGMIEYBCYJHAD-INIZCTEOSA-N 2 1 335.448 3.170 20 5 EGBDMP C[NH+](CCCOc1ccc([N+](=O)[O-])cc1)CC[C@@H]1CCCC[N@@H+]1C ZINC000441330104 458921501 /nfs/dbraw/zinc/92/15/01/458921501.db2.gz LGGMIEYBCYJHAD-INIZCTEOSA-N 2 1 335.448 3.170 20 5 EGBDMP C[NH+](CCCOc1ccc([N+](=O)[O-])cc1)CC[C@@H]1CCCC[N@H+]1C ZINC000441330104 458921506 /nfs/dbraw/zinc/92/15/06/458921506.db2.gz LGGMIEYBCYJHAD-INIZCTEOSA-N 2 1 335.448 3.170 20 5 EGBDMP CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000595506480 459329216 /nfs/dbraw/zinc/32/92/16/459329216.db2.gz CYZLZSCVYGVEFU-IBGZPJMESA-N 2 1 347.459 3.300 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000591582291 459406867 /nfs/dbraw/zinc/40/68/67/459406867.db2.gz FISUIONZBXVKDK-HIFRSBDPSA-N 2 1 333.432 3.319 20 5 EGBDMP C[N@H+]1CCCC[C@@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000599070097 460150436 /nfs/dbraw/zinc/15/04/36/460150436.db2.gz KUODJMAQTKOPFQ-MAUKXSAKSA-N 2 1 331.460 3.237 20 5 EGBDMP Cc1[nH+]ccn1CCCC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000164593733 534768605 /nfs/dbraw/zinc/76/86/05/534768605.db2.gz UJCNMALGEGTYIZ-GOSISDBHSA-N 2 1 342.443 3.491 20 5 EGBDMP C[NH+]1CCC2(CCC[N@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)CC1 ZINC000796055723 1309894690 /nfs/dbraw/zinc/89/46/90/1309894690.db2.gz DQWSLCVANBQFQO-UHFFFAOYSA-N 2 1 339.386 3.181 20 5 EGBDMP C[NH+]1CCC2(CCC[N@@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)CC1 ZINC000796055723 1309894700 /nfs/dbraw/zinc/89/47/00/1309894700.db2.gz DQWSLCVANBQFQO-UHFFFAOYSA-N 2 1 339.386 3.181 20 5 EGBDMP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000866393430 1330106142 /nfs/dbraw/zinc/10/61/42/1330106142.db2.gz OEBAPHCGUBDWBN-GDBMZVCRSA-N 2 1 349.450 3.377 20 5 EGBDMP Cc1c([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cccc1[N+](=O)[O-] ZINC000132961475 223376800 /nfs/dbraw/zinc/37/68/00/223376800.db2.gz SHFABLLCWMPKEU-HOTGVXAUSA-N 2 1 347.459 3.055 20 5 EGBDMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000122190939 152396287 /nfs/dbraw/zinc/39/62/87/152396287.db2.gz JBHRCDZZSTUGLY-UHFFFAOYSA-N 2 1 349.475 3.165 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000372449964 157333715 /nfs/dbraw/zinc/33/37/15/157333715.db2.gz OBAYXWJYPLNRFM-CWRNSKLLSA-N 2 1 333.432 3.271 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000372449964 157333720 /nfs/dbraw/zinc/33/37/20/157333720.db2.gz OBAYXWJYPLNRFM-CWRNSKLLSA-N 2 1 333.432 3.271 20 5 EGBDMP [NH3+]C[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000423513111 309403846 /nfs/dbraw/zinc/40/38/46/309403846.db2.gz VEAMXDPACOEGIU-JQHSSLGASA-N 2 1 331.460 3.413 20 5 EGBDMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451545985 310184805 /nfs/dbraw/zinc/18/48/05/310184805.db2.gz ILLIXBZLWLNKQR-QGZVFWFLSA-N 2 1 328.416 3.369 20 5 EGBDMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451545985 310184806 /nfs/dbraw/zinc/18/48/06/310184806.db2.gz ILLIXBZLWLNKQR-QGZVFWFLSA-N 2 1 328.416 3.369 20 5 EGBDMP C[C@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000347073659 457216961 /nfs/dbraw/zinc/21/69/61/457216961.db2.gz RUPLYEULISAQDP-KBPBESRZSA-N 2 1 329.400 3.414 20 5 EGBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1c[nH+]cn1C ZINC000530354901 458753355 /nfs/dbraw/zinc/75/33/55/458753355.db2.gz CUCDLENJWLPWML-ZDUSSCGKSA-N 2 1 334.445 3.031 20 5 EGBDMP C[NH+](C)C1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCC1 ZINC000480137902 459183946 /nfs/dbraw/zinc/18/39/46/459183946.db2.gz MENPZEAFBFNHCD-KRWDZBQOSA-N 2 1 331.460 3.380 20 5 EGBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000534328443 459314961 /nfs/dbraw/zinc/31/49/61/459314961.db2.gz IRZURNGJVHOWGA-LSDHHAIUSA-N 2 1 337.489 3.397 20 5 EGBDMP [NH3+]C[C@@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000574400847 459814339 /nfs/dbraw/zinc/81/43/39/459814339.db2.gz ZCRKNBLWCQDJDB-FZWSFRSISA-N 2 1 337.423 3.282 20 5 EGBDMP COc1ccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cc1[N+](=O)[O-] ZINC000609133463 459908236 /nfs/dbraw/zinc/90/82/36/459908236.db2.gz KMDXMXURBSPTFF-UHFFFAOYSA-N 2 1 335.448 3.156 20 5 EGBDMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602687347 460067461 /nfs/dbraw/zinc/06/74/61/460067461.db2.gz KEFXNBAHUHMLPE-GFCCVEGCSA-N 2 1 345.365 3.435 20 5 EGBDMP C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C[NH+]1CCCCC1 ZINC000761522974 1301490201 /nfs/dbraw/zinc/49/02/01/1301490201.db2.gz OGKVSLWADBYBAW-CYBMUJFWSA-N 2 1 325.840 3.460 20 5 EGBDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000788673902 1305994011 /nfs/dbraw/zinc/99/40/11/1305994011.db2.gz YVVKTFPLDFVWMG-HUUCEWRRSA-N 2 1 334.464 3.196 20 5 EGBDMP CC[NH+]1C[C@H]2C[NH+](Cc3ccc4ccc5cccnc5c4n3)C[C@@H]2C1 ZINC001232227641 1376419198 /nfs/dbraw/zinc/41/91/98/1376419198.db2.gz JUEBHLUIGQHOTO-ROUUACIJSA-N 2 1 332.451 3.167 20 5 EGBDMP COc1ccc(C[C@@H](C)[NH+]2CCC([NH3+])(CC3CC3)CC2)c([N+](=O)[O-])c1 ZINC001170323845 1384291202 /nfs/dbraw/zinc/29/12/02/1384291202.db2.gz MOLSPCWLXMTPKG-CQSZACIVSA-N 2 1 347.459 3.128 20 5 EGBDMP COc1ccc(C[C@H](C)[NH2+][C@H]2CC[N@H+](C(C)C)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170329324 1384292971 /nfs/dbraw/zinc/29/29/71/1384292971.db2.gz OMYPATNMJDHEOF-MPGHIAIKSA-N 2 1 349.475 3.243 20 5 EGBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC([NH3+])(c2ccccc2)CC1 ZINC001173225672 1384940071 /nfs/dbraw/zinc/94/00/71/1384940071.db2.gz UOSPGHHZQZVFCX-MRXNPFEDSA-N 2 1 339.439 3.476 20 5 EGBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC001173228960 1384940729 /nfs/dbraw/zinc/94/07/29/1384940729.db2.gz OMYACLIJQGUULD-MRXNPFEDSA-N 2 1 331.460 3.476 20 5 EGBDMP C[NH2+][C@H](C)CC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC001331419837 1389740663 /nfs/dbraw/zinc/74/06/63/1389740663.db2.gz SPJARZPRZINLAR-OAHLLOKOSA-N 2 1 342.443 3.450 20 5 EGBDMP C[NH+]1CCC2(CCC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000366949364 168160349 /nfs/dbraw/zinc/16/03/49/168160349.db2.gz AQXGKLPHOPWZLK-QPJJXVBHSA-N 2 1 329.444 3.416 20 5 EGBDMP COCCC[NH+]1CCC([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000159133347 225154769 /nfs/dbraw/zinc/15/47/69/225154769.db2.gz YAIZFXVZVQCZBR-HNNXBMFYSA-N 2 1 335.448 3.055 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000122324309 222062821 /nfs/dbraw/zinc/06/28/21/222062821.db2.gz VDFQQSFDRLIMFD-GJYPPUQNSA-N 2 1 349.475 3.382 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000122324309 222062825 /nfs/dbraw/zinc/06/28/25/222062825.db2.gz VDFQQSFDRLIMFD-GJYPPUQNSA-N 2 1 349.475 3.382 20 5 EGBDMP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000278564544 268040750 /nfs/dbraw/zinc/04/07/50/268040750.db2.gz PGQODKDXQBJHDC-IRXDYDNUSA-N 2 1 349.475 3.006 20 5 EGBDMP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC000278564544 268040751 /nfs/dbraw/zinc/04/07/51/268040751.db2.gz PGQODKDXQBJHDC-IRXDYDNUSA-N 2 1 349.475 3.006 20 5 EGBDMP CC1(C)C[C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279075022 275301778 /nfs/dbraw/zinc/30/17/78/275301778.db2.gz MBMRLJBLLSZWAX-UGSOOPFHSA-N 2 1 329.444 3.391 20 5 EGBDMP [NH3+]CCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000359470459 303376247 /nfs/dbraw/zinc/37/62/47/303376247.db2.gz FENDNHZDOLTHBJ-WDZFZDKYSA-N 2 1 325.412 3.459 20 5 EGBDMP C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000294297731 308207997 /nfs/dbraw/zinc/20/79/97/308207997.db2.gz NBYCUINBDDTDRK-SQWLQELKSA-N 2 1 346.475 3.481 20 5 EGBDMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272603608 456009583 /nfs/dbraw/zinc/00/95/83/456009583.db2.gz JJFXWXPFVPOYIG-JMSVASOKSA-N 2 1 325.840 3.109 20 5 EGBDMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000095968180 454242380 /nfs/dbraw/zinc/24/23/80/454242380.db2.gz ZKQWYMXVXYADSG-JKSUJKDBSA-N 2 1 347.459 3.055 20 5 EGBDMP C[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185736376 455609891 /nfs/dbraw/zinc/60/98/91/455609891.db2.gz IOKGLUOUZZYFFJ-CVEARBPZSA-N 2 1 347.459 3.216 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC000432369824 458726425 /nfs/dbraw/zinc/72/64/25/458726425.db2.gz XIAQUSKELMGPSC-WBILKINKSA-N 2 1 347.459 3.089 20 5 EGBDMP O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592433713 459599974 /nfs/dbraw/zinc/59/99/74/459599974.db2.gz PPLXAVZENZHAKO-PUZHUATGSA-N 2 1 329.444 3.320 20 5 EGBDMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000610818832 460241844 /nfs/dbraw/zinc/24/18/44/460241844.db2.gz GQQNVAAQIHRARV-QAPCUYQASA-N 2 1 347.459 3.197 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000187012796 528669555 /nfs/dbraw/zinc/66/95/55/528669555.db2.gz QFSXZIROJOVLEI-QAPCUYQASA-N 2 1 349.475 3.130 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000187012796 528669559 /nfs/dbraw/zinc/66/95/59/528669559.db2.gz QFSXZIROJOVLEI-QAPCUYQASA-N 2 1 349.475 3.130 20 5 EGBDMP Cc1[nH]c(C2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)[nH+]c1C ZINC000886666709 1303546960 /nfs/dbraw/zinc/54/69/60/1303546960.db2.gz YMOBYEFCBSXWQG-UHFFFAOYSA-N 2 1 328.416 3.357 20 5 EGBDMP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000819128951 1319642901 /nfs/dbraw/zinc/64/29/01/1319642901.db2.gz VLRMPCHCLPNPKX-IBGZPJMESA-N 2 1 347.459 3.015 20 5 EGBDMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000859213026 1328947171 /nfs/dbraw/zinc/94/71/71/1328947171.db2.gz LIPHEJKRWUEZOM-UHFFFAOYSA-N 2 1 331.391 3.428 20 5 EGBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000859213026 1328947175 /nfs/dbraw/zinc/94/71/75/1328947175.db2.gz LIPHEJKRWUEZOM-UHFFFAOYSA-N 2 1 331.391 3.428 20 5 EGBDMP C[N@@H+](Cc1ccccc1)C1CC[NH+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169022540 1384092632 /nfs/dbraw/zinc/09/26/32/1384092632.db2.gz CSWAZHYFUUMAPA-HKUYNNGSSA-N 2 1 331.460 3.028 20 5 EGBDMP CC[NH+]1CCC([N@H+](C)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172912477 1384876068 /nfs/dbraw/zinc/87/60/68/1384876068.db2.gz AWFUQABPAUAFJA-QGZVFWFLSA-N 2 1 331.460 3.258 20 5 EGBDMP CC[NH+]1CCC([N@@H+](C)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172912477 1384876072 /nfs/dbraw/zinc/87/60/72/1384876072.db2.gz AWFUQABPAUAFJA-QGZVFWFLSA-N 2 1 331.460 3.258 20 5 EGBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC([NH3+])(c2ccccc2)CC1 ZINC001173225669 1384940146 /nfs/dbraw/zinc/94/01/46/1384940146.db2.gz UOSPGHHZQZVFCX-INIZCTEOSA-N 2 1 339.439 3.476 20 5 EGBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000178708211 232394321 /nfs/dbraw/zinc/39/43/21/232394321.db2.gz ZXNNEAZOQDYPKY-CABCVRRESA-N 2 1 330.432 3.347 20 5 EGBDMP Cc1[nH+]ccn1CCC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000268773807 252223630 /nfs/dbraw/zinc/22/36/30/252223630.db2.gz AMYUOQQMANKJNA-KRWDZBQOSA-N 2 1 328.416 3.101 20 5 EGBDMP O=[N+]([O-])c1cccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000192924401 153265922 /nfs/dbraw/zinc/26/59/22/153265922.db2.gz VRYKOXNVMSIIQQ-SFHVURJKSA-N 2 1 325.412 3.207 20 5 EGBDMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]12 ZINC000346852149 156164914 /nfs/dbraw/zinc/16/49/14/156164914.db2.gz WKFMKWYTOXHFMW-IAOVAPTHSA-N 2 1 327.384 3.024 20 5 EGBDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc([O-])ccc2[N+](=O)[O-])CC1 ZINC000350222624 165019664 /nfs/dbraw/zinc/01/96/64/165019664.db2.gz QGRPXACABRYARO-UHFFFAOYSA-N 2 1 335.448 3.244 20 5 EGBDMP CC[N@@H+]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000279609682 275343822 /nfs/dbraw/zinc/34/38/22/275343822.db2.gz XGUMQDTWKJUFKR-NHYWBVRUSA-N 2 1 345.365 3.434 20 5 EGBDMP CC[N@H+]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000279609682 275343824 /nfs/dbraw/zinc/34/38/24/275343824.db2.gz XGUMQDTWKJUFKR-NHYWBVRUSA-N 2 1 345.365 3.434 20 5 EGBDMP C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294941178 308274252 /nfs/dbraw/zinc/27/42/52/308274252.db2.gz YBJFIHPKUHGMRN-ZDUSSCGKSA-N 2 1 332.448 3.235 20 5 EGBDMP CN(c1ccccc1)c1ccc(C[NH2+]CCC[NH+](C)C)cc1[N+](=O)[O-] ZINC000340456861 456470933 /nfs/dbraw/zinc/47/09/33/456470933.db2.gz BGJWXZJXDILTJH-UHFFFAOYSA-N 2 1 342.443 3.404 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H]4[NH2+]CC[C@@H]4C3)o2)cc1 ZINC000427134558 457946933 /nfs/dbraw/zinc/94/69/33/457946933.db2.gz ZKYQRJFJKXLASA-PBHICJAKSA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]4[NH2+]CC[C@@H]4C3)o2)cc1 ZINC000427134558 457946941 /nfs/dbraw/zinc/94/69/41/457946941.db2.gz ZKYQRJFJKXLASA-PBHICJAKSA-N 2 1 327.384 3.039 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000599070622 460150650 /nfs/dbraw/zinc/15/06/50/460150650.db2.gz MBEIKPSISYKULF-GJZGRUSLSA-N 2 1 335.448 3.376 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000599070622 460150659 /nfs/dbraw/zinc/15/06/59/460150659.db2.gz MBEIKPSISYKULF-GJZGRUSLSA-N 2 1 335.448 3.376 20 5 EGBDMP CC1([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC[NH+](Cc2ccccc2)CC1 ZINC001169006803 1384086066 /nfs/dbraw/zinc/08/60/66/1384086066.db2.gz ZCPHEALURJMGIL-ZWKOTPCHSA-N 2 1 331.460 3.076 20 5 EGBDMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172900020 1384874366 /nfs/dbraw/zinc/87/43/66/1384874366.db2.gz RHFOSXHWUVOMFF-MAUKXSAKSA-N 2 1 331.460 3.164 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH+]1CCC([NH+]3CCC3)CC1)CC2 ZINC001172913527 1384876537 /nfs/dbraw/zinc/87/65/37/1384876537.db2.gz RLHDEADWLSKVLX-KRWDZBQOSA-N 2 1 329.444 3.012 20 5 EGBDMP CC[N@@H+](C)C1CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172912931 1384876543 /nfs/dbraw/zinc/87/65/43/1384876543.db2.gz MTTKEQBDNRKYMU-GOSISDBHSA-N 2 1 331.460 3.258 20 5 EGBDMP CC[N@@H+](C)C1CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172912933 1384877198 /nfs/dbraw/zinc/87/71/98/1384877198.db2.gz MTTKEQBDNRKYMU-SFHVURJKSA-N 2 1 331.460 3.258 20 5 EGBDMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@H]21 ZINC000346836761 156159077 /nfs/dbraw/zinc/15/90/77/156159077.db2.gz VOBVDRLQLHLROF-ZTFGCOKTSA-N 2 1 341.411 3.414 20 5 EGBDMP Cc1c([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000278385802 268000627 /nfs/dbraw/zinc/00/06/27/268000627.db2.gz CNVGXATZDRWYFW-GOEBONIOSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1c([C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000278385802 268000631 /nfs/dbraw/zinc/00/06/31/268000631.db2.gz CNVGXATZDRWYFW-GOEBONIOSA-N 2 1 335.448 3.055 20 5 EGBDMP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414831688 309104394 /nfs/dbraw/zinc/10/43/94/309104394.db2.gz DKQAPSJEYNRHFC-NSHDSACASA-N 2 1 337.807 3.453 20 5 EGBDMP C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[NH2+]C1 ZINC000414842322 309104997 /nfs/dbraw/zinc/10/49/97/309104997.db2.gz BDMFULMEWBLNFM-ZFWWWQNUSA-N 2 1 329.400 3.333 20 5 EGBDMP C[C@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCC[NH2+]C1 ZINC000414847625 309105309 /nfs/dbraw/zinc/10/53/09/309105309.db2.gz FWIIMTCMRPHSSV-DZGCQCFKSA-N 2 1 329.400 3.333 20 5 EGBDMP COc1ccc(-c2ccc(C[NH2+]C3(C)CC[NH2+]CC3)o2)c([N+](=O)[O-])c1 ZINC000414947205 309110707 /nfs/dbraw/zinc/11/07/07/309110707.db2.gz VPSJVNLLHJELBH-UHFFFAOYSA-N 2 1 345.399 3.095 20 5 EGBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C[NH3+])CC(C)C ZINC000423257851 309392708 /nfs/dbraw/zinc/39/27/08/309392708.db2.gz AIPQDTPDFDRUKU-UONOGXRCSA-N 2 1 325.478 3.429 20 5 EGBDMP C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCN(CCC(F)(F)F)CC1 ZINC000489063869 311091423 /nfs/dbraw/zinc/09/14/23/311091423.db2.gz AYCGCPOOLOWDRS-UHFFFAOYSA-N 2 1 345.365 3.443 20 5 EGBDMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)C1 ZINC000153145302 454764198 /nfs/dbraw/zinc/76/41/98/454764198.db2.gz HCDLFQKOVVCOES-LSDHHAIUSA-N 2 1 335.448 3.376 20 5 EGBDMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)C1 ZINC000153145302 454764202 /nfs/dbraw/zinc/76/42/02/454764202.db2.gz HCDLFQKOVVCOES-LSDHHAIUSA-N 2 1 335.448 3.376 20 5 EGBDMP CCC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1cccc([N+](=O)[O-])c1 ZINC000268844447 455716047 /nfs/dbraw/zinc/71/60/47/455716047.db2.gz BJMHNYLQBLEGOM-RTBURBONSA-N 2 1 349.475 3.263 20 5 EGBDMP O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H](C[NH+]4CCCC4)C3)c2c1 ZINC000601121860 460718390 /nfs/dbraw/zinc/71/83/90/460718390.db2.gz PYTSOAPLKGHPPE-CQSZACIVSA-N 2 1 326.400 3.065 20 5 EGBDMP C[C@@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435374016 458124057 /nfs/dbraw/zinc/12/40/57/458124057.db2.gz PAAOFCJLAFHTRR-OCCSQVGLSA-N 2 1 331.441 3.492 20 5 EGBDMP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[NH2+]CC1 ZINC000435438991 458147658 /nfs/dbraw/zinc/14/76/58/458147658.db2.gz SHKWLTKQVYUVRO-HNNXBMFYSA-N 2 1 329.400 3.429 20 5 EGBDMP CC(C)c1ccc(C[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000432349831 458722090 /nfs/dbraw/zinc/72/20/90/458722090.db2.gz YEKCVKYIDWFQCK-MRXNPFEDSA-N 2 1 349.475 3.309 20 5 EGBDMP CC(C)c1ccc(C[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000432349831 458722094 /nfs/dbraw/zinc/72/20/94/458722094.db2.gz YEKCVKYIDWFQCK-MRXNPFEDSA-N 2 1 349.475 3.309 20 5 EGBDMP CC(C)[N@@H+](C)CC1CCN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000556813540 459013752 /nfs/dbraw/zinc/01/37/52/459013752.db2.gz ZYGKSCWRKNEXQK-UHFFFAOYSA-N 2 1 341.402 3.425 20 5 EGBDMP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596058803 459504781 /nfs/dbraw/zinc/50/47/81/459504781.db2.gz JLXBEVNPKOLIDR-RJIDQJRZSA-N 2 1 329.444 3.320 20 5 EGBDMP CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1[NH3+] ZINC000592427553 459598327 /nfs/dbraw/zinc/59/83/27/459598327.db2.gz BTHHOUODAFAISU-DYVFJYSZSA-N 2 1 329.400 3.414 20 5 EGBDMP Cc1c(C[N@H+]2CCCN(c3cc[nH+]cc3)CC2)cccc1[N+](=O)[O-] ZINC000602845422 460155327 /nfs/dbraw/zinc/15/53/27/460155327.db2.gz KSXSMSUDGLYWMP-UHFFFAOYSA-N 2 1 326.400 3.011 20 5 EGBDMP Cc1c([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cccc1[N+](=O)[O-] ZINC000765976379 1302360529 /nfs/dbraw/zinc/36/05/29/1302360529.db2.gz OEOOBJLBKNFFNS-RDJZCZTQSA-N 2 1 347.459 3.197 20 5 EGBDMP C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CCC([NH3+])CC1 ZINC000843054746 1321462756 /nfs/dbraw/zinc/46/27/56/1321462756.db2.gz FJVWKTYBRHAMTL-UHFFFAOYSA-N 2 1 346.456 3.420 20 5 EGBDMP C[C@H](C[N+](C)(C)C)Oc1ccc2c(n1)CC[N@@H+](Cc1ccccc1)C2 ZINC001226742126 1375322985 /nfs/dbraw/zinc/32/29/85/1375322985.db2.gz CQXVVCHWXZKUAA-QGZVFWFLSA-N 2 1 340.491 3.113 20 5 EGBDMP C[C@H](C[N+](C)(C)C)Oc1ccc2c(n1)CC[N@H+](Cc1ccccc1)C2 ZINC001226742126 1375322991 /nfs/dbraw/zinc/32/29/91/1375322991.db2.gz CQXVVCHWXZKUAA-QGZVFWFLSA-N 2 1 340.491 3.113 20 5 EGBDMP CC(C)[N@@H+]1CC[C@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)[C@@H](C)C1 ZINC001163367478 1383032745 /nfs/dbraw/zinc/03/27/45/1383032745.db2.gz ZIGAZBCHRLKWDG-YKNXIFKJSA-N 2 1 347.463 3.053 20 5 EGBDMP CC(C)[N@H+]1CC[C@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)[C@@H](C)C1 ZINC001163367478 1383032749 /nfs/dbraw/zinc/03/27/49/1383032749.db2.gz ZIGAZBCHRLKWDG-YKNXIFKJSA-N 2 1 347.463 3.053 20 5 EGBDMP O=[N+]([O-])C[C@H]1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001168961620 1384071944 /nfs/dbraw/zinc/07/19/44/1384071944.db2.gz JEWSWXIUMXEFRN-FSGKZVOOSA-N 2 1 343.471 3.217 20 5 EGBDMP C[C@@H]1C[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000344610650 144198292 /nfs/dbraw/zinc/19/82/92/144198292.db2.gz AYRUXAOPTKYLDT-ZIAGYGMSSA-N 2 1 329.400 3.427 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000344610650 144198293 /nfs/dbraw/zinc/19/82/93/144198293.db2.gz AYRUXAOPTKYLDT-ZIAGYGMSSA-N 2 1 329.400 3.427 20 5 EGBDMP C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[NH2+]C1 ZINC000414842307 309105056 /nfs/dbraw/zinc/10/50/56/309105056.db2.gz BDMFULMEWBLNFM-HIFRSBDPSA-N 2 1 329.400 3.333 20 5 EGBDMP C[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCC[NH2+]C1 ZINC000414847633 309105349 /nfs/dbraw/zinc/10/53/49/309105349.db2.gz FWIIMTCMRPHSSV-UKRRQHHQSA-N 2 1 329.400 3.333 20 5 EGBDMP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000414928600 309109738 /nfs/dbraw/zinc/10/97/38/309109738.db2.gz QIKRQFUREOXYJB-QWHCGFSZSA-N 2 1 332.429 3.078 20 5 EGBDMP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CC[NH2+]C2CCCCCC2)n1 ZINC000423282994 309393991 /nfs/dbraw/zinc/39/39/91/309393991.db2.gz VNUIAPHYJUAKCD-IAGOWNOFSA-N 2 1 349.479 3.177 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000571955449 317270953 /nfs/dbraw/zinc/27/09/53/317270953.db2.gz MHANURQILPDKSW-HOTGVXAUSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC000571955449 317270955 /nfs/dbraw/zinc/27/09/55/317270955.db2.gz MHANURQILPDKSW-HOTGVXAUSA-N 2 1 335.448 3.055 20 5 EGBDMP CCC[N@@H+](C)C[C@@H]1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000081516795 453880672 /nfs/dbraw/zinc/88/06/72/453880672.db2.gz WMARIJRCZPWVLM-INIZCTEOSA-N 2 1 335.448 3.027 20 5 EGBDMP CCC[NH+](C)C[C@@H]1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000081516795 453880675 /nfs/dbraw/zinc/88/06/75/453880675.db2.gz WMARIJRCZPWVLM-INIZCTEOSA-N 2 1 335.448 3.027 20 5 EGBDMP CCC[NH+](C)C[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000081516795 453880677 /nfs/dbraw/zinc/88/06/77/453880677.db2.gz WMARIJRCZPWVLM-INIZCTEOSA-N 2 1 335.448 3.027 20 5 EGBDMP COc1ccc(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000134903556 454606392 /nfs/dbraw/zinc/60/63/92/454606392.db2.gz PTBNGIWJAGJKDN-WBVHZDCISA-N 2 1 345.443 3.052 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000134932068 454611344 /nfs/dbraw/zinc/61/13/44/454611344.db2.gz ORESVFSAKUYRPP-APWZRJJASA-N 2 1 329.444 3.086 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000134932068 454611345 /nfs/dbraw/zinc/61/13/45/454611345.db2.gz ORESVFSAKUYRPP-APWZRJJASA-N 2 1 329.444 3.086 20 5 EGBDMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000271873359 455794886 /nfs/dbraw/zinc/79/48/86/455794886.db2.gz NKBNYZCSAKTSNC-FUHWJXTLSA-N 2 1 329.444 3.158 20 5 EGBDMP Cc1[nH+]ccn1CCCN(C)c1cc(C)[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000302095256 456286023 /nfs/dbraw/zinc/28/60/23/456286023.db2.gz RRCXXFFSNPZSNQ-UHFFFAOYSA-N 2 1 339.399 3.483 20 5 EGBDMP CN(CCC[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1)Cc1ccco1 ZINC000353571953 456771744 /nfs/dbraw/zinc/77/17/44/456771744.db2.gz JGPRMBIFSJVHRZ-UHFFFAOYSA-N 2 1 331.416 3.184 20 5 EGBDMP C[C@@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000347070016 457214868 /nfs/dbraw/zinc/21/48/68/457214868.db2.gz PCKKGRIZNQAYCR-UKRRQHHQSA-N 2 1 329.400 3.414 20 5 EGBDMP C[C@H]1C[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000435373701 458124551 /nfs/dbraw/zinc/12/45/51/458124551.db2.gz OCQDKMOWLQFUAC-STQMWFEESA-N 2 1 331.441 3.492 20 5 EGBDMP [NH3+]C[C@H]([NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000423513114 458447334 /nfs/dbraw/zinc/44/73/34/458447334.db2.gz VEAMXDPACOEGIU-SZMVWBNQSA-N 2 1 331.460 3.413 20 5 EGBDMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494489888 458688662 /nfs/dbraw/zinc/68/86/62/458688662.db2.gz BOQVKUQQEOVLRD-HFAKWTLXSA-N 2 1 345.365 3.432 20 5 EGBDMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494489888 458688669 /nfs/dbraw/zinc/68/86/69/458688669.db2.gz BOQVKUQQEOVLRD-HFAKWTLXSA-N 2 1 345.365 3.432 20 5 EGBDMP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000595015567 459217126 /nfs/dbraw/zinc/21/71/26/459217126.db2.gz ZBYLEQNKKZOVEU-QWHCGFSZSA-N 2 1 332.404 3.095 20 5 EGBDMP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596094027 459518615 /nfs/dbraw/zinc/51/86/15/459518615.db2.gz HBPFAERNHZBHAQ-QAPCUYQASA-N 2 1 329.444 3.294 20 5 EGBDMP COc1ccc(-c2ccc(C[NH+]3CCC(C)([NH3+])CC3)o2)c([N+](=O)[O-])c1 ZINC000592431558 459600351 /nfs/dbraw/zinc/60/03/51/459600351.db2.gz HVTMAORLSQGLAD-UHFFFAOYSA-N 2 1 345.399 3.177 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592492589 459613610 /nfs/dbraw/zinc/61/36/10/459613610.db2.gz BGIIZXHSFZDHPD-KBPBESRZSA-N 2 1 337.851 3.460 20 5 EGBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866259074 1330086796 /nfs/dbraw/zinc/08/67/96/1330086796.db2.gz GMVJZWNTUJTLNC-CHWSQXEVSA-N 2 1 334.395 3.096 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2F)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168999917 1384083658 /nfs/dbraw/zinc/08/36/58/1384083658.db2.gz WGYPZXBQZYTZDG-LEUOFYLZSA-N 2 1 349.450 3.343 20 5 EGBDMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169030343 1384094407 /nfs/dbraw/zinc/09/44/07/1384094407.db2.gz YXZDQJHTPKXTLT-AZUAARDMSA-N 2 1 345.487 3.418 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001169037686 1384097530 /nfs/dbraw/zinc/09/75/30/1384097530.db2.gz SREDBFUIGPTNBB-HSALFYBXSA-N 2 1 343.471 3.030 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001169037686 1384097535 /nfs/dbraw/zinc/09/75/35/1384097535.db2.gz SREDBFUIGPTNBB-HSALFYBXSA-N 2 1 343.471 3.030 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001169037686 1384097539 /nfs/dbraw/zinc/09/75/39/1384097539.db2.gz SREDBFUIGPTNBB-HSALFYBXSA-N 2 1 343.471 3.030 20 5 EGBDMP COc1ccc(C[C@@H](C)[N@H+]2CCCC[C@H](CCC[NH3+])C2)c([N+](=O)[O-])c1 ZINC001170326143 1384291144 /nfs/dbraw/zinc/29/11/44/1384291144.db2.gz FKCKVXYARBCGTP-HZPDHXFCSA-N 2 1 349.475 3.375 20 5 EGBDMP CC[C@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000159176395 529584645 /nfs/dbraw/zinc/58/46/45/529584645.db2.gz GVXBASIMZWUNQV-SFHVURJKSA-N 2 1 335.448 3.136 20 5 EGBDMP O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000192926078 153268373 /nfs/dbraw/zinc/26/83/73/153268373.db2.gz ALWXCKXOTZJGPX-SFHVURJKSA-N 2 1 325.412 3.207 20 5 EGBDMP CCOc1cc(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)ccc1[N+](=O)[O-] ZINC000367201021 168192329 /nfs/dbraw/zinc/19/23/29/168192329.db2.gz QQBIACCAASCOFY-UHFFFAOYSA-N 2 1 347.459 3.301 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000132959623 454380745 /nfs/dbraw/zinc/38/07/45/454380745.db2.gz NRRPRLAWJFIVBN-CVEARBPZSA-N 2 1 347.459 3.055 20 5 EGBDMP Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272829039 456082600 /nfs/dbraw/zinc/08/26/00/456082600.db2.gz KRWOQAQBMZWXIU-HIFRSBDPSA-N 2 1 326.400 3.124 20 5 EGBDMP C[NH+]1CCC([C@H]2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000601134901 460725384 /nfs/dbraw/zinc/72/53/84/460725384.db2.gz JISDIJAJTONJTO-HNNXBMFYSA-N 2 1 340.427 3.311 20 5 EGBDMP Cc1cc(N(C)C[C@H]2CCC[N@@H+](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302190991 456312833 /nfs/dbraw/zinc/31/28/33/456312833.db2.gz QXPQUGZABWOYOB-AWEZNQCLSA-N 2 1 328.416 3.229 20 5 EGBDMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435386948 458132248 /nfs/dbraw/zinc/13/22/48/458132248.db2.gz ZGMLHZHZAUGVGA-CYBMUJFWSA-N 2 1 331.441 3.365 20 5 EGBDMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447506510 458301130 /nfs/dbraw/zinc/30/11/30/458301130.db2.gz CXYMHJRXORGIII-IKGGRYGDSA-N 2 1 349.479 3.129 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC000432369822 458726259 /nfs/dbraw/zinc/72/62/59/458726259.db2.gz XIAQUSKELMGPSC-NWNNTGRJSA-N 2 1 347.459 3.089 20 5 EGBDMP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596058800 459504050 /nfs/dbraw/zinc/50/40/50/459504050.db2.gz JLXBEVNPKOLIDR-GALSZHCDSA-N 2 1 329.444 3.320 20 5 EGBDMP O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592433710 459599991 /nfs/dbraw/zinc/59/99/91/459599991.db2.gz PPLXAVZENZHAKO-AEEZDXSHSA-N 2 1 329.444 3.320 20 5 EGBDMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000610818830 460242241 /nfs/dbraw/zinc/24/22/41/460242241.db2.gz GQQNVAAQIHRARV-CRAIPNDOSA-N 2 1 347.459 3.197 20 5 EGBDMP C[N@@H+](CCCC[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000834909431 1293172995 /nfs/dbraw/zinc/17/29/95/1293172995.db2.gz NUHQTNCKLQIOLO-UHFFFAOYSA-N 2 1 346.475 3.028 20 5 EGBDMP O=[N+]([O-])c1ccc(C[N@@H+](Cc2cc3c(s2)CC[NH2+]C3)C2CC2)cc1 ZINC000873202860 1297346951 /nfs/dbraw/zinc/34/69/51/1297346951.db2.gz GLEVNLYKWLFXIH-UHFFFAOYSA-N 2 1 343.452 3.467 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000765977680 1302363799 /nfs/dbraw/zinc/36/37/99/1302363799.db2.gz RWZITGDAQHXARU-QAPCUYQASA-N 2 1 347.459 3.197 20 5 EGBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000859214179 1328947627 /nfs/dbraw/zinc/94/76/27/1328947627.db2.gz NOEVYUZSKKTFGJ-UHFFFAOYSA-N 2 1 343.427 3.167 20 5 EGBDMP O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001168961627 1384072098 /nfs/dbraw/zinc/07/20/98/1384072098.db2.gz JEWSWXIUMXEFRN-YHDCXSKOSA-N 2 1 343.471 3.217 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168999914 1384083815 /nfs/dbraw/zinc/08/38/15/1384083815.db2.gz WGYPZXBQZYTZDG-DDBAPUKQSA-N 2 1 349.450 3.343 20 5 EGBDMP CCCC[N@@H+](C)CCC[NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170297716 1384285047 /nfs/dbraw/zinc/28/50/47/1384285047.db2.gz QVSVUCYTDCVUBK-HNNXBMFYSA-N 2 1 337.464 3.246 20 5 EGBDMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cccc1[N+](=O)[O-] ZINC000132961679 223377080 /nfs/dbraw/zinc/37/70/80/223377080.db2.gz SHFABLLCWMPKEU-HZPDHXFCSA-N 2 1 347.459 3.055 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000344792445 533409270 /nfs/dbraw/zinc/40/92/70/533409270.db2.gz MSIMUQPFQXIPFF-AAWPKVBNSA-N 2 1 328.416 3.429 20 5 EGBDMP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000347006419 156242986 /nfs/dbraw/zinc/24/29/86/156242986.db2.gz QDTPCFKJUFDPEO-CQSZACIVSA-N 2 1 329.400 3.286 20 5 EGBDMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000347006419 156242990 /nfs/dbraw/zinc/24/29/90/156242990.db2.gz QDTPCFKJUFDPEO-CQSZACIVSA-N 2 1 329.400 3.286 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]CCCn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000271143840 266609035 /nfs/dbraw/zinc/60/90/35/266609035.db2.gz OXMYMSNEYGSQIW-CYBMUJFWSA-N 2 1 332.404 3.239 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CCC2 ZINC000192700131 275038073 /nfs/dbraw/zinc/03/80/73/275038073.db2.gz OFEZHRUAUYACTL-LJQANCHMSA-N 2 1 329.444 3.436 20 5 EGBDMP CC1(C)C[C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279075019 275301758 /nfs/dbraw/zinc/30/17/58/275301758.db2.gz MBMRLJBLLSZWAX-SCLBCKFNSA-N 2 1 329.444 3.391 20 5 EGBDMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000414172160 309064678 /nfs/dbraw/zinc/06/46/78/309064678.db2.gz FBMYVLHMTSTYBA-MAUKXSAKSA-N 2 1 331.460 3.237 20 5 EGBDMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C[C@H]12 ZINC000414670815 309094635 /nfs/dbraw/zinc/09/46/35/309094635.db2.gz NAVKNEBUQHJFKF-UHOFOFEASA-N 2 1 343.452 3.492 20 5 EGBDMP COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[NH2+][C@@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000414954682 309111355 /nfs/dbraw/zinc/11/13/55/309111355.db2.gz SWIUDUYNEBKMNT-QWHCGFSZSA-N 2 1 345.399 3.094 20 5 EGBDMP CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420322015 309281982 /nfs/dbraw/zinc/28/19/82/309281982.db2.gz DQPXWMJWFUEHGR-HOTGVXAUSA-N 2 1 347.459 3.204 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000513831481 312218616 /nfs/dbraw/zinc/21/86/16/312218616.db2.gz SAIGIKPQLVRFAP-ATLSCFEFSA-N 2 1 331.460 3.378 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000513831481 312218617 /nfs/dbraw/zinc/21/86/17/312218617.db2.gz SAIGIKPQLVRFAP-ATLSCFEFSA-N 2 1 331.460 3.378 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000173420242 323295545 /nfs/dbraw/zinc/29/55/45/323295545.db2.gz AVSXQXSQTZTOES-GJYPPUQNSA-N 2 1 349.475 3.382 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000173420242 323295547 /nfs/dbraw/zinc/29/55/47/323295547.db2.gz AVSXQXSQTZTOES-GJYPPUQNSA-N 2 1 349.475 3.382 20 5 EGBDMP CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000158961602 455341106 /nfs/dbraw/zinc/34/11/06/455341106.db2.gz XRPMQAXQOVAWDM-CRAIPNDOSA-N 2 1 347.459 3.298 20 5 EGBDMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000151098767 454936773 /nfs/dbraw/zinc/93/67/73/454936773.db2.gz ZPWMWVNURYKUQA-QAPCUYQASA-N 2 1 331.460 3.237 20 5 EGBDMP Cn1ccnc1C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000179435539 455047817 /nfs/dbraw/zinc/04/78/17/455047817.db2.gz QOJDXPIZZJPBMM-CYBMUJFWSA-N 2 1 348.834 3.436 20 5 EGBDMP Cn1ccnc1C[C@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000179435539 455047819 /nfs/dbraw/zinc/04/78/19/455047819.db2.gz QOJDXPIZZJPBMM-CYBMUJFWSA-N 2 1 348.834 3.436 20 5 EGBDMP Cc1c(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000247017194 455544563 /nfs/dbraw/zinc/54/45/63/455544563.db2.gz XTWNZOFQXXOLLZ-LPHOPBHVSA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000247017194 455544569 /nfs/dbraw/zinc/54/45/69/455544569.db2.gz XTWNZOFQXXOLLZ-LPHOPBHVSA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000247017194 455544572 /nfs/dbraw/zinc/54/45/72/455544572.db2.gz XTWNZOFQXXOLLZ-LPHOPBHVSA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000247017194 455544577 /nfs/dbraw/zinc/54/45/77/455544577.db2.gz XTWNZOFQXXOLLZ-LPHOPBHVSA-N 2 1 329.444 3.352 20 5 EGBDMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271553240 455682313 /nfs/dbraw/zinc/68/23/13/455682313.db2.gz VITCAPWANQBMSX-GDIGMMSISA-N 2 1 347.459 3.013 20 5 EGBDMP [NH3+]C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435380811 458127784 /nfs/dbraw/zinc/12/77/84/458127784.db2.gz SZSZTSFJFFZNPS-LLVKDONJSA-N 2 1 335.791 3.289 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000591582292 459407463 /nfs/dbraw/zinc/40/74/63/459407463.db2.gz FISUIONZBXVKDK-UKRRQHHQSA-N 2 1 333.432 3.319 20 5 EGBDMP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C1=CC[N@@H+](C)CC1 ZINC001208909969 1371940654 /nfs/dbraw/zinc/94/06/54/1371940654.db2.gz LAUDJBJPCZHMJU-UHFFFAOYSA-N 2 1 348.450 3.431 20 5 EGBDMP Cn1ccnc1C[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000131213242 162393917 /nfs/dbraw/zinc/39/39/17/162393917.db2.gz ZJONKRVTKCLRFB-CYBMUJFWSA-N 2 1 348.834 3.436 20 5 EGBDMP Cn1ccnc1C[C@H]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000131213242 162393919 /nfs/dbraw/zinc/39/39/19/162393919.db2.gz ZJONKRVTKCLRFB-CYBMUJFWSA-N 2 1 348.834 3.436 20 5 EGBDMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C[C@@H]12 ZINC000414670813 309094776 /nfs/dbraw/zinc/09/47/76/309094776.db2.gz NAVKNEBUQHJFKF-APHBMKBZSA-N 2 1 343.452 3.492 20 5 EGBDMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1C[NH3+] ZINC000415127357 309122403 /nfs/dbraw/zinc/12/24/03/309122403.db2.gz MULBDEBFZMPWEQ-UONOGXRCSA-N 2 1 329.400 3.272 20 5 EGBDMP Cn1ccnc1C[C@@H]1CCCN(Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000119576591 454205139 /nfs/dbraw/zinc/20/51/39/454205139.db2.gz UWBGKSTWQWVFAM-ZDUSSCGKSA-N 2 1 348.834 3.436 20 5 EGBDMP C[NH+](C)CCC1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000163420369 454846327 /nfs/dbraw/zinc/84/63/27/454846327.db2.gz MLEQLQGIINAQAC-UHFFFAOYSA-N 2 1 325.840 3.412 20 5 EGBDMP C[N@H+]1CC=C(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000271780033 455757020 /nfs/dbraw/zinc/75/70/20/455757020.db2.gz DHPTVOPQFGSFIC-UHFFFAOYSA-N 2 1 344.440 3.070 20 5 EGBDMP C[N@@H+]1CC=C(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000271780033 455757024 /nfs/dbraw/zinc/75/70/24/455757024.db2.gz DHPTVOPQFGSFIC-UHFFFAOYSA-N 2 1 344.440 3.070 20 5 EGBDMP CC[N@H+]1CC[C@@H]([NH+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000354209184 457131287 /nfs/dbraw/zinc/13/12/87/457131287.db2.gz QKMLURYKTZASKX-NVXWUHKLSA-N 2 1 335.448 3.168 20 5 EGBDMP CC[NH+]1CC[C@@H]([N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000354209184 457131292 /nfs/dbraw/zinc/13/12/92/457131292.db2.gz QKMLURYKTZASKX-NVXWUHKLSA-N 2 1 335.448 3.168 20 5 EGBDMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000354209184 457131296 /nfs/dbraw/zinc/13/12/96/457131296.db2.gz QKMLURYKTZASKX-NVXWUHKLSA-N 2 1 335.448 3.168 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)o1 ZINC000427138857 457949131 /nfs/dbraw/zinc/94/91/31/457949131.db2.gz ZNULIDBAUYLQBF-CZUORRHYSA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)o1 ZINC000427138857 457949134 /nfs/dbraw/zinc/94/91/34/457949134.db2.gz ZNULIDBAUYLQBF-CZUORRHYSA-N 2 1 327.384 3.039 20 5 EGBDMP C[C@@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435369948 458122699 /nfs/dbraw/zinc/12/26/99/458122699.db2.gz GVPLOVIVPVINJF-OLZOCXBDSA-N 2 1 331.441 3.492 20 5 EGBDMP C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCC[NH2+]CC1 ZINC000435435460 458145870 /nfs/dbraw/zinc/14/58/70/458145870.db2.gz BJNRRUDDNAMYOJ-OAHLLOKOSA-N 2 1 329.400 3.429 20 5 EGBDMP CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[C@@H]1[NH3+] ZINC000592427534 459598534 /nfs/dbraw/zinc/59/85/34/459598534.db2.gz AMIIYOQNZAZLEF-CJNGLKHVSA-N 2 1 329.400 3.414 20 5 EGBDMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000589197657 460051175 /nfs/dbraw/zinc/05/11/75/460051175.db2.gz KGSFGWJCZUMYQA-CQSZACIVSA-N 2 1 337.851 3.412 20 5 EGBDMP C[N@H+]1CCCC[C@@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000599070099 460150076 /nfs/dbraw/zinc/15/00/76/460150076.db2.gz KUODJMAQTKOPFQ-YJBOKZPZSA-N 2 1 331.460 3.237 20 5 EGBDMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000610818833 460241968 /nfs/dbraw/zinc/24/19/68/460241968.db2.gz GQQNVAAQIHRARV-YJBOKZPZSA-N 2 1 347.459 3.197 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000153585954 528594385 /nfs/dbraw/zinc/59/43/85/528594385.db2.gz NVAFWUCMSOVRLQ-UONOGXRCSA-N 2 1 346.431 3.485 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000153585839 528606975 /nfs/dbraw/zinc/60/69/75/528606975.db2.gz NVAFWUCMSOVRLQ-KGLIPLIRSA-N 2 1 346.431 3.485 20 5 EGBDMP C[NH+](C)C1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCCC1 ZINC000764655463 1302111337 /nfs/dbraw/zinc/11/13/37/1302111337.db2.gz WIFHJOSLOWVBMY-UHFFFAOYSA-N 2 1 346.475 3.028 20 5 EGBDMP C[NH+]1CCC2(CCC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000798956505 1310462891 /nfs/dbraw/zinc/46/28/91/1310462891.db2.gz AQXGKLPHOPWZLK-DAXSKMNVSA-N 2 1 329.444 3.416 20 5 EGBDMP COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859215999 1328949009 /nfs/dbraw/zinc/94/90/09/1328949009.db2.gz VVGJPUOAOZDSEH-UHFFFAOYSA-N 2 1 343.427 3.297 20 5 EGBDMP COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859215999 1328949011 /nfs/dbraw/zinc/94/90/11/1328949011.db2.gz VVGJPUOAOZDSEH-UHFFFAOYSA-N 2 1 343.427 3.297 20 5 EGBDMP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)cc1Cl ZINC000843127254 1321473991 /nfs/dbraw/zinc/47/39/91/1321473991.db2.gz PCPIFSKDNDETND-CABCVRRESA-N 2 1 337.851 3.460 20 5 EGBDMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000866262008 1330087035 /nfs/dbraw/zinc/08/70/35/1330087035.db2.gz ZBVHAYIFKNUXIZ-HUUCEWRRSA-N 2 1 337.439 3.375 20 5 EGBDMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC001319383660 1386094378 /nfs/dbraw/zinc/09/43/78/1386094378.db2.gz OTYVDCXDECWAGV-YJBOKZPZSA-N 2 1 331.460 3.237 20 5 EGBDMP Cc1[nH+]ccn1CCC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000268773808 252224111 /nfs/dbraw/zinc/22/41/11/252224111.db2.gz AMYUOQQMANKJNA-QGZVFWFLSA-N 2 1 328.416 3.101 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000349127709 156360895 /nfs/dbraw/zinc/36/08/95/156360895.db2.gz JCDQWLGCBSFXNX-INIZCTEOSA-N 2 1 347.459 3.157 20 5 EGBDMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000164593610 226084922 /nfs/dbraw/zinc/08/49/22/226084922.db2.gz UJCNMALGEGTYIZ-SFHVURJKSA-N 2 1 342.443 3.491 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3C[C@H](C[NH3+])C[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000414655978 309093813 /nfs/dbraw/zinc/09/38/13/309093813.db2.gz DYEXMJBACXTTFK-OLZOCXBDSA-N 2 1 345.399 3.033 20 5 EGBDMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C[NH3+] ZINC000415131422 309122670 /nfs/dbraw/zinc/12/26/70/309122670.db2.gz SFIYNDXOKAUVPS-UKRRQHHQSA-N 2 1 329.400 3.272 20 5 EGBDMP COc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000553877720 315286557 /nfs/dbraw/zinc/28/65/57/315286557.db2.gz QNZIDXBFEAJVOX-UHFFFAOYSA-N 2 1 347.459 3.490 20 5 EGBDMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090523380 454315712 /nfs/dbraw/zinc/31/57/12/454315712.db2.gz VITCAPWANQBMSX-JVPBZIDWSA-N 2 1 347.459 3.013 20 5 EGBDMP C[C@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000347070023 457214842 /nfs/dbraw/zinc/21/48/42/457214842.db2.gz PCKKGRIZNQAYCR-ZFWWWQNUSA-N 2 1 329.400 3.414 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000470179015 458621084 /nfs/dbraw/zinc/62/10/84/458621084.db2.gz RDYALZYMKDJVMY-FYXHJSOBSA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000470179015 458621090 /nfs/dbraw/zinc/62/10/90/458621090.db2.gz RDYALZYMKDJVMY-FYXHJSOBSA-N 2 1 329.444 3.416 20 5 EGBDMP O=[N+]([O-])c1ccc(CNC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1Cl ZINC000827948127 1292410096 /nfs/dbraw/zinc/41/00/96/1292410096.db2.gz GJQODHTXEBUCNO-HNNXBMFYSA-N 2 1 337.851 3.460 20 5 EGBDMP O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1Cl ZINC000827948127 1292410099 /nfs/dbraw/zinc/41/00/99/1292410099.db2.gz GJQODHTXEBUCNO-HNNXBMFYSA-N 2 1 337.851 3.460 20 5 EGBDMP O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1Cl ZINC000827948127 1292410104 /nfs/dbraw/zinc/41/01/04/1292410104.db2.gz GJQODHTXEBUCNO-HNNXBMFYSA-N 2 1 337.851 3.460 20 5 EGBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000872022699 1296666957 /nfs/dbraw/zinc/66/69/57/1296666957.db2.gz YPFGQZGCSLZPDH-QWHCGFSZSA-N 2 1 335.473 3.452 20 5 EGBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000872022699 1296666964 /nfs/dbraw/zinc/66/69/64/1296666964.db2.gz YPFGQZGCSLZPDH-QWHCGFSZSA-N 2 1 335.473 3.452 20 5 EGBDMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788509333 1305959009 /nfs/dbraw/zinc/95/90/09/1305959009.db2.gz XBPATACYNHTYDG-HNNXBMFYSA-N 2 1 342.443 3.350 20 5 EGBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000859214891 1328948446 /nfs/dbraw/zinc/94/84/46/1328948446.db2.gz QKRHEUPYEDUTQQ-UHFFFAOYSA-N 2 1 327.428 3.331 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126568 1321474062 /nfs/dbraw/zinc/47/40/62/1321474062.db2.gz KMXYZKSPUIXBKL-KGLIPLIRSA-N 2 1 337.851 3.460 20 5 EGBDMP COc1ccc(C[NH2+]C2CC[NH+](CCC(C)C)CC2)cc1[N+](=O)[O-] ZINC000924841498 1323184060 /nfs/dbraw/zinc/18/40/60/1323184060.db2.gz JTZGXHQSABACMT-UHFFFAOYSA-N 2 1 335.448 3.204 20 5 EGBDMP C[N@@H+](Cc1ccccc1)C1CC[NH+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169022542 1384092551 /nfs/dbraw/zinc/09/25/51/1384092551.db2.gz CSWAZHYFUUMAPA-IEBWSBKVSA-N 2 1 331.460 3.028 20 5 EGBDMP C[NH+](C)[C@H]1CCCC[C@@H]1[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901175 1384874156 /nfs/dbraw/zinc/87/41/56/1384874156.db2.gz KJBCWFXPMNENGT-WDSOQIARSA-N 2 1 331.460 3.305 20 5 EGBDMP C[NH+]1CCC2(CC[N@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C2)CC1 ZINC001172921768 1384879900 /nfs/dbraw/zinc/87/99/00/1384879900.db2.gz SLNQPXKWBIAFDA-GOSISDBHSA-N 2 1 343.471 3.260 20 5 EGBDMP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000179633029 233252287 /nfs/dbraw/zinc/25/22/87/233252287.db2.gz KJBFWXTWQKJSMM-CQSZACIVSA-N 2 1 329.400 3.238 20 5 EGBDMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000179633029 233252295 /nfs/dbraw/zinc/25/22/95/233252295.db2.gz KJBFWXTWQKJSMM-CQSZACIVSA-N 2 1 329.400 3.238 20 5 EGBDMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000122114428 152390692 /nfs/dbraw/zinc/39/06/92/152390692.db2.gz VZMVQBXKFCNJGY-UHFFFAOYSA-N 2 1 349.475 3.165 20 5 EGBDMP O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000192926062 153269261 /nfs/dbraw/zinc/26/92/61/153269261.db2.gz ALWXCKXOTZJGPX-GOSISDBHSA-N 2 1 325.412 3.207 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCc3[nH+]ccn3C1)CCC2 ZINC000279025976 275297023 /nfs/dbraw/zinc/29/70/23/275297023.db2.gz VLJOHRFVDUROMQ-DYVFJYSZSA-N 2 1 326.400 3.021 20 5 EGBDMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C[C@@H]12 ZINC000414669463 309094660 /nfs/dbraw/zinc/09/46/60/309094660.db2.gz KOASZKSHRQENJV-IAOVAPTHSA-N 2 1 343.452 3.492 20 5 EGBDMP COc1ccc(-c2ccc(C[NH2+]CCC[NH2+]C3CC3)o2)c([N+](=O)[O-])c1 ZINC000415064017 309117668 /nfs/dbraw/zinc/11/76/68/309117668.db2.gz BJGZGTLJNAXAQR-UHFFFAOYSA-N 2 1 345.399 3.095 20 5 EGBDMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C[NH3+] ZINC000415131420 309122703 /nfs/dbraw/zinc/12/27/03/309122703.db2.gz SFIYNDXOKAUVPS-HIFRSBDPSA-N 2 1 329.400 3.272 20 5 EGBDMP COCC[NH+]1CCC([NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417346304 309202506 /nfs/dbraw/zinc/20/25/06/309202506.db2.gz VSWGSWIUTHNZCC-LJQANCHMSA-N 2 1 347.459 3.063 20 5 EGBDMP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Cc2[nH+]ccn2C)CC1 ZINC000441319363 309867896 /nfs/dbraw/zinc/86/78/96/309867896.db2.gz UTDFKSTYIJPPEC-CQSZACIVSA-N 2 1 328.416 3.344 20 5 EGBDMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000247250429 455579241 /nfs/dbraw/zinc/57/92/41/455579241.db2.gz ZPWMWVNURYKUQA-CRAIPNDOSA-N 2 1 331.460 3.237 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@]4(CC[NH2+]C4)C3)o2)c1 ZINC000262063064 455992022 /nfs/dbraw/zinc/99/20/22/455992022.db2.gz RHGCZAPLUNRDAU-SFHVURJKSA-N 2 1 327.384 3.040 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@]4(CC[NH2+]C4)C3)o2)c1 ZINC000262063064 455992027 /nfs/dbraw/zinc/99/20/27/455992027.db2.gz RHGCZAPLUNRDAU-SFHVURJKSA-N 2 1 327.384 3.040 20 5 EGBDMP Cc1cc(NC[C@@H](C)[N@@H+](C)C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000301802068 456217945 /nfs/dbraw/zinc/21/79/45/456217945.db2.gz ADAACCDBEGYYSY-CYBMUJFWSA-N 2 1 341.415 3.255 20 5 EGBDMP C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2ccnc3ccc([N+](=O)[O-])cc32)C1 ZINC000601131939 460724260 /nfs/dbraw/zinc/72/42/60/460724260.db2.gz RVXXHXFZODSMIA-SUMWQHHRSA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@@H+]1CC[C@@H]2[C@@H](CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601131939 460724265 /nfs/dbraw/zinc/72/42/65/460724265.db2.gz RVXXHXFZODSMIA-SUMWQHHRSA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601131939 460724271 /nfs/dbraw/zinc/72/42/71/460724271.db2.gz RVXXHXFZODSMIA-SUMWQHHRSA-N 2 1 326.400 3.064 20 5 EGBDMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000354088022 457054611 /nfs/dbraw/zinc/05/46/11/457054611.db2.gz JOORFOWWPPZQPC-KOEDOTQGSA-N 2 1 347.459 3.041 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H]4[NH2+]CC[C@@H]4C3)o2)c1 ZINC000427132939 457947033 /nfs/dbraw/zinc/94/70/33/457947033.db2.gz IVBSJFBHQYDPNG-PBHICJAKSA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H]4[NH2+]CC[C@@H]4C3)o2)c1 ZINC000427132939 457947041 /nfs/dbraw/zinc/94/70/41/457947041.db2.gz IVBSJFBHQYDPNG-PBHICJAKSA-N 2 1 327.384 3.039 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+]3CC[C@H]([NH3+])[C@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000435375914 458126078 /nfs/dbraw/zinc/12/60/78/458126078.db2.gz OWGVZRHYBLQJBZ-WBMJQRKESA-N 2 1 345.399 3.033 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@H]([NH3+])[C@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000435375914 458126087 /nfs/dbraw/zinc/12/60/87/458126087.db2.gz OWGVZRHYBLQJBZ-WBMJQRKESA-N 2 1 345.399 3.033 20 5 EGBDMP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000430133384 458408113 /nfs/dbraw/zinc/40/81/13/458408113.db2.gz NOJYKFMBUNXOTH-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000430133384 458408117 /nfs/dbraw/zinc/40/81/17/458408117.db2.gz NOJYKFMBUNXOTH-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000430133384 458408122 /nfs/dbraw/zinc/40/81/22/458408122.db2.gz NOJYKFMBUNXOTH-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000430133384 458408125 /nfs/dbraw/zinc/40/81/25/458408125.db2.gz NOJYKFMBUNXOTH-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000470170700 458621833 /nfs/dbraw/zinc/62/18/33/458621833.db2.gz ZFIGHXAIUJNREK-YBCWHDTPSA-N 2 1 329.444 3.414 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000470170700 458621836 /nfs/dbraw/zinc/62/18/36/458621836.db2.gz ZFIGHXAIUJNREK-YBCWHDTPSA-N 2 1 329.444 3.414 20 5 EGBDMP CN1CC[C@@H]2CC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@H]2C1 ZINC000495087709 458796469 /nfs/dbraw/zinc/79/64/69/458796469.db2.gz KXWMKZNMUWQWEB-KDOFPFPSSA-N 2 1 341.411 3.381 20 5 EGBDMP CN1CC[C@@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@H]2C1 ZINC000495087709 458796476 /nfs/dbraw/zinc/79/64/76/458796476.db2.gz KXWMKZNMUWQWEB-KDOFPFPSSA-N 2 1 341.411 3.381 20 5 EGBDMP [NH3+]CC[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000442928091 459061249 /nfs/dbraw/zinc/06/12/49/459061249.db2.gz PIHYLUJAMSITBP-CQSZACIVSA-N 2 1 329.400 3.416 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000595900352 459481216 /nfs/dbraw/zinc/48/12/16/459481216.db2.gz CYVUYKNKNAABHA-AWEZNQCLSA-N 2 1 337.851 3.460 20 5 EGBDMP CC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[C@@H]1[NH3+] ZINC000592427533 459598186 /nfs/dbraw/zinc/59/81/86/459598186.db2.gz AMIIYOQNZAZLEF-BBRMVZONSA-N 2 1 329.400 3.414 20 5 EGBDMP CC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[C@H]1[NH3+] ZINC000592427536 459598933 /nfs/dbraw/zinc/59/89/33/459598933.db2.gz AMIIYOQNZAZLEF-XJKSGUPXSA-N 2 1 329.400 3.414 20 5 EGBDMP C[N@@H+](Cc1cccc([N+](=O)[O-])c1Br)C1CCC([NH3+])CC1 ZINC000234322015 1296180772 /nfs/dbraw/zinc/18/07/72/1296180772.db2.gz GZPKICLGTAWHTG-UHFFFAOYSA-N 2 1 342.237 3.059 20 5 EGBDMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866272024 1330088608 /nfs/dbraw/zinc/08/86/08/1330088608.db2.gz IKFGOZFCPKJPII-CYBMUJFWSA-N 2 1 334.395 3.240 20 5 EGBDMP C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169001495 1384083781 /nfs/dbraw/zinc/08/37/81/1384083781.db2.gz GMBHNRGNBDADFH-BTHPGYMESA-N 2 1 345.487 3.180 20 5 EGBDMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000274362495 267224625 /nfs/dbraw/zinc/22/46/25/267224625.db2.gz NVGSZGFTPFRRKH-SJLPKXTDSA-N 2 1 342.443 3.491 20 5 EGBDMP C[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000279616039 275344198 /nfs/dbraw/zinc/34/41/98/275344198.db2.gz XTVOJSBKMPCBPV-ZWNOBZJWSA-N 2 1 331.338 3.186 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1C ZINC000279616039 275344200 /nfs/dbraw/zinc/34/42/00/275344200.db2.gz XTVOJSBKMPCBPV-ZWNOBZJWSA-N 2 1 331.338 3.186 20 5 EGBDMP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000414982670 309112790 /nfs/dbraw/zinc/11/27/90/309112790.db2.gz YUWBGJJMWKNDGS-QGZVFWFLSA-N 2 1 329.400 3.333 20 5 EGBDMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1C[NH3+] ZINC000415127355 309122293 /nfs/dbraw/zinc/12/22/93/309122293.db2.gz MULBDEBFZMPWEQ-KGLIPLIRSA-N 2 1 329.400 3.272 20 5 EGBDMP CC[NH+](CC)CCO[C@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490030518 311130444 /nfs/dbraw/zinc/13/04/44/311130444.db2.gz LVRNYVNYTPLMKS-WMZOPIPTSA-N 2 1 349.475 3.397 20 5 EGBDMP COc1ccc(-c2ccc(C[NH2+]C[C@@H](C)C[NH+](C)C)o2)c([N+](=O)[O-])c1 ZINC000491548733 311184179 /nfs/dbraw/zinc/18/41/79/311184179.db2.gz SSXCRAOPDQXWMJ-CYBMUJFWSA-N 2 1 347.415 3.151 20 5 EGBDMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000354088021 457053938 /nfs/dbraw/zinc/05/39/38/457053938.db2.gz JOORFOWWPPZQPC-CNRGFGOASA-N 2 1 347.459 3.041 20 5 EGBDMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000354088023 457054695 /nfs/dbraw/zinc/05/46/95/457054695.db2.gz JOORFOWWPPZQPC-PDFOZTTASA-N 2 1 347.459 3.041 20 5 EGBDMP CC(C)[C@@H]([NH3+])CC[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157913087 1294191188 /nfs/dbraw/zinc/19/11/88/1294191188.db2.gz CEQDPUFBVCABSP-ZDUSSCGKSA-N 2 1 344.253 3.163 20 5 EGBDMP CC(C)[C@@H]([NH3+])CC[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157913087 1294191193 /nfs/dbraw/zinc/19/11/93/1294191193.db2.gz CEQDPUFBVCABSP-ZDUSSCGKSA-N 2 1 344.253 3.163 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)o1 ZINC000261944097 1296609253 /nfs/dbraw/zinc/60/92/53/1296609253.db2.gz FAKKCIUJCIHZAH-UHFFFAOYSA-N 2 1 341.411 3.430 20 5 EGBDMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cccc1[N+](=O)[O-] ZINC000765976378 1302361580 /nfs/dbraw/zinc/36/15/80/1302361580.db2.gz OEOOBJLBKNFFNS-NVXWUHKLSA-N 2 1 347.459 3.197 20 5 EGBDMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815559755 1319016723 /nfs/dbraw/zinc/01/67/23/1319016723.db2.gz PFVOASKBXZMGHK-LSDHHAIUSA-N 2 1 334.464 3.482 20 5 EGBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000859214656 1328947611 /nfs/dbraw/zinc/94/76/11/1328947611.db2.gz QMTWYOJNPXNQTG-UHFFFAOYSA-N 2 1 343.427 3.167 20 5 EGBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001173215311 1384937665 /nfs/dbraw/zinc/93/76/65/1384937665.db2.gz UTEFHMVKJMFHNW-BBWFWOEESA-N 2 1 333.476 3.483 20 5 EGBDMP CC[C@@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000159176514 529681765 /nfs/dbraw/zinc/68/17/65/529681765.db2.gz GVXBASIMZWUNQV-GOSISDBHSA-N 2 1 335.448 3.136 20 5 EGBDMP C[N@H+](Cc1csc([N+](=O)[O-])c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000354894980 166058411 /nfs/dbraw/zinc/05/84/11/166058411.db2.gz JMHJOCHNJJVLNI-UHFFFAOYSA-N 2 1 346.456 3.400 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000414195399 309066233 /nfs/dbraw/zinc/06/62/33/309066233.db2.gz UUSOJPOZHOJYRC-CABCVRRESA-N 2 1 335.448 3.376 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+]3CC[C@H]([NH3+])C[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000571578020 317218724 /nfs/dbraw/zinc/21/87/24/317218724.db2.gz DCXXQXDGAUPFJW-STQMWFEESA-N 2 1 345.399 3.175 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@H]([NH3+])C[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000571578020 317218725 /nfs/dbraw/zinc/21/87/25/317218725.db2.gz DCXXQXDGAUPFJW-STQMWFEESA-N 2 1 345.399 3.175 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000153037951 454755186 /nfs/dbraw/zinc/75/51/86/454755186.db2.gz DFNVFSLILITDQQ-GJZGRUSLSA-N 2 1 335.448 3.376 20 5 EGBDMP Cc1c(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000247017215 455545052 /nfs/dbraw/zinc/54/50/52/455545052.db2.gz XTWNZOFQXXOLLZ-QFBILLFUSA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000247017215 455545053 /nfs/dbraw/zinc/54/50/53/455545053.db2.gz XTWNZOFQXXOLLZ-QFBILLFUSA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000247017215 455545056 /nfs/dbraw/zinc/54/50/56/455545056.db2.gz XTWNZOFQXXOLLZ-QFBILLFUSA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000247017215 455545058 /nfs/dbraw/zinc/54/50/58/455545058.db2.gz XTWNZOFQXXOLLZ-QFBILLFUSA-N 2 1 329.444 3.352 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H]4[NH2+]CC[C@H]4C3)o2)c1 ZINC000427132942 457946168 /nfs/dbraw/zinc/94/61/68/457946168.db2.gz IVBSJFBHQYDPNG-YOEHRIQHSA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H]4[NH2+]CC[C@H]4C3)o2)c1 ZINC000427132942 457946172 /nfs/dbraw/zinc/94/61/72/457946172.db2.gz IVBSJFBHQYDPNG-YOEHRIQHSA-N 2 1 327.384 3.039 20 5 EGBDMP C[C@@H]1C[N@H+](CCCC[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])C[C@H](C)O1 ZINC000578643111 459235632 /nfs/dbraw/zinc/23/56/32/459235632.db2.gz NOVNTGLJEJMDBG-DAYGRLMNSA-N 2 1 347.459 3.061 20 5 EGBDMP C[C@@H]1C[N@H+](CCCC[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])C[C@H](C)O1 ZINC000578643114 459236432 /nfs/dbraw/zinc/23/64/32/459236432.db2.gz NOVNTGLJEJMDBG-RVKKMQEKSA-N 2 1 347.459 3.061 20 5 EGBDMP O=[N+]([O-])c1cccc([C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2ccccc2)c1 ZINC000591578268 459406139 /nfs/dbraw/zinc/40/61/39/459406139.db2.gz JCGZNGJXYMQISE-MJGOQNOKSA-N 2 1 325.412 3.416 20 5 EGBDMP O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592433711 459599437 /nfs/dbraw/zinc/59/94/37/459599437.db2.gz PPLXAVZENZHAKO-LQIFBCGMSA-N 2 1 329.444 3.320 20 5 EGBDMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602514611 459978514 /nfs/dbraw/zinc/97/85/14/459978514.db2.gz OJAFPWWWBUFSAK-AWEZNQCLSA-N 2 1 346.431 3.338 20 5 EGBDMP O=[N+]([O-])c1cccc(C[N@@H+](Cc2cc3c(s2)CC[NH2+]C3)C2CC2)c1 ZINC000873202821 1297348219 /nfs/dbraw/zinc/34/82/19/1297348219.db2.gz FJOASDGNCWXTOH-UHFFFAOYSA-N 2 1 343.452 3.467 20 5 EGBDMP Cc1[nH]c(C2CC[NH+](CCOc3cccc([N+](=O)[O-])c3)CC2)[nH+]c1C ZINC000886667539 1303547770 /nfs/dbraw/zinc/54/77/70/1303547770.db2.gz CIFDCSVSKQGYSX-UHFFFAOYSA-N 2 1 344.415 3.193 20 5 EGBDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000788673900 1305994327 /nfs/dbraw/zinc/99/43/27/1305994327.db2.gz YVVKTFPLDFVWMG-GJZGRUSLSA-N 2 1 334.464 3.196 20 5 EGBDMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)CC1 ZINC000809756020 1317891189 /nfs/dbraw/zinc/89/11/89/1317891189.db2.gz ODEHVIWRDIYWCW-CQSZACIVSA-N 2 1 337.851 3.412 20 5 EGBDMP C[NH+]1CCC2(CCCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000865754513 1329735139 /nfs/dbraw/zinc/73/51/39/1329735139.db2.gz VQRRVJNZWYRSOS-UHFFFAOYSA-N 2 1 340.427 3.455 20 5 EGBDMP C[C@H]1CCCC[N@@H+]1CCCNc1ccc([N+](=O)[O-])c2c1CC[NH+](C)C2 ZINC001167754900 1383732526 /nfs/dbraw/zinc/73/25/26/1383732526.db2.gz XHNLRRIZIKZUFG-HNNXBMFYSA-N 2 1 346.475 3.259 20 5 EGBDMP C[C@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c2c1CC[NH+](C)C2 ZINC001167754900 1383732527 /nfs/dbraw/zinc/73/25/27/1383732527.db2.gz XHNLRRIZIKZUFG-HNNXBMFYSA-N 2 1 346.475 3.259 20 5 EGBDMP C[C@H]1CCCC[NH+]1CCCNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2 ZINC001167754900 1383732531 /nfs/dbraw/zinc/73/25/31/1383732531.db2.gz XHNLRRIZIKZUFG-HNNXBMFYSA-N 2 1 346.475 3.259 20 5 EGBDMP C[C@H]1CCCC[NH+]1CCCNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2 ZINC001167754900 1383732533 /nfs/dbraw/zinc/73/25/33/1383732533.db2.gz XHNLRRIZIKZUFG-HNNXBMFYSA-N 2 1 346.475 3.259 20 5 EGBDMP O=[N+]([O-])C[C@H]1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001168982913 1384078654 /nfs/dbraw/zinc/07/86/54/1384078654.db2.gz JEWSWXIUMXEFRN-VYJAJWGXSA-N 2 1 343.471 3.217 20 5 EGBDMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@@H]12 ZINC000346845147 156161220 /nfs/dbraw/zinc/16/12/20/156161220.db2.gz ZLQZBEVICKRMNS-DAXOMENPSA-N 2 1 327.384 3.024 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](c2nccn2C)C1 ZINC000349155595 156370279 /nfs/dbraw/zinc/37/02/79/156370279.db2.gz WBVXVLYRAKDHSO-DKGMDFAASA-N 2 1 326.400 3.221 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000372449963 157333362 /nfs/dbraw/zinc/33/33/62/157333362.db2.gz OBAYXWJYPLNRFM-BPUTZDHNSA-N 2 1 333.432 3.271 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000372449963 157333366 /nfs/dbraw/zinc/33/33/66/157333366.db2.gz OBAYXWJYPLNRFM-BPUTZDHNSA-N 2 1 333.432 3.271 20 5 EGBDMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000414172164 309064571 /nfs/dbraw/zinc/06/45/71/309064571.db2.gz FBMYVLHMTSTYBA-YJBOKZPZSA-N 2 1 331.460 3.237 20 5 EGBDMP C[C@]1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC[NH2+]C1 ZINC000414915247 309109035 /nfs/dbraw/zinc/10/90/35/309109035.db2.gz ZLIXRUUWSYIBFW-SFHVURJKSA-N 2 1 329.400 3.334 20 5 EGBDMP C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C[NH3+] ZINC000415126977 309122411 /nfs/dbraw/zinc/12/24/11/309122411.db2.gz MREUZMYRPOFKOS-DZGCQCFKSA-N 2 1 329.400 3.272 20 5 EGBDMP C[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185723492 455606744 /nfs/dbraw/zinc/60/67/44/455606744.db2.gz UPZFKNOMHIPFLB-CVEARBPZSA-N 2 1 347.459 3.216 20 5 EGBDMP C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000283278386 456750565 /nfs/dbraw/zinc/75/05/65/456750565.db2.gz WZQAONPYUPQOFK-ZFWWWQNUSA-N 2 1 335.423 3.477 20 5 EGBDMP C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000283278386 456750569 /nfs/dbraw/zinc/75/05/69/456750569.db2.gz WZQAONPYUPQOFK-ZFWWWQNUSA-N 2 1 335.423 3.477 20 5 EGBDMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000347049096 457203192 /nfs/dbraw/zinc/20/31/92/457203192.db2.gz PZDPVAWNIPHKMH-AWEZNQCLSA-N 2 1 329.400 3.286 20 5 EGBDMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000347049096 457203197 /nfs/dbraw/zinc/20/31/97/457203197.db2.gz PZDPVAWNIPHKMH-AWEZNQCLSA-N 2 1 329.400 3.286 20 5 EGBDMP C[C@@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000347145793 457255804 /nfs/dbraw/zinc/25/58/04/457255804.db2.gz YGWDPDKCOYPJQZ-UKRRQHHQSA-N 2 1 329.400 3.414 20 5 EGBDMP CC(C)[C@@H]([NH3+])CC[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000430572307 458463441 /nfs/dbraw/zinc/46/34/41/458463441.db2.gz FJWPZGBHOMEBNY-INIZCTEOSA-N 2 1 346.431 3.098 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@H]4C[NH2+]C[C@H]4C3)o2)c(Cl)c1 ZINC000479965334 459175171 /nfs/dbraw/zinc/17/51/71/459175171.db2.gz PKVUXWYJZONPIQ-TXEJJXNPSA-N 2 1 347.802 3.159 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@H]4C[NH2+]C[C@H]4C3)o2)c(Cl)c1 ZINC000479965334 459175176 /nfs/dbraw/zinc/17/51/76/459175176.db2.gz PKVUXWYJZONPIQ-TXEJJXNPSA-N 2 1 347.802 3.159 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000153586062 528607301 /nfs/dbraw/zinc/60/73/01/528607301.db2.gz NVAFWUCMSOVRLQ-KBPBESRZSA-N 2 1 346.431 3.485 20 5 EGBDMP O=[N+]([O-])c1ccc(CNC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1Cl ZINC000827948129 1292410418 /nfs/dbraw/zinc/41/04/18/1292410418.db2.gz GJQODHTXEBUCNO-OAHLLOKOSA-N 2 1 337.851 3.460 20 5 EGBDMP O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1Cl ZINC000827948129 1292410421 /nfs/dbraw/zinc/41/04/21/1292410421.db2.gz GJQODHTXEBUCNO-OAHLLOKOSA-N 2 1 337.851 3.460 20 5 EGBDMP O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cc1Cl ZINC000827948129 1292410426 /nfs/dbraw/zinc/41/04/26/1292410426.db2.gz GJQODHTXEBUCNO-OAHLLOKOSA-N 2 1 337.851 3.460 20 5 EGBDMP c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CC[C@H](N2CC[NH2+]CC2)C1 ZINC000843123242 1321473003 /nfs/dbraw/zinc/47/30/03/1321473003.db2.gz PQAOLTJEDAQLSQ-FQEVSTJZSA-N 2 1 345.490 3.473 20 5 EGBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866259075 1330086755 /nfs/dbraw/zinc/08/67/55/1330086755.db2.gz GMVJZWNTUJTLNC-OLZOCXBDSA-N 2 1 334.395 3.096 20 5 EGBDMP O=[N+]([O-])c1ccc2[nH+]ccc(NC3CCN(c4cc[nH+]cc4)CC3)c2c1 ZINC001348594678 1391242942 /nfs/dbraw/zinc/24/29/42/1391242942.db2.gz CYODSZMLRMOSMF-UHFFFAOYSA-N 2 1 349.394 3.041 20 5 EGBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178696317 232386900 /nfs/dbraw/zinc/38/69/00/232386900.db2.gz SFXUOVJFCZTSGK-RDTXWAMCSA-N 2 1 342.443 3.347 20 5 EGBDMP CC[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278724650 275269078 /nfs/dbraw/zinc/26/90/78/275269078.db2.gz WCDMBXZNXWSENM-YJBOKZPZSA-N 2 1 335.448 3.136 20 5 EGBDMP CC[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278724650 275269080 /nfs/dbraw/zinc/26/90/80/275269080.db2.gz WCDMBXZNXWSENM-YJBOKZPZSA-N 2 1 335.448 3.136 20 5 EGBDMP C[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000279616036 275344145 /nfs/dbraw/zinc/34/41/45/275344145.db2.gz XTVOJSBKMPCBPV-GWCFXTLKSA-N 2 1 331.338 3.186 20 5 EGBDMP C[C@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1C ZINC000279616036 275344147 /nfs/dbraw/zinc/34/41/47/275344147.db2.gz XTVOJSBKMPCBPV-GWCFXTLKSA-N 2 1 331.338 3.186 20 5 EGBDMP Cc1cc(NCCCC[N@H+](C)C2CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000413350405 309028223 /nfs/dbraw/zinc/02/82/23/309028223.db2.gz WIOPNEINFHMJGK-UHFFFAOYSA-N 2 1 328.416 3.160 20 5 EGBDMP COCC[NH+]1CCC([NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417346301 309202491 /nfs/dbraw/zinc/20/24/91/309202491.db2.gz VSWGSWIUTHNZCC-IBGZPJMESA-N 2 1 347.459 3.063 20 5 EGBDMP Cc1cc(N2CC[N@@H+](C)[C@@H](C(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000487073184 311009482 /nfs/dbraw/zinc/00/94/82/311009482.db2.gz PCPPULWFWYHGQV-GOSISDBHSA-N 2 1 328.416 3.228 20 5 EGBDMP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000125498613 454826800 /nfs/dbraw/zinc/82/68/00/454826800.db2.gz OSFKCGHQVJEGCZ-CQSZACIVSA-N 2 1 329.400 3.238 20 5 EGBDMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000125498613 454826805 /nfs/dbraw/zinc/82/68/05/454826805.db2.gz OSFKCGHQVJEGCZ-CQSZACIVSA-N 2 1 329.400 3.238 20 5 EGBDMP CCC[C@H]([NH2+]CCCC[N@H+]1CCC[C@H]1CO)c1cccc([N+](=O)[O-])c1 ZINC000268844444 455715522 /nfs/dbraw/zinc/71/55/22/455715522.db2.gz BJMHNYLQBLEGOM-OALUTQOASA-N 2 1 349.475 3.263 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000249459034 455756395 /nfs/dbraw/zinc/75/63/95/455756395.db2.gz QFSXZIROJOVLEI-MAUKXSAKSA-N 2 1 349.475 3.130 20 5 EGBDMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000249459034 455756399 /nfs/dbraw/zinc/75/63/99/455756399.db2.gz QFSXZIROJOVLEI-MAUKXSAKSA-N 2 1 349.475 3.130 20 5 EGBDMP C[NH+]1CCC([C@@H]2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000601134902 460725161 /nfs/dbraw/zinc/72/51/61/460725161.db2.gz JISDIJAJTONJTO-OAHLLOKOSA-N 2 1 340.427 3.311 20 5 EGBDMP CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCC[N@@H+](C)C1 ZINC000339004551 456895716 /nfs/dbraw/zinc/89/57/16/456895716.db2.gz FRNQSMYUDVCSRL-GFCCVEGCSA-N 2 1 345.365 3.387 20 5 EGBDMP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c(Cl)c1 ZINC000592433667 459599509 /nfs/dbraw/zinc/59/95/09/459599509.db2.gz OOAILWWNNBQFCW-KGLIPLIRSA-N 2 1 337.851 3.460 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000599070620 460150405 /nfs/dbraw/zinc/15/04/05/460150405.db2.gz MBEIKPSISYKULF-CABCVRRESA-N 2 1 335.448 3.376 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000599070620 460150412 /nfs/dbraw/zinc/15/04/12/460150412.db2.gz MBEIKPSISYKULF-CABCVRRESA-N 2 1 335.448 3.376 20 5 EGBDMP CC(C)[C@H]([NH3+])CC[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157912940 1294191115 /nfs/dbraw/zinc/19/11/15/1294191115.db2.gz CEQDPUFBVCABSP-CYBMUJFWSA-N 2 1 344.253 3.163 20 5 EGBDMP CC(C)[C@H]([NH3+])CC[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157912940 1294191118 /nfs/dbraw/zinc/19/11/18/1294191118.db2.gz CEQDPUFBVCABSP-CYBMUJFWSA-N 2 1 344.253 3.163 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168999447 1384082636 /nfs/dbraw/zinc/08/26/36/1384082636.db2.gz TZIGSGGGULBMOM-NCXUSEDFSA-N 2 1 331.460 3.204 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168997732 1384082876 /nfs/dbraw/zinc/08/28/76/1384082876.db2.gz FGAOFLODUARSPD-NXWXRZEISA-N 2 1 349.450 3.343 20 5 EGBDMP COc1ccc(C[C@@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c([N+](=O)[O-])c1 ZINC001170305548 1384287159 /nfs/dbraw/zinc/28/71/59/1384287159.db2.gz MZDPOUMGLHRHJA-MXASKKJJSA-N 2 1 347.459 3.139 20 5 EGBDMP COc1ccc(C[C@@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1 ZINC001170305548 1384287162 /nfs/dbraw/zinc/28/71/62/1384287162.db2.gz MZDPOUMGLHRHJA-MXASKKJJSA-N 2 1 347.459 3.139 20 5 EGBDMP CC[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000133054745 529584800 /nfs/dbraw/zinc/58/48/00/529584800.db2.gz QJJTZOSCXIUCHU-KXBFYZLASA-N 2 1 347.459 3.136 20 5 EGBDMP O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000192920355 153266606 /nfs/dbraw/zinc/26/66/06/153266606.db2.gz FOZBDSFRPGXFKK-KRWDZBQOSA-N 2 1 325.412 3.207 20 5 EGBDMP O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192920355 153266621 /nfs/dbraw/zinc/26/66/21/153266621.db2.gz FOZBDSFRPGXFKK-KRWDZBQOSA-N 2 1 325.412 3.207 20 5 EGBDMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@@H]21 ZINC000346822087 156152354 /nfs/dbraw/zinc/15/23/54/156152354.db2.gz FDUPIZSKTFGOKH-RRQGHBQHSA-N 2 1 341.411 3.414 20 5 EGBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C[NH3+])CC(C)C ZINC000423257849 309392628 /nfs/dbraw/zinc/39/26/28/309392628.db2.gz AIPQDTPDFDRUKU-KGLIPLIRSA-N 2 1 325.478 3.429 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]4C[NH2+]C[C@H]4C3)s2)cc1 ZINC000579719032 325150783 /nfs/dbraw/zinc/15/07/83/325150783.db2.gz RGVOJRUPEQIOPY-GJZGRUSLSA-N 2 1 343.452 3.365 20 5 EGBDMP C[N@H+](CC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CCCC1 ZINC000133203134 454400684 /nfs/dbraw/zinc/40/06/84/454400684.db2.gz VREDFGXBPMFRIJ-SFHVURJKSA-N 2 1 331.460 3.380 20 5 EGBDMP C[N@@H+](CC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CCCC1 ZINC000133203134 454400687 /nfs/dbraw/zinc/40/06/87/454400687.db2.gz VREDFGXBPMFRIJ-SFHVURJKSA-N 2 1 331.460 3.380 20 5 EGBDMP [NH3+]C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435380812 458128163 /nfs/dbraw/zinc/12/81/63/458128163.db2.gz SZSZTSFJFFZNPS-NSHDSACASA-N 2 1 335.791 3.289 20 5 EGBDMP CC(C)c1ccc(C[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000432349829 458722158 /nfs/dbraw/zinc/72/21/58/458722158.db2.gz YEKCVKYIDWFQCK-INIZCTEOSA-N 2 1 349.475 3.309 20 5 EGBDMP CC(C)c1ccc(C[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000432349829 458722163 /nfs/dbraw/zinc/72/21/63/458722163.db2.gz YEKCVKYIDWFQCK-INIZCTEOSA-N 2 1 349.475 3.309 20 5 EGBDMP [NH3+]CC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000442930085 459062754 /nfs/dbraw/zinc/06/27/54/459062754.db2.gz SODIHQVLFHMSEX-CQSZACIVSA-N 2 1 329.400 3.416 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cc1[N+](=O)[O-] ZINC000593323632 459842586 /nfs/dbraw/zinc/84/25/86/459842586.db2.gz RNYHVYLWIAINQW-LBPRGKRZSA-N 2 1 347.390 3.442 20 5 EGBDMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610448143 460153374 /nfs/dbraw/zinc/15/33/74/460153374.db2.gz BLJNWIGOGWSJSD-KRWDZBQOSA-N 2 1 347.459 3.027 20 5 EGBDMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610448143 460153383 /nfs/dbraw/zinc/15/33/83/460153383.db2.gz BLJNWIGOGWSJSD-KRWDZBQOSA-N 2 1 347.459 3.027 20 5 EGBDMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610448143 460153390 /nfs/dbraw/zinc/15/33/90/460153390.db2.gz BLJNWIGOGWSJSD-KRWDZBQOSA-N 2 1 347.459 3.027 20 5 EGBDMP [NH3+]CC[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000904406746 1317844168 /nfs/dbraw/zinc/84/41/68/1317844168.db2.gz ZHQCOADKOXTHJN-ZDUSSCGKSA-N 2 1 331.441 3.494 20 5 EGBDMP CCC[N@H+](CC)C[C@@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000810260442 1317988837 /nfs/dbraw/zinc/98/88/37/1317988837.db2.gz CMHGPAJPLAXTJQ-MRXNPFEDSA-N 2 1 348.491 3.274 20 5 EGBDMP CCC[N@@H+](CC)C[C@@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000810260442 1317988847 /nfs/dbraw/zinc/98/88/47/1317988847.db2.gz CMHGPAJPLAXTJQ-MRXNPFEDSA-N 2 1 348.491 3.274 20 5 EGBDMP C[C@@H](C[N+](C)(C)C)Oc1ccc2c(n1)C[N@@H+](Cc1ccccc1)CC2 ZINC001229056263 1375752109 /nfs/dbraw/zinc/75/21/09/1375752109.db2.gz LNONREIMJSZDCO-KRWDZBQOSA-N 2 1 340.491 3.113 20 5 EGBDMP C[C@@H](C[N+](C)(C)C)Oc1ccc2c(n1)C[N@H+](Cc1ccccc1)CC2 ZINC001229056263 1375752113 /nfs/dbraw/zinc/75/21/13/1375752113.db2.gz LNONREIMJSZDCO-KRWDZBQOSA-N 2 1 340.491 3.113 20 5 EGBDMP COc1ccc(C[C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC001170307595 1384286875 /nfs/dbraw/zinc/28/68/75/1384286875.db2.gz HWVSWCMQCWLLRE-JKSUJKDBSA-N 2 1 349.475 3.389 20 5 EGBDMP COc1ccc(C[C@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c([N+](=O)[O-])c1 ZINC001170305547 1384287343 /nfs/dbraw/zinc/28/73/43/1384287343.db2.gz MZDPOUMGLHRHJA-LLLHUVSDSA-N 2 1 347.459 3.139 20 5 EGBDMP COc1ccc(C[C@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1 ZINC001170305547 1384287346 /nfs/dbraw/zinc/28/73/46/1384287346.db2.gz MZDPOUMGLHRHJA-LLLHUVSDSA-N 2 1 347.459 3.139 20 5 EGBDMP CCC[N@@H+]1C[C@@H]2C[NH+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]2C1 ZINC001172913271 1384876686 /nfs/dbraw/zinc/87/66/86/1384876686.db2.gz QKSWKCNEMSPSIE-OTWHNJEPSA-N 2 1 343.471 3.116 20 5 EGBDMP CCC[NH+]1C[C@@H]2C[N@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]2C1 ZINC001172913271 1384876687 /nfs/dbraw/zinc/87/66/87/1384876687.db2.gz QKSWKCNEMSPSIE-OTWHNJEPSA-N 2 1 343.471 3.116 20 5 EGBDMP CCC[NH+]1C[C@@H]2C[N@@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]2C1 ZINC001172913271 1384876691 /nfs/dbraw/zinc/87/66/91/1384876691.db2.gz QKSWKCNEMSPSIE-OTWHNJEPSA-N 2 1 343.471 3.116 20 5 EGBDMP CC[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278724644 275269164 /nfs/dbraw/zinc/26/91/64/275269164.db2.gz WCDMBXZNXWSENM-MAUKXSAKSA-N 2 1 335.448 3.136 20 5 EGBDMP CC[C@@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278724644 275269165 /nfs/dbraw/zinc/26/91/65/275269165.db2.gz WCDMBXZNXWSENM-MAUKXSAKSA-N 2 1 335.448 3.136 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCc3[nH+]ccn3C2)cc1[N+](=O)[O-] ZINC000278934851 275289086 /nfs/dbraw/zinc/28/90/86/275289086.db2.gz JMUMTAHKOBLJQJ-UONOGXRCSA-N 2 1 344.415 3.103 20 5 EGBDMP C[NH2+]CCC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000414862664 309106072 /nfs/dbraw/zinc/10/60/72/309106072.db2.gz WBRZFVZSNKONAX-UHFFFAOYSA-N 2 1 328.416 3.062 20 5 EGBDMP COc1ccc(-c2ccc(C[NH2+]C[C@H](C)C[NH+](C)C)o2)c([N+](=O)[O-])c1 ZINC000491548734 311184146 /nfs/dbraw/zinc/18/41/46/311184146.db2.gz SSXCRAOPDQXWMJ-ZDUSSCGKSA-N 2 1 347.415 3.151 20 5 EGBDMP Cc1cc(N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302106445 456289337 /nfs/dbraw/zinc/28/93/37/456289337.db2.gz XUGUDIHNBQUNBJ-KSSFIOAISA-N 2 1 340.427 3.372 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000277112166 456685289 /nfs/dbraw/zinc/68/52/89/456685289.db2.gz PVKKEPLCQOTMRG-UHFFFAOYSA-N 2 1 346.431 3.145 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000277112166 456685295 /nfs/dbraw/zinc/68/52/95/456685295.db2.gz PVKKEPLCQOTMRG-UHFFFAOYSA-N 2 1 346.431 3.145 20 5 EGBDMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000347006417 457196674 /nfs/dbraw/zinc/19/66/74/457196674.db2.gz QDTPCFKJUFDPEO-AWEZNQCLSA-N 2 1 329.400 3.286 20 5 EGBDMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000347006417 457196681 /nfs/dbraw/zinc/19/66/81/457196681.db2.gz QDTPCFKJUFDPEO-AWEZNQCLSA-N 2 1 329.400 3.286 20 5 EGBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000534328442 459315501 /nfs/dbraw/zinc/31/55/01/459315501.db2.gz IRZURNGJVHOWGA-HUUCEWRRSA-N 2 1 337.489 3.397 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000591582290 459407447 /nfs/dbraw/zinc/40/74/47/459407447.db2.gz FISUIONZBXVKDK-DZGCQCFKSA-N 2 1 333.432 3.319 20 5 EGBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000887133351 1303686605 /nfs/dbraw/zinc/68/66/05/1303686605.db2.gz ZGWAFUOUKVSTTM-LSDHHAIUSA-N 2 1 326.400 3.262 20 5 EGBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000887133351 1303686613 /nfs/dbraw/zinc/68/66/13/1303686613.db2.gz ZGWAFUOUKVSTTM-LSDHHAIUSA-N 2 1 326.400 3.262 20 5 EGBDMP [NH3+][C@@H]1CC[N@@H+](Cc2ccc3ccc4cccc5ccc2c3c45)C[C@H]1O ZINC001205945704 1370920013 /nfs/dbraw/zinc/92/00/13/1370920013.db2.gz BYUORYNXHCAVFT-WOJBJXKFSA-N 2 1 330.431 3.478 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC[N@@H+]1Cc1ccccc1 ZINC001168966009 1384072404 /nfs/dbraw/zinc/07/24/04/1384072404.db2.gz FRJRVIHEZXKRIP-NXWXRZEISA-N 2 1 331.460 3.075 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC[N@H+]1Cc1ccccc1 ZINC001168966009 1384072409 /nfs/dbraw/zinc/07/24/09/1384072409.db2.gz FRJRVIHEZXKRIP-NXWXRZEISA-N 2 1 331.460 3.075 20 5 EGBDMP C[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169040360 1384098569 /nfs/dbraw/zinc/09/85/69/1384098569.db2.gz ZJBSHDLCFGHDPT-VQTJNVASSA-N 2 1 345.487 3.276 20 5 EGBDMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]21 ZINC000346836759 156158773 /nfs/dbraw/zinc/15/87/73/156158773.db2.gz VOBVDRLQLHLROF-FHLIZLRMSA-N 2 1 341.411 3.414 20 5 EGBDMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@H]12 ZINC000346845149 156160707 /nfs/dbraw/zinc/16/07/07/156160707.db2.gz ZLQZBEVICKRMNS-VBNZEHGJSA-N 2 1 327.384 3.024 20 5 EGBDMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@H]12 ZINC000346845148 156160731 /nfs/dbraw/zinc/16/07/31/156160731.db2.gz ZLQZBEVICKRMNS-UHOFOFEASA-N 2 1 327.384 3.024 20 5 EGBDMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000274362494 267224436 /nfs/dbraw/zinc/22/44/36/267224436.db2.gz NVGSZGFTPFRRKH-FUHWJXTLSA-N 2 1 342.443 3.491 20 5 EGBDMP COc1ccc(-c2ccc(C[NH2+][C@H]3CC[NH2+][C@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000414954680 309111275 /nfs/dbraw/zinc/11/12/75/309111275.db2.gz SWIUDUYNEBKMNT-OLZOCXBDSA-N 2 1 345.399 3.094 20 5 EGBDMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000090526140 454316907 /nfs/dbraw/zinc/31/69/07/454316907.db2.gz KBYKQOOFDKNBNA-KYNGSXCRSA-N 2 1 347.459 3.013 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H](N[C@H](C)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245418523 455293148 /nfs/dbraw/zinc/29/31/48/455293148.db2.gz AVSXQXSQTZTOES-FCEWJHQRSA-N 2 1 349.475 3.382 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245418523 455293151 /nfs/dbraw/zinc/29/31/51/455293151.db2.gz AVSXQXSQTZTOES-FCEWJHQRSA-N 2 1 349.475 3.382 20 5 EGBDMP CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCC[N@@H+](C)C1 ZINC000339004554 456895104 /nfs/dbraw/zinc/89/51/04/456895104.db2.gz FRNQSMYUDVCSRL-LBPRGKRZSA-N 2 1 345.365 3.387 20 5 EGBDMP CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000424283160 458603632 /nfs/dbraw/zinc/60/36/32/458603632.db2.gz AXDFBHKBYKHXFI-HNNXBMFYSA-N 2 1 347.459 3.346 20 5 EGBDMP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Cc2[nH+]ccn2C)CC1 ZINC000441319361 458918317 /nfs/dbraw/zinc/91/83/17/458918317.db2.gz UTDFKSTYIJPPEC-AWEZNQCLSA-N 2 1 328.416 3.344 20 5 EGBDMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000589197656 460050964 /nfs/dbraw/zinc/05/09/64/460050964.db2.gz KGSFGWJCZUMYQA-AWEZNQCLSA-N 2 1 337.851 3.412 20 5 EGBDMP C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788509463 1305958983 /nfs/dbraw/zinc/95/89/83/1305958983.db2.gz YEWPVTPKNHELSX-AWEZNQCLSA-N 2 1 334.464 3.482 20 5 EGBDMP C[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788509463 1305958994 /nfs/dbraw/zinc/95/89/94/1305958994.db2.gz YEWPVTPKNHELSX-AWEZNQCLSA-N 2 1 334.464 3.482 20 5 EGBDMP CC[C@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000133055171 529585082 /nfs/dbraw/zinc/58/50/82/529585082.db2.gz QJJTZOSCXIUCHU-BEFAXECRSA-N 2 1 347.459 3.136 20 5 EGBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000178708198 232394352 /nfs/dbraw/zinc/39/43/52/232394352.db2.gz ZXNNEAZOQDYPKY-GJZGRUSLSA-N 2 1 330.432 3.347 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000132960074 307665464 /nfs/dbraw/zinc/66/54/64/307665464.db2.gz NRRPRLAWJFIVBN-HZPDHXFCSA-N 2 1 347.459 3.055 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-] ZINC000296029869 308386536 /nfs/dbraw/zinc/38/65/36/308386536.db2.gz SSWHLOIJINJBPM-WWTUQBGBSA-N 2 1 333.432 3.269 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000296029869 308386538 /nfs/dbraw/zinc/38/65/38/308386538.db2.gz SSWHLOIJINJBPM-WWTUQBGBSA-N 2 1 333.432 3.269 20 5 EGBDMP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414831269 309104367 /nfs/dbraw/zinc/10/43/67/309104367.db2.gz CUDSEANKWIOAKI-ZDUSSCGKSA-N 2 1 347.390 3.471 20 5 EGBDMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1C[NH3+] ZINC000415127359 309122390 /nfs/dbraw/zinc/12/23/90/309122390.db2.gz MULBDEBFZMPWEQ-ZIAGYGMSSA-N 2 1 329.400 3.272 20 5 EGBDMP Cc1cc(N2CC[N@@H+](C)[C@H](C(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000487073185 311009411 /nfs/dbraw/zinc/00/94/11/311009411.db2.gz PCPPULWFWYHGQV-SFHVURJKSA-N 2 1 328.416 3.228 20 5 EGBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192824172 455701156 /nfs/dbraw/zinc/70/11/56/455701156.db2.gz ZWNAGBAZERFJFB-SCLBCKFNSA-N 2 1 328.416 3.403 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)o1 ZINC000261939854 455974996 /nfs/dbraw/zinc/97/49/96/455974996.db2.gz DNNVPQNIYISFDI-GOSISDBHSA-N 2 1 327.384 3.040 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@]3(CC[NH2+]C3)C2)o1 ZINC000261939854 455974998 /nfs/dbraw/zinc/97/49/98/455974998.db2.gz DNNVPQNIYISFDI-GOSISDBHSA-N 2 1 327.384 3.040 20 5 EGBDMP C[NH+]1CCC([C@@H]2CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000290574210 456369030 /nfs/dbraw/zinc/36/90/30/456369030.db2.gz UANRJTBIDHEGCM-MJICGBHWSA-N 2 1 329.444 3.272 20 5 EGBDMP C[N@H+]1CC=C(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000290914185 456465756 /nfs/dbraw/zinc/46/57/56/456465756.db2.gz PRKLMXUQWDAVRP-UHFFFAOYSA-N 2 1 330.215 3.253 20 5 EGBDMP C[N@@H+]1CC=C(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000290914185 456465761 /nfs/dbraw/zinc/46/57/61/456465761.db2.gz PRKLMXUQWDAVRP-UHFFFAOYSA-N 2 1 330.215 3.253 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000277326552 456778382 /nfs/dbraw/zinc/77/83/82/456778382.db2.gz VJRZVKWCWXTIJK-UHFFFAOYSA-N 2 1 346.431 3.145 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000277326552 456778386 /nfs/dbraw/zinc/77/83/86/456778386.db2.gz VJRZVKWCWXTIJK-UHFFFAOYSA-N 2 1 346.431 3.145 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@@H]([C@@H](C)[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000435368636 458120969 /nfs/dbraw/zinc/12/09/69/458120969.db2.gz BXWKQNSRQJZGHH-CHWSQXEVSA-N 2 1 345.399 3.033 20 5 EGBDMP [NH3+]C[C@]12CCC[C@H]1C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)C2 ZINC000593314298 459837866 /nfs/dbraw/zinc/83/78/66/459837866.db2.gz BWRCLUUALGAUSX-LIRRHRJNSA-N 2 1 341.411 3.416 20 5 EGBDMP CC(C)[N@@H+](C)CC1CC[NH+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000609133461 459907494 /nfs/dbraw/zinc/90/74/94/459907494.db2.gz KFKHFXNVOAKDMO-UHFFFAOYSA-N 2 1 335.448 3.026 20 5 EGBDMP C[NH+](C)Cc1cccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000602589971 460011838 /nfs/dbraw/zinc/01/18/38/460011838.db2.gz AJJXWTXZVXCAKU-UHFFFAOYSA-N 2 1 340.383 3.087 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3C[C@@H]4C[NH2+]C[C@H]4C3)o2)c(Cl)c1 ZINC000611287812 460330781 /nfs/dbraw/zinc/33/07/81/460330781.db2.gz PKVUXWYJZONPIQ-RYUDHWBXSA-N 2 1 347.802 3.159 20 5 EGBDMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)CC1 ZINC000809756947 1317893897 /nfs/dbraw/zinc/89/38/97/1317893897.db2.gz VGJPTYCTJQDUHZ-OAHLLOKOSA-N 2 1 337.851 3.412 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168999448 1384082887 /nfs/dbraw/zinc/08/28/87/1384082887.db2.gz TZIGSGGGULBMOM-VJANTYMQSA-N 2 1 331.460 3.204 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001169037687 1384097302 /nfs/dbraw/zinc/09/73/02/1384097302.db2.gz SREDBFUIGPTNBB-VAMGGRTRSA-N 2 1 343.471 3.030 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001169037687 1384097308 /nfs/dbraw/zinc/09/73/08/1384097308.db2.gz SREDBFUIGPTNBB-VAMGGRTRSA-N 2 1 343.471 3.030 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001169037687 1384097312 /nfs/dbraw/zinc/09/73/12/1384097312.db2.gz SREDBFUIGPTNBB-VAMGGRTRSA-N 2 1 343.471 3.030 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001169037684 1384097456 /nfs/dbraw/zinc/09/74/56/1384097456.db2.gz SREDBFUIGPTNBB-AABGKKOBSA-N 2 1 343.471 3.030 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001169037684 1384097461 /nfs/dbraw/zinc/09/74/61/1384097461.db2.gz SREDBFUIGPTNBB-AABGKKOBSA-N 2 1 343.471 3.030 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001169037684 1384097465 /nfs/dbraw/zinc/09/74/65/1384097465.db2.gz SREDBFUIGPTNBB-AABGKKOBSA-N 2 1 343.471 3.030 20 5 EGBDMP C[NH+](C)CCC1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000174867825 231328676 /nfs/dbraw/zinc/32/86/76/231328676.db2.gz VLVUKONSKXBBDF-UHFFFAOYSA-N 2 1 325.840 3.412 20 5 EGBDMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@@H]12 ZINC000346845146 156161140 /nfs/dbraw/zinc/16/11/40/156161140.db2.gz ZLQZBEVICKRMNS-APHBMKBZSA-N 2 1 327.384 3.024 20 5 EGBDMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000274362497 267224914 /nfs/dbraw/zinc/22/49/14/267224914.db2.gz NVGSZGFTPFRRKH-WMZOPIPTSA-N 2 1 342.443 3.491 20 5 EGBDMP CCC[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cccc([N+](=O)[O-])c1 ZINC000278941324 275289688 /nfs/dbraw/zinc/28/96/88/275289688.db2.gz KDZMGACJKADKKL-PBHICJAKSA-N 2 1 328.416 3.485 20 5 EGBDMP C[C@H]1C[C@H](NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000279616037 275344175 /nfs/dbraw/zinc/34/41/75/275344175.db2.gz XTVOJSBKMPCBPV-GXFFZTMASA-N 2 1 331.338 3.186 20 5 EGBDMP C[C@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1C ZINC000279616037 275344177 /nfs/dbraw/zinc/34/41/77/275344177.db2.gz XTVOJSBKMPCBPV-GXFFZTMASA-N 2 1 331.338 3.186 20 5 EGBDMP CC[NH+](CC)CCO[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000350227883 279109827 /nfs/dbraw/zinc/10/98/27/279109827.db2.gz WTBSWPFOSNWXCG-JKSUJKDBSA-N 2 1 335.448 3.089 20 5 EGBDMP O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cs1 ZINC000415014473 309114468 /nfs/dbraw/zinc/11/44/68/309114468.db2.gz ZTGIOUJLTATWSU-GOEBONIOSA-N 2 1 349.431 3.278 20 5 EGBDMP C[NH+](C)CCC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172237817 455137956 /nfs/dbraw/zinc/13/79/56/455137956.db2.gz ZTQMZSPHLQWYGM-UHFFFAOYSA-N 2 1 325.840 3.412 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@]4(CC[NH2+]C4)C3)o2)cc1 ZINC000261695357 455930001 /nfs/dbraw/zinc/93/00/01/455930001.db2.gz BEYPQJVBRINYGP-SFHVURJKSA-N 2 1 327.384 3.040 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@]4(CC[NH2+]C4)C3)o2)cc1 ZINC000261695357 455930009 /nfs/dbraw/zinc/93/00/09/455930009.db2.gz BEYPQJVBRINYGP-SFHVURJKSA-N 2 1 327.384 3.040 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@]4(CC[NH2+]C4)C3)o2)c1 ZINC000262063061 455992179 /nfs/dbraw/zinc/99/21/79/455992179.db2.gz RHGCZAPLUNRDAU-GOSISDBHSA-N 2 1 327.384 3.040 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@]4(CC[NH2+]C4)C3)o2)c1 ZINC000262063061 455992184 /nfs/dbraw/zinc/99/21/84/455992184.db2.gz RHGCZAPLUNRDAU-GOSISDBHSA-N 2 1 327.384 3.040 20 5 EGBDMP C[C@@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000347073667 457217384 /nfs/dbraw/zinc/21/73/84/457217384.db2.gz RUPLYEULISAQDP-ZIAGYGMSSA-N 2 1 329.400 3.414 20 5 EGBDMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494489891 458687894 /nfs/dbraw/zinc/68/78/94/458687894.db2.gz BOQVKUQQEOVLRD-ZETOZRRWSA-N 2 1 345.365 3.432 20 5 EGBDMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494489891 458687897 /nfs/dbraw/zinc/68/78/97/458687897.db2.gz BOQVKUQQEOVLRD-ZETOZRRWSA-N 2 1 345.365 3.432 20 5 EGBDMP CC(C)[N@@H+](C)CC1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000524156171 459349712 /nfs/dbraw/zinc/34/97/12/459349712.db2.gz PGSMELPCBWWMTC-UHFFFAOYSA-N 2 1 335.448 3.026 20 5 EGBDMP O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2ccccc2)c1 ZINC000591578267 459406177 /nfs/dbraw/zinc/40/61/77/459406177.db2.gz JCGZNGJXYMQISE-IEBWSBKVSA-N 2 1 325.412 3.416 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592433673 459600127 /nfs/dbraw/zinc/60/01/27/459600127.db2.gz PEXDCNMOCBTFAM-HZPDHXFCSA-N 2 1 347.459 3.205 20 5 EGBDMP [NH3+]CC[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000904404609 1317841919 /nfs/dbraw/zinc/84/19/19/1317841919.db2.gz AMGWLHPRBCSWFV-CYBMUJFWSA-N 2 1 331.441 3.494 20 5 EGBDMP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000866393437 1330106118 /nfs/dbraw/zinc/10/61/18/1330106118.db2.gz OEBAPHCGUBDWBN-ZBFHGGJFSA-N 2 1 349.450 3.377 20 5 EGBDMP O[C@@H]1C[NH2+]CC[N@H+](Cc2c3ccccc3c3cc4ccccc4oc2-3)C1 ZINC001210474167 1372361781 /nfs/dbraw/zinc/36/17/81/1372361781.db2.gz DUYSNPDGYYXJLU-MRXNPFEDSA-N 2 1 346.430 3.457 20 5 EGBDMP O[C@@H]1C[NH2+]CC[N@@H+](Cc2c3ccccc3c3cc4ccccc4oc2-3)C1 ZINC001210474167 1372361782 /nfs/dbraw/zinc/36/17/82/1372361782.db2.gz DUYSNPDGYYXJLU-MRXNPFEDSA-N 2 1 346.430 3.457 20 5 EGBDMP C[C@@H](C[N+](C)(C)C)Oc1ccc2c(n1)CC[N@@H+](Cc1ccccc1)C2 ZINC001226742125 1375322611 /nfs/dbraw/zinc/32/26/11/1375322611.db2.gz CQXVVCHWXZKUAA-KRWDZBQOSA-N 2 1 340.491 3.113 20 5 EGBDMP C[C@@H](C[N+](C)(C)C)Oc1ccc2c(n1)CC[N@H+](Cc1ccccc1)C2 ZINC001226742125 1375322614 /nfs/dbraw/zinc/32/26/14/1375322614.db2.gz CQXVVCHWXZKUAA-KRWDZBQOSA-N 2 1 340.491 3.113 20 5 EGBDMP C[NH+](C)CC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000338915145 163383701 /nfs/dbraw/zinc/38/37/01/163383701.db2.gz XUGKOMKNEIECJE-UHFFFAOYSA-N 2 1 345.365 3.387 20 5 EGBDMP CCC[N@@H+](CCN1CC[NH+](CC)CC1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000344190978 164123266 /nfs/dbraw/zinc/12/32/66/164123266.db2.gz YJFCIKOKGMLRMY-QGZVFWFLSA-N 2 1 348.491 3.005 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3C[C@@H](C[NH3+])C[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000414655981 309093832 /nfs/dbraw/zinc/09/38/32/309093832.db2.gz DYEXMJBACXTTFK-QWHCGFSZSA-N 2 1 345.399 3.033 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CC[NH2+]CC3)o2)c(Cl)c1 ZINC000414780473 309100614 /nfs/dbraw/zinc/10/06/14/309100614.db2.gz BEJVZYZQIMQEJG-UHFFFAOYSA-N 2 1 335.791 3.350 20 5 EGBDMP CN(c1ccccc1)c1ccc(C[NH2+]C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000414798227 309102101 /nfs/dbraw/zinc/10/21/01/309102101.db2.gz ZXBRIDNWVYQWCF-UHFFFAOYSA-N 2 1 340.427 3.204 20 5 EGBDMP COc1ccc(-c2ccc(C[NH2+][C@H]3CC[NH2+][C@@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000414954684 309111344 /nfs/dbraw/zinc/11/13/44/309111344.db2.gz SWIUDUYNEBKMNT-STQMWFEESA-N 2 1 345.399 3.094 20 5 EGBDMP [NH3+]C[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000423513112 309403914 /nfs/dbraw/zinc/40/39/14/309403914.db2.gz VEAMXDPACOEGIU-NJAFHUGGSA-N 2 1 331.460 3.413 20 5 EGBDMP CC(C)OCC[NH+]1CCC([NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449192982 310043615 /nfs/dbraw/zinc/04/36/15/310043615.db2.gz ZHMKANMZPTVXQZ-MRXNPFEDSA-N 2 1 349.475 3.005 20 5 EGBDMP CC(C)OCC[NH+]1CCC([NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449192980 310043670 /nfs/dbraw/zinc/04/36/70/310043670.db2.gz ZHMKANMZPTVXQZ-INIZCTEOSA-N 2 1 349.475 3.005 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000571955450 317270641 /nfs/dbraw/zinc/27/06/41/317270641.db2.gz MHANURQILPDKSW-HZPDHXFCSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC000571955450 317270644 /nfs/dbraw/zinc/27/06/44/317270644.db2.gz MHANURQILPDKSW-HZPDHXFCSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1c(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134903158 454607506 /nfs/dbraw/zinc/60/75/06/454607506.db2.gz XTWNZOFQXXOLLZ-APWZRJJASA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134903158 454607511 /nfs/dbraw/zinc/60/75/11/454607511.db2.gz XTWNZOFQXXOLLZ-APWZRJJASA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134903158 454607519 /nfs/dbraw/zinc/60/75/19/454607519.db2.gz XTWNZOFQXXOLLZ-APWZRJJASA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134903158 454607523 /nfs/dbraw/zinc/60/75/23/454607523.db2.gz XTWNZOFQXXOLLZ-APWZRJJASA-N 2 1 329.444 3.352 20 5 EGBDMP O=[N+]([O-])c1cccc(F)c1CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134931821 454611611 /nfs/dbraw/zinc/61/16/11/454611611.db2.gz IDXFKWKLMBJHQQ-CXAGYDPISA-N 2 1 333.407 3.183 20 5 EGBDMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000179633015 455063003 /nfs/dbraw/zinc/06/30/03/455063003.db2.gz KJBFWXTWQKJSMM-AWEZNQCLSA-N 2 1 329.400 3.238 20 5 EGBDMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000179633015 455063007 /nfs/dbraw/zinc/06/30/07/455063007.db2.gz KJBFWXTWQKJSMM-AWEZNQCLSA-N 2 1 329.400 3.238 20 5 EGBDMP C[N@@H+]1CCC[C@@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC[C@@H]21 ZINC000601130629 460722119 /nfs/dbraw/zinc/72/21/19/460722119.db2.gz NDQHDBLGZCGAPN-DYVFJYSZSA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@H+]1CCC[C@@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC[C@@H]21 ZINC000601130629 460722124 /nfs/dbraw/zinc/72/21/24/460722124.db2.gz NDQHDBLGZCGAPN-DYVFJYSZSA-N 2 1 326.400 3.064 20 5 EGBDMP C[C@@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000347145786 457255690 /nfs/dbraw/zinc/25/56/90/457255690.db2.gz YGWDPDKCOYPJQZ-HIFRSBDPSA-N 2 1 329.400 3.414 20 5 EGBDMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435391919 458136056 /nfs/dbraw/zinc/13/60/56/458136056.db2.gz UTSLZKOTOHOLJO-ZDUSSCGKSA-N 2 1 331.441 3.365 20 5 EGBDMP C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC[NH2+]CC1 ZINC000435432044 458144812 /nfs/dbraw/zinc/14/48/12/458144812.db2.gz HGHALUDDCPUFRK-CQSZACIVSA-N 2 1 329.400 3.429 20 5 EGBDMP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[NH2+]C[C@H]1c1ccccc1 ZINC000423503486 458444868 /nfs/dbraw/zinc/44/48/68/458444868.db2.gz FURXPMBXXUEVJK-ZYSHUDEJSA-N 2 1 339.439 3.261 20 5 EGBDMP CN(c1cc[nH+]c2ccc([N+](=O)[O-])cc21)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000601165686 460738568 /nfs/dbraw/zinc/73/85/68/460738568.db2.gz SNJQAGJOKKEZOO-NNQSOWQGSA-N 2 1 326.400 3.204 20 5 EGBDMP CN(c1cc[nH+]c2ccc([N+](=O)[O-])cc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000601165686 460738574 /nfs/dbraw/zinc/73/85/74/460738574.db2.gz SNJQAGJOKKEZOO-NNQSOWQGSA-N 2 1 326.400 3.204 20 5 EGBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000876783239 1298981684 /nfs/dbraw/zinc/98/16/84/1298981684.db2.gz XKZRBCRXNQQVCC-KRWDZBQOSA-N 2 1 331.460 3.375 20 5 EGBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000876783239 1298981696 /nfs/dbraw/zinc/98/16/96/1298981696.db2.gz XKZRBCRXNQQVCC-KRWDZBQOSA-N 2 1 331.460 3.375 20 5 EGBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000876783239 1298981709 /nfs/dbraw/zinc/98/17/09/1298981709.db2.gz XKZRBCRXNQQVCC-KRWDZBQOSA-N 2 1 331.460 3.375 20 5 EGBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000876783239 1298981724 /nfs/dbraw/zinc/98/17/24/1298981724.db2.gz XKZRBCRXNQQVCC-KRWDZBQOSA-N 2 1 331.460 3.375 20 5 EGBDMP [NH3+]CC[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000904404610 1317842490 /nfs/dbraw/zinc/84/24/90/1317842490.db2.gz AMGWLHPRBCSWFV-ZDUSSCGKSA-N 2 1 331.441 3.494 20 5 EGBDMP [NH3+]C[C@H]1C[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)C[C@H]1O ZINC001206476913 1371066772 /nfs/dbraw/zinc/06/67/72/1371066772.db2.gz YEVSKFUKBWMCNS-ORAYPTAESA-N 2 1 340.854 3.398 20 5 EGBDMP C[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169040359 1384098318 /nfs/dbraw/zinc/09/83/18/1384098318.db2.gz ZJBSHDLCFGHDPT-UXHICEINSA-N 2 1 345.487 3.276 20 5 EGBDMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172900022 1384874138 /nfs/dbraw/zinc/87/41/38/1384874138.db2.gz RHFOSXHWUVOMFF-YJBOKZPZSA-N 2 1 331.460 3.164 20 5 EGBDMP CC[NH+]1CCC([N@H+](C)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172912475 1384875818 /nfs/dbraw/zinc/87/58/18/1384875818.db2.gz AWFUQABPAUAFJA-KRWDZBQOSA-N 2 1 331.460 3.258 20 5 EGBDMP CC[NH+]1CCC([N@@H+](C)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172912475 1384875825 /nfs/dbraw/zinc/87/58/25/1384875825.db2.gz AWFUQABPAUAFJA-KRWDZBQOSA-N 2 1 331.460 3.258 20 5 EGBDMP C[N@H+]1C[C@@H]2C[NH+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C[C@@H]2C1 ZINC000194539164 266126373 /nfs/dbraw/zinc/12/63/73/266126373.db2.gz HUVAYCPFIQLKGY-OKILXGFUSA-N 2 1 343.452 3.317 20 5 EGBDMP C[N@@H+]1C[C@@H]2C[NH+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C[C@@H]2C1 ZINC000194539164 266126376 /nfs/dbraw/zinc/12/63/76/266126376.db2.gz HUVAYCPFIQLKGY-OKILXGFUSA-N 2 1 343.452 3.317 20 5 EGBDMP C[NH+]1C[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C[C@@H]2C1 ZINC000194539164 266126380 /nfs/dbraw/zinc/12/63/80/266126380.db2.gz HUVAYCPFIQLKGY-OKILXGFUSA-N 2 1 343.452 3.317 20 5 EGBDMP C[NH+]1C[C@@H]2C[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C[C@@H]2C1 ZINC000194539164 266126382 /nfs/dbraw/zinc/12/63/82/266126382.db2.gz HUVAYCPFIQLKGY-OKILXGFUSA-N 2 1 343.452 3.317 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3C[C@@H](C[NH3+])C[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000414655976 309093843 /nfs/dbraw/zinc/09/38/43/309093843.db2.gz DYEXMJBACXTTFK-CHWSQXEVSA-N 2 1 345.399 3.033 20 5 EGBDMP C[C@@]1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC[NH2+]C1 ZINC000414915245 309108981 /nfs/dbraw/zinc/10/89/81/309108981.db2.gz ZLIXRUUWSYIBFW-GOSISDBHSA-N 2 1 329.400 3.334 20 5 EGBDMP CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000158961743 455341175 /nfs/dbraw/zinc/34/11/75/455341175.db2.gz XRPMQAXQOVAWDM-QAPCUYQASA-N 2 1 347.459 3.298 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000153037749 454755311 /nfs/dbraw/zinc/75/53/11/454755311.db2.gz DFNVFSLILITDQQ-CABCVRRESA-N 2 1 335.448 3.376 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000245586275 455336090 /nfs/dbraw/zinc/33/60/90/455336090.db2.gz JWRPICUVZNOMMD-YOEHRIQHSA-N 2 1 344.415 3.273 20 5 EGBDMP C[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185736340 455610507 /nfs/dbraw/zinc/61/05/07/455610507.db2.gz IOKGLUOUZZYFFJ-HZPDHXFCSA-N 2 1 347.459 3.216 20 5 EGBDMP Cc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000278375607 455834506 /nfs/dbraw/zinc/83/45/06/455834506.db2.gz CCOKUQKLIUWBRC-HOTGVXAUSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000278375607 455834508 /nfs/dbraw/zinc/83/45/08/455834508.db2.gz CCOKUQKLIUWBRC-HOTGVXAUSA-N 2 1 335.448 3.055 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)o1 ZINC000352539773 457451491 /nfs/dbraw/zinc/45/14/91/457451491.db2.gz CNOPZAUAGPYHRX-IBGZPJMESA-N 2 1 341.411 3.430 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@]3(CC[NH2+]C3)C2)o1 ZINC000352539773 457451503 /nfs/dbraw/zinc/45/15/03/457451503.db2.gz CNOPZAUAGPYHRX-IBGZPJMESA-N 2 1 341.411 3.430 20 5 EGBDMP C[C@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435374014 458124760 /nfs/dbraw/zinc/12/47/60/458124760.db2.gz PAAOFCJLAFHTRR-GXTWGEPZSA-N 2 1 331.441 3.492 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+]3CC[C@@H]([NH3+])[C@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000435375913 458126724 /nfs/dbraw/zinc/12/67/24/458126724.db2.gz OWGVZRHYBLQJBZ-MLGOLLRUSA-N 2 1 345.399 3.033 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@@H]([NH3+])[C@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000435375913 458126728 /nfs/dbraw/zinc/12/67/28/458126728.db2.gz OWGVZRHYBLQJBZ-MLGOLLRUSA-N 2 1 345.399 3.033 20 5 EGBDMP [NH3+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435399126 458137833 /nfs/dbraw/zinc/13/78/33/458137833.db2.gz VLKYIBLBAJCXCB-CYBMUJFWSA-N 2 1 331.441 3.494 20 5 EGBDMP CC[NH+](CC)CCCC1CC[NH+](Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000595423567 459297064 /nfs/dbraw/zinc/29/70/64/459297064.db2.gz ASVUGIQRLGJUSL-UHFFFAOYSA-N 2 1 338.452 3.225 20 5 EGBDMP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c(Cl)c1 ZINC000592433669 459599707 /nfs/dbraw/zinc/59/97/07/459599707.db2.gz OOAILWWNNBQFCW-ZIAGYGMSSA-N 2 1 337.851 3.460 20 5 EGBDMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602512543 459976774 /nfs/dbraw/zinc/97/67/74/459976774.db2.gz CBJALVSZHGQKCG-CQSZACIVSA-N 2 1 346.431 3.480 20 5 EGBDMP [NH3+]C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1c1ccccc1 ZINC000261787514 1296602633 /nfs/dbraw/zinc/60/26/33/1296602633.db2.gz UOVMMTDEGWCHTL-WBVHZDCISA-N 2 1 345.830 3.423 20 5 EGBDMP [NH3+]C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1c1ccccc1 ZINC000261787514 1296602650 /nfs/dbraw/zinc/60/26/50/1296602650.db2.gz UOVMMTDEGWCHTL-WBVHZDCISA-N 2 1 345.830 3.423 20 5 EGBDMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cccc1[N+](=O)[O-] ZINC000765976380 1302361271 /nfs/dbraw/zinc/36/12/71/1302361271.db2.gz OEOOBJLBKNFFNS-WBVHZDCISA-N 2 1 347.459 3.197 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126567 1321474471 /nfs/dbraw/zinc/47/44/71/1321474471.db2.gz KMXYZKSPUIXBKL-KBPBESRZSA-N 2 1 337.851 3.460 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1 ZINC000843127904 1321474572 /nfs/dbraw/zinc/47/45/72/1321474572.db2.gz UICDNCUMXDJEDY-ZIAGYGMSSA-N 2 1 337.851 3.460 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001168961624 1384071493 /nfs/dbraw/zinc/07/14/93/1384071493.db2.gz JEWSWXIUMXEFRN-UJMXGEILSA-N 2 1 343.471 3.217 20 5 EGBDMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@H]12 ZINC000346821589 156153242 /nfs/dbraw/zinc/15/32/42/156153242.db2.gz IUEWYBKHYQTBEX-XOKHGSTOSA-N 2 1 327.384 3.024 20 5 EGBDMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@H]12 ZINC000346852151 156164597 /nfs/dbraw/zinc/16/45/97/156164597.db2.gz WKFMKWYTOXHFMW-RRQGHBQHSA-N 2 1 327.384 3.024 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](c2nccn2C)C1 ZINC000349155596 156369816 /nfs/dbraw/zinc/36/98/16/156369816.db2.gz WBVXVLYRAKDHSO-DNXIFWLFSA-N 2 1 326.400 3.221 20 5 EGBDMP C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[NH2+]C1 ZINC000414842312 309105018 /nfs/dbraw/zinc/10/50/18/309105018.db2.gz BDMFULMEWBLNFM-UKRRQHHQSA-N 2 1 329.400 3.333 20 5 EGBDMP [NH3+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000581071166 325326991 /nfs/dbraw/zinc/32/69/91/325326991.db2.gz HMZLQKVEIFWMPB-CYBMUJFWSA-N 2 1 331.441 3.494 20 5 EGBDMP COCCC[NH+]1CCC([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000159132813 455355040 /nfs/dbraw/zinc/35/50/40/455355040.db2.gz SBZLJBIPMOUZOJ-HNNXBMFYSA-N 2 1 335.448 3.055 20 5 EGBDMP CCCC[N@@H+](C)CC1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000065223100 454539668 /nfs/dbraw/zinc/53/96/68/454539668.db2.gz ZVGXVCKXHVEPCR-UHFFFAOYSA-N 2 1 349.475 3.418 20 5 EGBDMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)C1 ZINC000245502914 455315678 /nfs/dbraw/zinc/31/56/78/455315678.db2.gz HCDLFQKOVVCOES-CABCVRRESA-N 2 1 335.448 3.376 20 5 EGBDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)C1 ZINC000245502914 455315682 /nfs/dbraw/zinc/31/56/82/455315682.db2.gz HCDLFQKOVVCOES-CABCVRRESA-N 2 1 335.448 3.376 20 5 EGBDMP C[N@@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000271814495 455771301 /nfs/dbraw/zinc/77/13/01/455771301.db2.gz LSGNLKDJLJEFDQ-UHFFFAOYSA-N 2 1 327.384 3.206 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)o1 ZINC000427138855 457949083 /nfs/dbraw/zinc/94/90/83/457949083.db2.gz ZNULIDBAUYLQBF-BBRMVZONSA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)o1 ZINC000427138855 457949089 /nfs/dbraw/zinc/94/90/89/457949089.db2.gz ZNULIDBAUYLQBF-BBRMVZONSA-N 2 1 327.384 3.039 20 5 EGBDMP C[C@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435369950 458121587 /nfs/dbraw/zinc/12/15/87/458121587.db2.gz GVPLOVIVPVINJF-QWHCGFSZSA-N 2 1 331.441 3.492 20 5 EGBDMP C[C@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435369951 458121609 /nfs/dbraw/zinc/12/16/09/458121609.db2.gz GVPLOVIVPVINJF-STQMWFEESA-N 2 1 331.441 3.492 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000593736240 459967189 /nfs/dbraw/zinc/96/71/89/459967189.db2.gz KHQKOXUBOXQTHN-YIOZNXECSA-N 2 1 347.459 3.183 20 5 EGBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602847292 460158271 /nfs/dbraw/zinc/15/82/71/460158271.db2.gz VTLRGXMWIIOLAC-OAHLLOKOSA-N 2 1 326.400 3.263 20 5 EGBDMP C[N@H+](CCCC[NH+]1CCCCC1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000603110075 460244744 /nfs/dbraw/zinc/24/47/44/460244744.db2.gz LUYSASQAMOQVSF-UHFFFAOYSA-N 2 1 345.447 3.169 20 5 EGBDMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000603110075 460244749 /nfs/dbraw/zinc/24/47/49/460244749.db2.gz LUYSASQAMOQVSF-UHFFFAOYSA-N 2 1 345.447 3.169 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000734510142 575504545 /nfs/dbraw/zinc/50/45/45/575504545.db2.gz RIHCSKNHBIMFRP-FUHWJXTLSA-N 2 1 349.475 3.130 20 5 EGBDMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000734510142 575504548 /nfs/dbraw/zinc/50/45/48/575504548.db2.gz RIHCSKNHBIMFRP-FUHWJXTLSA-N 2 1 349.475 3.130 20 5 EGBDMP [NH3+]C1CC([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000906510056 1318111253 /nfs/dbraw/zinc/11/12/53/1318111253.db2.gz LYJNTAHFEGVZGP-UHFFFAOYSA-N 2 1 331.347 3.106 20 5 EGBDMP C[NH+]1CCN(C2C[NH+](Cc3c4ccccc4cc4ccccc43)C2)CC1 ZINC001141728560 1378366548 /nfs/dbraw/zinc/36/65/48/1378366548.db2.gz WWCAZWYQYKOOIK-UHFFFAOYSA-N 2 1 345.490 3.425 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169000870 1384084414 /nfs/dbraw/zinc/08/44/14/1384084414.db2.gz YZEXOACFLYXCER-WNHJNPCNSA-N 2 1 349.450 3.343 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001169037685 1384097019 /nfs/dbraw/zinc/09/70/19/1384097019.db2.gz SREDBFUIGPTNBB-AQNXPRMDSA-N 2 1 343.471 3.030 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001169037685 1384097022 /nfs/dbraw/zinc/09/70/22/1384097022.db2.gz SREDBFUIGPTNBB-AQNXPRMDSA-N 2 1 343.471 3.030 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001169037685 1384097028 /nfs/dbraw/zinc/09/70/28/1384097028.db2.gz SREDBFUIGPTNBB-AQNXPRMDSA-N 2 1 343.471 3.030 20 5 EGBDMP COc1ccc(C[C@H](C)n2c[nH+]cc2C2CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001170351394 1384298471 /nfs/dbraw/zinc/29/84/71/1384298471.db2.gz FZDZTSVNPIAQOX-ZDUSSCGKSA-N 2 1 344.415 3.071 20 5 EGBDMP NCC[N@@H+](Cc1ccccc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172895195 1384873012 /nfs/dbraw/zinc/87/30/12/1384873012.db2.gz ATLDGFQGNQTFFS-IBGZPJMESA-N 2 1 339.439 3.303 20 5 EGBDMP [NH3+]CC[N@@H+](Cc1ccccc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172895195 1384873014 /nfs/dbraw/zinc/87/30/14/1384873014.db2.gz ATLDGFQGNQTFFS-IBGZPJMESA-N 2 1 339.439 3.303 20 5 EGBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172900021 1384874312 /nfs/dbraw/zinc/87/43/12/1384874312.db2.gz RHFOSXHWUVOMFF-QAPCUYQASA-N 2 1 331.460 3.164 20 5 EGBDMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172904522 1384875338 /nfs/dbraw/zinc/87/53/38/1384875338.db2.gz XXEANJBEKCQZNU-MKXGPGLRSA-N 2 1 343.471 3.447 20 5 EGBDMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172904522 1384875340 /nfs/dbraw/zinc/87/53/40/1384875340.db2.gz XXEANJBEKCQZNU-MKXGPGLRSA-N 2 1 343.471 3.447 20 5 EGBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC001173228959 1384940893 /nfs/dbraw/zinc/94/08/93/1384940893.db2.gz OMYACLIJQGUULD-INIZCTEOSA-N 2 1 331.460 3.476 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCc3[nH+]ccn3C1)CCC2 ZINC000279025978 275296991 /nfs/dbraw/zinc/29/69/91/275296991.db2.gz VLJOHRFVDUROMQ-SUMWQHHRSA-N 2 1 326.400 3.021 20 5 EGBDMP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)C1CC1 ZINC000119648658 280374352 /nfs/dbraw/zinc/37/43/52/280374352.db2.gz AEAVNCBPPONIFA-GOSISDBHSA-N 2 1 329.444 3.132 20 5 EGBDMP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000414811426 309103086 /nfs/dbraw/zinc/10/30/86/309103086.db2.gz WGKRJOMZQSBBGA-CJNGLKHVSA-N 2 1 346.456 3.325 20 5 EGBDMP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000414977848 309112529 /nfs/dbraw/zinc/11/25/29/309112529.db2.gz SFRHUPYJFCGNPN-KRWDZBQOSA-N 2 1 329.400 3.333 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+]3CC[C@@H]([NH3+])C[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000571578017 317218896 /nfs/dbraw/zinc/21/88/96/317218896.db2.gz DCXXQXDGAUPFJW-CHWSQXEVSA-N 2 1 345.399 3.175 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@@H]([NH3+])C[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000571578017 317218899 /nfs/dbraw/zinc/21/88/99/317218899.db2.gz DCXXQXDGAUPFJW-CHWSQXEVSA-N 2 1 345.399 3.175 20 5 EGBDMP CC(C)[N@H+](C)CC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000083170673 453941435 /nfs/dbraw/zinc/94/14/35/453941435.db2.gz MTSDYQDIWFOBGX-UHFFFAOYSA-N 2 1 346.431 3.288 20 5 EGBDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000083170673 453941439 /nfs/dbraw/zinc/94/14/39/453941439.db2.gz MTSDYQDIWFOBGX-UHFFFAOYSA-N 2 1 346.431 3.288 20 5 EGBDMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000090526152 454317479 /nfs/dbraw/zinc/31/74/79/454317479.db2.gz KBYKQOOFDKNBNA-JVPBZIDWSA-N 2 1 347.459 3.013 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000153585725 454809347 /nfs/dbraw/zinc/80/93/47/454809347.db2.gz NVAFWUCMSOVRLQ-ZIAGYGMSSA-N 2 1 346.431 3.485 20 5 EGBDMP CCC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H]1CO)c1cccc([N+](=O)[O-])c1 ZINC000268844445 455715644 /nfs/dbraw/zinc/71/56/44/455715644.db2.gz BJMHNYLQBLEGOM-RBUKOAKNSA-N 2 1 349.475 3.263 20 5 EGBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCn1cc[nH+]c1C ZINC000271024142 456100635 /nfs/dbraw/zinc/10/06/35/456100635.db2.gz AWRHNHISTHGOJV-CQSZACIVSA-N 2 1 334.445 3.260 20 5 EGBDMP Cc1cc(N(C)C[C@@H]2CCC[N@@H+](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302190992 456313024 /nfs/dbraw/zinc/31/30/24/456313024.db2.gz QXPQUGZABWOYOB-CQSZACIVSA-N 2 1 328.416 3.229 20 5 EGBDMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1[NH3+] ZINC000435377362 458127085 /nfs/dbraw/zinc/12/70/85/458127085.db2.gz ARJHNTSVZKTHGH-WFASDCNBSA-N 2 1 331.441 3.492 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+]3CC[C@@H]([NH3+])[C@@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000435375911 458127308 /nfs/dbraw/zinc/12/73/08/458127308.db2.gz OWGVZRHYBLQJBZ-BLLLJJGKSA-N 2 1 345.399 3.033 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@@H]([NH3+])[C@@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000435375911 458127312 /nfs/dbraw/zinc/12/73/12/458127312.db2.gz OWGVZRHYBLQJBZ-BLLLJJGKSA-N 2 1 345.399 3.033 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CCC[C@@H](C[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000435392107 458136355 /nfs/dbraw/zinc/13/63/55/458136355.db2.gz GAQKAFAJGYPOFV-ZDUSSCGKSA-N 2 1 345.399 3.034 20 5 EGBDMP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000430133383 458408152 /nfs/dbraw/zinc/40/81/52/458408152.db2.gz NOJYKFMBUNXOTH-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000430133383 458408155 /nfs/dbraw/zinc/40/81/55/458408155.db2.gz NOJYKFMBUNXOTH-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000430133383 458408157 /nfs/dbraw/zinc/40/81/57/458408157.db2.gz NOJYKFMBUNXOTH-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000430133383 458408161 /nfs/dbraw/zinc/40/81/61/458408161.db2.gz NOJYKFMBUNXOTH-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000609133601 459908197 /nfs/dbraw/zinc/90/81/97/459908197.db2.gz ZDTMLCHNEKTWCL-UHFFFAOYSA-N 2 1 335.448 3.156 20 5 EGBDMP C[NH+](C)CCOc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000611254743 460318544 /nfs/dbraw/zinc/31/85/44/460318544.db2.gz ALPINCSFIMGRGA-UHFFFAOYSA-N 2 1 343.427 3.167 20 5 EGBDMP C[NH+](C)CCOc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000611254743 460318548 /nfs/dbraw/zinc/31/85/48/460318548.db2.gz ALPINCSFIMGRGA-UHFFFAOYSA-N 2 1 343.427 3.167 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115628086 1293192810 /nfs/dbraw/zinc/19/28/10/1293192810.db2.gz RIHCSKNHBIMFRP-AEFFLSMTSA-N 2 1 349.475 3.130 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115628086 1293192814 /nfs/dbraw/zinc/19/28/14/1293192814.db2.gz RIHCSKNHBIMFRP-AEFFLSMTSA-N 2 1 349.475 3.130 20 5 EGBDMP Cc1[nH]c(C2CC[NH+](CCOc3ccc([N+](=O)[O-])cc3)CC2)[nH+]c1C ZINC000886668794 1303549452 /nfs/dbraw/zinc/54/94/52/1303549452.db2.gz ZNJPUBQODTUHDW-UHFFFAOYSA-N 2 1 344.415 3.193 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)CC[N@@H+]1Cc1ccccc1 ZINC001168966012 1384072417 /nfs/dbraw/zinc/07/24/17/1384072417.db2.gz FRJRVIHEZXKRIP-XGXHKWSGSA-N 2 1 331.460 3.075 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)CC[N@H+]1Cc1ccccc1 ZINC001168966012 1384072424 /nfs/dbraw/zinc/07/24/24/1384072424.db2.gz FRJRVIHEZXKRIP-XGXHKWSGSA-N 2 1 331.460 3.075 20 5 EGBDMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169049139 1384100507 /nfs/dbraw/zinc/10/05/07/1384100507.db2.gz VZMXLPZCCOBEHL-LPHOPBHVSA-N 2 1 349.450 3.167 20 5 EGBDMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169049139 1384100509 /nfs/dbraw/zinc/10/05/09/1384100509.db2.gz VZMXLPZCCOBEHL-LPHOPBHVSA-N 2 1 349.450 3.167 20 5 EGBDMP CCC[N@@H+]1C[C@@H]2C[NH+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]2C1 ZINC001172913268 1384876815 /nfs/dbraw/zinc/87/68/15/1384876815.db2.gz QKSWKCNEMSPSIE-CEXWTWQISA-N 2 1 343.471 3.116 20 5 EGBDMP CCC[NH+]1C[C@@H]2C[N@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]2C1 ZINC001172913268 1384876820 /nfs/dbraw/zinc/87/68/20/1384876820.db2.gz QKSWKCNEMSPSIE-CEXWTWQISA-N 2 1 343.471 3.116 20 5 EGBDMP CCC[NH+]1C[C@@H]2C[N@@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]2C1 ZINC001172913268 1384876823 /nfs/dbraw/zinc/87/68/23/1384876823.db2.gz QKSWKCNEMSPSIE-CEXWTWQISA-N 2 1 343.471 3.116 20 5 EGBDMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271553242 266686258 /nfs/dbraw/zinc/68/62/58/266686258.db2.gz VITCAPWANQBMSX-ZOCIIQOWSA-N 2 1 347.459 3.013 20 5 EGBDMP C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294941170 308274234 /nfs/dbraw/zinc/27/42/34/308274234.db2.gz YBJFIHPKUHGMRN-CYBMUJFWSA-N 2 1 332.448 3.235 20 5 EGBDMP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000414811425 309103014 /nfs/dbraw/zinc/10/30/14/309103014.db2.gz WGKRJOMZQSBBGA-BBRMVZONSA-N 2 1 346.456 3.325 20 5 EGBDMP O=[N+]([O-])c1cccc(F)c1CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134931843 454611585 /nfs/dbraw/zinc/61/15/85/454611585.db2.gz IDXFKWKLMBJHQQ-DYVFJYSZSA-N 2 1 333.407 3.183 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000248173143 455694232 /nfs/dbraw/zinc/69/42/32/455694232.db2.gz VDFQQSFDRLIMFD-BXWFABGCSA-N 2 1 349.475 3.382 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000248173143 455694235 /nfs/dbraw/zinc/69/42/35/455694235.db2.gz VDFQQSFDRLIMFD-BXWFABGCSA-N 2 1 349.475 3.382 20 5 EGBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192824207 455700826 /nfs/dbraw/zinc/70/08/26/455700826.db2.gz ZWNAGBAZERFJFB-UGSOOPFHSA-N 2 1 328.416 3.403 20 5 EGBDMP Cc1ccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000261826196 455955115 /nfs/dbraw/zinc/95/51/15/455955115.db2.gz YHRNFFRGCNCANL-MSOLQXFVSA-N 2 1 325.412 3.078 20 5 EGBDMP CCC[C@@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000282429249 456509764 /nfs/dbraw/zinc/50/97/64/456509764.db2.gz TURNLINXMNBXQH-GOSISDBHSA-N 2 1 348.491 3.052 20 5 EGBDMP Cn1ccnc1[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000377189942 458485480 /nfs/dbraw/zinc/48/54/80/458485480.db2.gz SDHWPBLWTOXYNT-CYBMUJFWSA-N 2 1 334.807 3.361 20 5 EGBDMP COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859212648 1328946835 /nfs/dbraw/zinc/94/68/35/1328946835.db2.gz MHXJBNQSNAZUNX-UHFFFAOYSA-N 2 1 343.427 3.297 20 5 EGBDMP COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859212648 1328946840 /nfs/dbraw/zinc/94/68/40/1328946840.db2.gz MHXJBNQSNAZUNX-UHFFFAOYSA-N 2 1 343.427 3.297 20 5 EGBDMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000866262007 1330087026 /nfs/dbraw/zinc/08/70/26/1330087026.db2.gz ZBVHAYIFKNUXIZ-GJZGRUSLSA-N 2 1 337.439 3.375 20 5 EGBDMP O[C@H]1C[NH2+]CC[N@H+](Cc2c3ccccc3c3cc4ccccc4oc2-3)C1 ZINC001210474166 1372361940 /nfs/dbraw/zinc/36/19/40/1372361940.db2.gz DUYSNPDGYYXJLU-INIZCTEOSA-N 2 1 346.430 3.457 20 5 EGBDMP O[C@H]1C[NH2+]CC[N@@H+](Cc2c3ccccc3c3cc4ccccc4oc2-3)C1 ZINC001210474166 1372361943 /nfs/dbraw/zinc/36/19/43/1372361943.db2.gz DUYSNPDGYYXJLU-INIZCTEOSA-N 2 1 346.430 3.457 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168997731 1384082936 /nfs/dbraw/zinc/08/29/36/1384082936.db2.gz FGAOFLODUARSPD-DSLXNQLJSA-N 2 1 349.450 3.343 20 5 EGBDMP CC1([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC[NH+](Cc2ccccc2)CC1 ZINC001169006799 1384085882 /nfs/dbraw/zinc/08/58/82/1384085882.db2.gz ZCPHEALURJMGIL-QZTJIDSGSA-N 2 1 331.460 3.076 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)CC[C@@H](n1c[nH+]cc1C1CC[NH2+]CC1)CC2 ZINC001172919299 1384878259 /nfs/dbraw/zinc/87/82/59/1384878259.db2.gz FMXCSIPWVNCZSK-KRWDZBQOSA-N 2 1 340.427 3.378 20 5 EGBDMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@@H]21 ZINC000346822095 156152233 /nfs/dbraw/zinc/15/22/33/156152233.db2.gz FDUPIZSKTFGOKH-XOKHGSTOSA-N 2 1 341.411 3.414 20 5 EGBDMP C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[NH2+]C1 ZINC000414842291 309105054 /nfs/dbraw/zinc/10/50/54/309105054.db2.gz BDMFULMEWBLNFM-DZGCQCFKSA-N 2 1 329.400 3.333 20 5 EGBDMP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271493898 455659506 /nfs/dbraw/zinc/65/95/06/455659506.db2.gz KVZHCZTXESYTSQ-OTWHNJEPSA-N 2 1 347.459 3.013 20 5 EGBDMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000271873357 455794071 /nfs/dbraw/zinc/79/40/71/455794071.db2.gz NKBNYZCSAKTSNC-AEFFLSMTSA-N 2 1 329.444 3.158 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000282578323 456558225 /nfs/dbraw/zinc/55/82/25/456558225.db2.gz VRXNPUUUHZJIIX-UHFFFAOYSA-N 2 1 334.395 3.405 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000282578323 456558231 /nfs/dbraw/zinc/55/82/31/456558231.db2.gz VRXNPUUUHZJIIX-UHFFFAOYSA-N 2 1 334.395 3.405 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000277180363 456711962 /nfs/dbraw/zinc/71/19/62/456711962.db2.gz ZPECZJPPAKSPFP-UHFFFAOYSA-N 2 1 346.431 3.275 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000277180363 456711965 /nfs/dbraw/zinc/71/19/65/456711965.db2.gz ZPECZJPPAKSPFP-UHFFFAOYSA-N 2 1 346.431 3.275 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H]4[NH2+]CC[C@@H]4C3)o2)c1 ZINC000427132940 457946602 /nfs/dbraw/zinc/94/66/02/457946602.db2.gz IVBSJFBHQYDPNG-RHSMWYFYSA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H]4[NH2+]CC[C@@H]4C3)o2)c1 ZINC000427132940 457946611 /nfs/dbraw/zinc/94/66/11/457946611.db2.gz IVBSJFBHQYDPNG-RHSMWYFYSA-N 2 1 327.384 3.039 20 5 EGBDMP CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001328491091 1388761926 /nfs/dbraw/zinc/76/19/26/1388761926.db2.gz COOGZMZSCOUJDX-UHFFFAOYSA-N 2 1 347.459 3.348 20 5 EGBDMP C[N@@H+](Cc1ccccc1)C1CC[NH+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169022544 1384092467 /nfs/dbraw/zinc/09/24/67/1384092467.db2.gz CSWAZHYFUUMAPA-MJGOQNOKSA-N 2 1 331.460 3.028 20 5 EGBDMP COc1ccc(C[C@H](C)[NH+]2CCC([NH3+])(CC3CC3)CC2)c([N+](=O)[O-])c1 ZINC001170323844 1384291361 /nfs/dbraw/zinc/29/13/61/1384291361.db2.gz MOLSPCWLXMTPKG-AWEZNQCLSA-N 2 1 347.459 3.128 20 5 EGBDMP Cc1c([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cccc1[N+](=O)[O-] ZINC000132961256 205349940 /nfs/dbraw/zinc/34/99/40/205349940.db2.gz SHFABLLCWMPKEU-CVEARBPZSA-N 2 1 347.459 3.055 20 5 EGBDMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@H]12 ZINC000346852153 156164756 /nfs/dbraw/zinc/16/47/56/156164756.db2.gz WKFMKWYTOXHFMW-XOKHGSTOSA-N 2 1 327.384 3.024 20 5 EGBDMP CCC[N@@H+](CCN1CC[NH+](CC)CC1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000344162850 164117311 /nfs/dbraw/zinc/11/73/11/164117311.db2.gz ZIRQDKOCVRFGLR-KRWDZBQOSA-N 2 1 348.491 3.005 20 5 EGBDMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000114479757 454957088 /nfs/dbraw/zinc/95/70/88/454957088.db2.gz IGOVPODMRSQGGL-HNNXBMFYSA-N 2 1 336.435 3.330 20 5 EGBDMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000114479757 454957091 /nfs/dbraw/zinc/95/70/91/454957091.db2.gz IGOVPODMRSQGGL-HNNXBMFYSA-N 2 1 336.435 3.330 20 5 EGBDMP C[C@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000261751366 455940566 /nfs/dbraw/zinc/94/05/66/455940566.db2.gz QFSLWHUZLPCEMQ-QGZVFWFLSA-N 2 1 331.441 3.494 20 5 EGBDMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000261751362 455941084 /nfs/dbraw/zinc/94/10/84/455941084.db2.gz QFSLWHUZLPCEMQ-KRWDZBQOSA-N 2 1 331.441 3.494 20 5 EGBDMP O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@@H](C[NH+]4CCCC4)C3)c2c1 ZINC000601121859 460719141 /nfs/dbraw/zinc/71/91/41/460719141.db2.gz PYTSOAPLKGHPPE-AWEZNQCLSA-N 2 1 326.400 3.065 20 5 EGBDMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1[NH3+] ZINC000435377360 458126655 /nfs/dbraw/zinc/12/66/55/458126655.db2.gz ARJHNTSVZKTHGH-IUODEOHRSA-N 2 1 331.441 3.492 20 5 EGBDMP COc1ccc(-c2ccc(C[NH2+][C@H]3CCC[NH2+]CC3)o2)c([N+](=O)[O-])c1 ZINC000591278483 459345657 /nfs/dbraw/zinc/34/56/57/459345657.db2.gz HVITWWUFWDJKHK-ZDUSSCGKSA-N 2 1 345.399 3.095 20 5 EGBDMP CC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1[NH3+] ZINC000592427554 459598790 /nfs/dbraw/zinc/59/87/90/459598790.db2.gz BTHHOUODAFAISU-GUYCJALGSA-N 2 1 329.400 3.414 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592433674 459600305 /nfs/dbraw/zinc/60/03/05/459600305.db2.gz PEXDCNMOCBTFAM-JKSUJKDBSA-N 2 1 347.459 3.205 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602844317 460156223 /nfs/dbraw/zinc/15/62/23/460156223.db2.gz AFXXUZKWAXGVEH-UHFFFAOYSA-N 2 1 346.818 3.356 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602844317 460156227 /nfs/dbraw/zinc/15/62/27/460156227.db2.gz AFXXUZKWAXGVEH-UHFFFAOYSA-N 2 1 346.818 3.356 20 5 EGBDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866259077 1330086759 /nfs/dbraw/zinc/08/67/59/1330086759.db2.gz GMVJZWNTUJTLNC-STQMWFEESA-N 2 1 334.395 3.096 20 5 EGBDMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)CC1 ZINC001205579158 1370798795 /nfs/dbraw/zinc/79/87/95/1370798795.db2.gz KWZQREKQXYREHI-HXUWFJFHSA-N 2 1 338.430 3.436 20 5 EGBDMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168998253 1384082770 /nfs/dbraw/zinc/08/27/70/1384082770.db2.gz KNPVVEUXIYVFMP-QRVBRYPASA-N 2 1 345.487 3.322 20 5 EGBDMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168998253 1384082775 /nfs/dbraw/zinc/08/27/75/1384082775.db2.gz KNPVVEUXIYVFMP-QRVBRYPASA-N 2 1 345.487 3.322 20 5 EGBDMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169049141 1384100566 /nfs/dbraw/zinc/10/05/66/1384100566.db2.gz VZMXLPZCCOBEHL-VQIMIIECSA-N 2 1 349.450 3.167 20 5 EGBDMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169049141 1384100570 /nfs/dbraw/zinc/10/05/70/1384100570.db2.gz VZMXLPZCCOBEHL-VQIMIIECSA-N 2 1 349.450 3.167 20 5 EGBDMP CCCC[N@@H+](C)CCC[NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170297717 1384285003 /nfs/dbraw/zinc/28/50/03/1384285003.db2.gz QVSVUCYTDCVUBK-OAHLLOKOSA-N 2 1 337.464 3.246 20 5 EGBDMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000173359823 206918441 /nfs/dbraw/zinc/91/84/41/206918441.db2.gz SUAGQLDGADRDOI-XHSDSOJGSA-N 2 1 335.448 3.135 20 5 EGBDMP C[C@H]1C[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000344610643 144198229 /nfs/dbraw/zinc/19/82/29/144198229.db2.gz AYRUXAOPTKYLDT-UONOGXRCSA-N 2 1 329.400 3.427 20 5 EGBDMP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000344610643 144198230 /nfs/dbraw/zinc/19/82/30/144198230.db2.gz AYRUXAOPTKYLDT-UONOGXRCSA-N 2 1 329.400 3.427 20 5 EGBDMP C[C@@H]1C[N@H+](CCC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000278379262 275255854 /nfs/dbraw/zinc/25/58/54/275255854.db2.gz CXRCKPJZBHNEAY-BEFAXECRSA-N 2 1 347.459 3.063 20 5 EGBDMP C[C@@H]1C[N@@H+](CCC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000278379262 275255856 /nfs/dbraw/zinc/25/58/56/275255856.db2.gz CXRCKPJZBHNEAY-BEFAXECRSA-N 2 1 347.459 3.063 20 5 EGBDMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294297722 308208165 /nfs/dbraw/zinc/20/81/65/308208165.db2.gz NBYCUINBDDTDRK-DZKIICNBSA-N 2 1 346.475 3.481 20 5 EGBDMP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000414982179 309112800 /nfs/dbraw/zinc/11/28/00/309112800.db2.gz YPAYTQOHCUMMJA-KRWDZBQOSA-N 2 1 329.400 3.333 20 5 EGBDMP COCCC[NH+]1CCC([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000159132661 455355147 /nfs/dbraw/zinc/35/51/47/455355147.db2.gz SBZLJBIPMOUZOJ-OAHLLOKOSA-N 2 1 335.448 3.055 20 5 EGBDMP CCC[C@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000128431792 455055947 /nfs/dbraw/zinc/05/59/47/455055947.db2.gz CVPCDHJZAWUAPQ-IBGZPJMESA-N 2 1 348.491 3.053 20 5 EGBDMP CC(C)[NH+]1CCC([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000263755283 456213535 /nfs/dbraw/zinc/21/35/35/456213535.db2.gz TXXJYIKPOYVNKR-UHFFFAOYSA-N 2 1 335.448 3.168 20 5 EGBDMP C[C@@H]1C[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000435373699 458124870 /nfs/dbraw/zinc/12/48/70/458124870.db2.gz OCQDKMOWLQFUAC-OLZOCXBDSA-N 2 1 331.441 3.492 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+]3CC[C@H]([NH3+])[C@@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000435375912 458126292 /nfs/dbraw/zinc/12/62/92/458126292.db2.gz OWGVZRHYBLQJBZ-LRDDRELGSA-N 2 1 345.399 3.033 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@H]([NH3+])[C@@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000435375912 458126297 /nfs/dbraw/zinc/12/62/97/458126297.db2.gz OWGVZRHYBLQJBZ-LRDDRELGSA-N 2 1 345.399 3.033 20 5 EGBDMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1[NH3+] ZINC000435377359 458126530 /nfs/dbraw/zinc/12/65/30/458126530.db2.gz ARJHNTSVZKTHGH-DOMZBBRYSA-N 2 1 331.441 3.492 20 5 EGBDMP COc1ccc(-c2ccc(C[NH2+][C@@H]3CCC[NH2+]CC3)o2)c([N+](=O)[O-])c1 ZINC000591278482 459346166 /nfs/dbraw/zinc/34/61/66/459346166.db2.gz HVITWWUFWDJKHK-CYBMUJFWSA-N 2 1 345.399 3.095 20 5 EGBDMP C[C@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788541162 1305967671 /nfs/dbraw/zinc/96/76/71/1305967671.db2.gz XALXFMJGTMRPLC-ZNMIVQPWSA-N 2 1 334.464 3.196 20 5 EGBDMP C[C@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788541162 1305967678 /nfs/dbraw/zinc/96/76/78/1305967678.db2.gz XALXFMJGTMRPLC-ZNMIVQPWSA-N 2 1 334.464 3.196 20 5 EGBDMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)CC1 ZINC000809756019 1317892017 /nfs/dbraw/zinc/89/20/17/1317892017.db2.gz ODEHVIWRDIYWCW-AWEZNQCLSA-N 2 1 337.851 3.412 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168997734 1384083012 /nfs/dbraw/zinc/08/30/12/1384083012.db2.gz FGAOFLODUARSPD-WNHJNPCNSA-N 2 1 349.450 3.343 20 5 EGBDMP C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169001497 1384083634 /nfs/dbraw/zinc/08/36/34/1384083634.db2.gz GMBHNRGNBDADFH-LMCOJAPRSA-N 2 1 345.487 3.180 20 5 EGBDMP C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169001498 1384083664 /nfs/dbraw/zinc/08/36/64/1384083664.db2.gz GMBHNRGNBDADFH-RSPOEFSDSA-N 2 1 345.487 3.180 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2F)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168999919 1384084138 /nfs/dbraw/zinc/08/41/38/1384084138.db2.gz WGYPZXBQZYTZDG-VDHUWJSZSA-N 2 1 349.450 3.343 20 5 EGBDMP C[N@@H+](C1CC1)C1CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172918512 1384878404 /nfs/dbraw/zinc/87/84/04/1384878404.db2.gz BKBGPPUGHCTPSC-LJQANCHMSA-N 2 1 343.471 3.401 20 5 EGBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001173215313 1384937642 /nfs/dbraw/zinc/93/76/42/1384937642.db2.gz UTEFHMVKJMFHNW-IXDOHACOSA-N 2 1 333.476 3.483 20 5 EGBDMP COCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000159113392 225149646 /nfs/dbraw/zinc/14/96/46/225149646.db2.gz FYGMKJJEEUZKEA-HNNXBMFYSA-N 2 1 335.448 3.055 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]CCCn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000271143841 266609617 /nfs/dbraw/zinc/60/96/17/266609617.db2.gz OXMYMSNEYGSQIW-ZDUSSCGKSA-N 2 1 332.404 3.239 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCc3[nH+]ccn3C2)cc1[N+](=O)[O-] ZINC000278934859 275289123 /nfs/dbraw/zinc/28/91/23/275289123.db2.gz JMUMTAHKOBLJQJ-ZIAGYGMSSA-N 2 1 344.415 3.103 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCc3[nH+]ccn3C1)CCC2 ZINC000279025977 275296974 /nfs/dbraw/zinc/29/69/74/275296974.db2.gz VLJOHRFVDUROMQ-GUYCJALGSA-N 2 1 326.400 3.021 20 5 EGBDMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000279609685 275343866 /nfs/dbraw/zinc/34/38/66/275343866.db2.gz XGUMQDTWKJUFKR-XHDPSFHLSA-N 2 1 345.365 3.434 20 5 EGBDMP CC[N@H+]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000279609685 275343867 /nfs/dbraw/zinc/34/38/67/275343867.db2.gz XGUMQDTWKJUFKR-XHDPSFHLSA-N 2 1 345.365 3.434 20 5 EGBDMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C[C@H]12 ZINC000414669468 309094653 /nfs/dbraw/zinc/09/46/53/309094653.db2.gz KOASZKSHRQENJV-RRQGHBQHSA-N 2 1 343.452 3.492 20 5 EGBDMP COc1ccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000134903527 454607180 /nfs/dbraw/zinc/60/71/80/454607180.db2.gz PTBNGIWJAGJKDN-NVXWUHKLSA-N 2 1 345.443 3.052 20 5 EGBDMP CCCC[N@@H+](C)CC1CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000052210261 454660536 /nfs/dbraw/zinc/66/05/36/454660536.db2.gz JLUUTHIHHHPMPR-UHFFFAOYSA-N 2 1 349.475 3.418 20 5 EGBDMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000271488580 455656697 /nfs/dbraw/zinc/65/66/97/455656697.db2.gz KBYKQOOFDKNBNA-GDIGMMSISA-N 2 1 347.459 3.013 20 5 EGBDMP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271493895 455658913 /nfs/dbraw/zinc/65/89/13/455658913.db2.gz KVZHCZTXESYTSQ-IPMKNSEASA-N 2 1 347.459 3.013 20 5 EGBDMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272603610 456009882 /nfs/dbraw/zinc/00/98/82/456009882.db2.gz JJFXWXPFVPOYIG-TYNCELHUSA-N 2 1 325.840 3.109 20 5 EGBDMP CCC[C@H]([NH2+]CCN1CC[N@@H+](C)C(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000282429255 456509544 /nfs/dbraw/zinc/50/95/44/456509544.db2.gz TURNLINXMNBXQH-SFHVURJKSA-N 2 1 348.491 3.052 20 5 EGBDMP CC[N@H+]1CC[C@H]([NH+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000354209185 457131130 /nfs/dbraw/zinc/13/11/30/457131130.db2.gz QKMLURYKTZASKX-RDJZCZTQSA-N 2 1 335.448 3.168 20 5 EGBDMP CC[NH+]1CC[C@H]([N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000354209185 457131135 /nfs/dbraw/zinc/13/11/35/457131135.db2.gz QKMLURYKTZASKX-RDJZCZTQSA-N 2 1 335.448 3.168 20 5 EGBDMP CC[NH+]1CC[C@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000354209185 457131137 /nfs/dbraw/zinc/13/11/37/457131137.db2.gz QKMLURYKTZASKX-RDJZCZTQSA-N 2 1 335.448 3.168 20 5 EGBDMP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[NH2+]CC1 ZINC000435438992 458148637 /nfs/dbraw/zinc/14/86/37/458148637.db2.gz SHKWLTKQVYUVRO-OAHLLOKOSA-N 2 1 329.400 3.429 20 5 EGBDMP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000595015563 459216234 /nfs/dbraw/zinc/21/62/34/459216234.db2.gz ZBYLEQNKKZOVEU-OLZOCXBDSA-N 2 1 332.404 3.095 20 5 EGBDMP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596094026 459519042 /nfs/dbraw/zinc/51/90/42/459519042.db2.gz HBPFAERNHZBHAQ-MAUKXSAKSA-N 2 1 329.444 3.294 20 5 EGBDMP CC[C@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@@H]1[NH3+] ZINC000592427669 459598837 /nfs/dbraw/zinc/59/88/37/459598837.db2.gz PASSTOGJLPUYQP-GUYCJALGSA-N 2 1 329.400 3.414 20 5 EGBDMP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c(Cl)c1 ZINC000592433668 459600021 /nfs/dbraw/zinc/60/00/21/459600021.db2.gz OOAILWWNNBQFCW-UONOGXRCSA-N 2 1 337.851 3.460 20 5 EGBDMP CC[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000610818835 460241924 /nfs/dbraw/zinc/24/19/24/460241924.db2.gz HMCOQGQIUZJESO-OALUTQOASA-N 2 1 347.459 3.279 20 5 EGBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000876783240 1298981237 /nfs/dbraw/zinc/98/12/37/1298981237.db2.gz XKZRBCRXNQQVCC-QGZVFWFLSA-N 2 1 331.460 3.375 20 5 EGBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000876783240 1298981253 /nfs/dbraw/zinc/98/12/53/1298981253.db2.gz XKZRBCRXNQQVCC-QGZVFWFLSA-N 2 1 331.460 3.375 20 5 EGBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000876783240 1298981264 /nfs/dbraw/zinc/98/12/64/1298981264.db2.gz XKZRBCRXNQQVCC-QGZVFWFLSA-N 2 1 331.460 3.375 20 5 EGBDMP Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000876783240 1298981273 /nfs/dbraw/zinc/98/12/73/1298981273.db2.gz XKZRBCRXNQQVCC-QGZVFWFLSA-N 2 1 331.460 3.375 20 5 EGBDMP C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Br)C1CCC([NH3+])CC1 ZINC000923295017 1322726913 /nfs/dbraw/zinc/72/69/13/1322726913.db2.gz TZVWRFYKZGXHOC-UHFFFAOYSA-N 2 1 342.237 3.059 20 5 EGBDMP C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169001496 1384084015 /nfs/dbraw/zinc/08/40/15/1384084015.db2.gz GMBHNRGNBDADFH-GTAWCEEGSA-N 2 1 345.487 3.180 20 5 EGBDMP CC1([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)CC[NH+](Cc2ccccc2)CC1 ZINC001169006801 1384086164 /nfs/dbraw/zinc/08/61/64/1384086164.db2.gz ZCPHEALURJMGIL-ROUUACIJSA-N 2 1 331.460 3.076 20 5 EGBDMP CC[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000133054958 529681645 /nfs/dbraw/zinc/68/16/45/529681645.db2.gz QJJTZOSCXIUCHU-HNAYVOBHSA-N 2 1 347.459 3.136 20 5 EGBDMP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000278564538 268040021 /nfs/dbraw/zinc/04/00/21/268040021.db2.gz PGQODKDXQBJHDC-DLBZAZTESA-N 2 1 349.475 3.006 20 5 EGBDMP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC000278564538 268040024 /nfs/dbraw/zinc/04/00/24/268040024.db2.gz PGQODKDXQBJHDC-DLBZAZTESA-N 2 1 349.475 3.006 20 5 EGBDMP C[C@@]1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCC[NH2+]C1 ZINC000414897057 309107999 /nfs/dbraw/zinc/10/79/99/309107999.db2.gz DAOWRIKRPUYJOJ-GOSISDBHSA-N 2 1 329.400 3.334 20 5 EGBDMP O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CC[NH2+]C2CCCCCC2)n1 ZINC000423282995 309394040 /nfs/dbraw/zinc/39/40/40/309394040.db2.gz VNUIAPHYJUAKCD-IRXDYDNUSA-N 2 1 349.479 3.177 20 5 EGBDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000449212950 310044949 /nfs/dbraw/zinc/04/49/49/310044949.db2.gz UMSMKTSIXNDRNB-DLBZAZTESA-N 2 1 333.476 3.483 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000513831482 312218623 /nfs/dbraw/zinc/21/86/23/312218623.db2.gz SAIGIKPQLVRFAP-CYGHRXIMSA-N 2 1 331.460 3.378 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000513831482 312218624 /nfs/dbraw/zinc/21/86/24/312218624.db2.gz SAIGIKPQLVRFAP-CYGHRXIMSA-N 2 1 331.460 3.378 20 5 EGBDMP Cc1[nH+]ccn1CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290911392 456464666 /nfs/dbraw/zinc/46/46/66/456464666.db2.gz PFVQNMKAEVZYHT-UHFFFAOYSA-N 2 1 329.187 3.196 20 5 EGBDMP CC[NH+](CC)C[C@@H]1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000076004337 453948594 /nfs/dbraw/zinc/94/85/94/453948594.db2.gz VLMOAKYYNUBFKR-INIZCTEOSA-N 2 1 335.448 3.027 20 5 EGBDMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000076004337 453948595 /nfs/dbraw/zinc/94/85/95/453948595.db2.gz VLMOAKYYNUBFKR-INIZCTEOSA-N 2 1 335.448 3.027 20 5 EGBDMP Cc1c(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134903135 454606988 /nfs/dbraw/zinc/60/69/88/454606988.db2.gz XTWNZOFQXXOLLZ-VQIMIIECSA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134903135 454606992 /nfs/dbraw/zinc/60/69/92/454606992.db2.gz XTWNZOFQXXOLLZ-VQIMIIECSA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134903135 454606995 /nfs/dbraw/zinc/60/69/95/454606995.db2.gz XTWNZOFQXXOLLZ-VQIMIIECSA-N 2 1 329.444 3.352 20 5 EGBDMP Cc1c(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134903135 454606997 /nfs/dbraw/zinc/60/69/97/454606997.db2.gz XTWNZOFQXXOLLZ-VQIMIIECSA-N 2 1 329.444 3.352 20 5 EGBDMP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596058801 459503618 /nfs/dbraw/zinc/50/36/18/459503618.db2.gz JLXBEVNPKOLIDR-KNYPUDEUSA-N 2 1 329.444 3.320 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592492590 459613639 /nfs/dbraw/zinc/61/36/39/459613639.db2.gz BGIIZXHSFZDHPD-KGLIPLIRSA-N 2 1 337.851 3.460 20 5 EGBDMP O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000765845225 1302339130 /nfs/dbraw/zinc/33/91/30/1302339130.db2.gz NPPNDQRHMDOPRS-LJQANCHMSA-N 2 1 347.459 3.015 20 5 EGBDMP CC[N@@H+](CCC1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1)CC1CC1 ZINC000886102465 1303355855 /nfs/dbraw/zinc/35/58/55/1303355855.db2.gz IAEOQEBGXFEAGE-UHFFFAOYSA-N 2 1 346.475 3.324 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001168961622 1384071336 /nfs/dbraw/zinc/07/13/36/1384071336.db2.gz JEWSWXIUMXEFRN-LTFPLMDUSA-N 2 1 343.471 3.217 20 5 EGBDMP C[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169040361 1384098432 /nfs/dbraw/zinc/09/84/32/1384098432.db2.gz ZJBSHDLCFGHDPT-WOJBJXKFSA-N 2 1 345.487 3.276 20 5 EGBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC[N@H+](CC2CCCC2)C1 ZINC001173221406 1384938420 /nfs/dbraw/zinc/93/84/20/1384938420.db2.gz MZVYFTMXDNLCQV-YJBOKZPZSA-N 2 1 331.460 3.380 20 5 EGBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC001173221406 1384938424 /nfs/dbraw/zinc/93/84/24/1384938424.db2.gz MZVYFTMXDNLCQV-YJBOKZPZSA-N 2 1 331.460 3.380 20 5 EGBDMP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000268540924 252007248 /nfs/dbraw/zinc/00/72/48/252007248.db2.gz KWRLTHKBTWWYKK-INIZCTEOSA-N 2 1 347.459 3.312 20 5 EGBDMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000268540924 252007250 /nfs/dbraw/zinc/00/72/50/252007250.db2.gz KWRLTHKBTWWYKK-INIZCTEOSA-N 2 1 347.459 3.312 20 5 EGBDMP CCC[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cccc([N+](=O)[O-])c1 ZINC000278941325 275289700 /nfs/dbraw/zinc/28/97/00/275289700.db2.gz KDZMGACJKADKKL-RHSMWYFYSA-N 2 1 328.416 3.485 20 5 EGBDMP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000414928596 309109855 /nfs/dbraw/zinc/10/98/55/309109855.db2.gz QIKRQFUREOXYJB-CHWSQXEVSA-N 2 1 332.429 3.078 20 5 EGBDMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1C[NH3+] ZINC000415126979 309122443 /nfs/dbraw/zinc/12/24/43/309122443.db2.gz MREUZMYRPOFKOS-HIFRSBDPSA-N 2 1 329.400 3.272 20 5 EGBDMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C[NH3+] ZINC000415131418 309122737 /nfs/dbraw/zinc/12/27/37/309122737.db2.gz SFIYNDXOKAUVPS-DZGCQCFKSA-N 2 1 329.400 3.272 20 5 EGBDMP CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420322017 309282005 /nfs/dbraw/zinc/28/20/05/309282005.db2.gz DQPXWMJWFUEHGR-JKSUJKDBSA-N 2 1 347.459 3.204 20 5 EGBDMP CC[NH+](CC)CCO[C@@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490030515 311130302 /nfs/dbraw/zinc/13/03/02/311130302.db2.gz LVRNYVNYTPLMKS-FUHWJXTLSA-N 2 1 349.475 3.397 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000513831483 312218598 /nfs/dbraw/zinc/21/85/98/312218598.db2.gz SAIGIKPQLVRFAP-JOCBIADPSA-N 2 1 331.460 3.378 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000513831483 312218599 /nfs/dbraw/zinc/21/85/99/312218599.db2.gz SAIGIKPQLVRFAP-JOCBIADPSA-N 2 1 331.460 3.378 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000132959850 454380598 /nfs/dbraw/zinc/38/05/98/454380598.db2.gz NRRPRLAWJFIVBN-HOTGVXAUSA-N 2 1 347.459 3.055 20 5 EGBDMP C[N@H+](CC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CCCC1 ZINC000133203307 454400699 /nfs/dbraw/zinc/40/06/99/454400699.db2.gz VREDFGXBPMFRIJ-GOSISDBHSA-N 2 1 331.460 3.380 20 5 EGBDMP C[N@@H+](CC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CCCC1 ZINC000133203307 454400702 /nfs/dbraw/zinc/40/07/02/454400702.db2.gz VREDFGXBPMFRIJ-GOSISDBHSA-N 2 1 331.460 3.380 20 5 EGBDMP COc1ccc(CN(C)CCC[N@H+](C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000285568959 455872318 /nfs/dbraw/zinc/87/23/18/455872318.db2.gz HTLHVOIUGOUUQV-UHFFFAOYSA-N 2 1 347.415 3.150 20 5 EGBDMP COc1ccc(CN(C)CCC[N@@H+](C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000285568959 455872321 /nfs/dbraw/zinc/87/23/21/455872321.db2.gz HTLHVOIUGOUUQV-UHFFFAOYSA-N 2 1 347.415 3.150 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000311076014 456585748 /nfs/dbraw/zinc/58/57/48/456585748.db2.gz AOBRSEKRSHHBFU-LJQANCHMSA-N 2 1 339.439 3.249 20 5 EGBDMP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000430133680 458408225 /nfs/dbraw/zinc/40/82/25/458408225.db2.gz QARYXSKWMAHFHC-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000430133680 458408228 /nfs/dbraw/zinc/40/82/28/458408228.db2.gz QARYXSKWMAHFHC-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000430133680 458408231 /nfs/dbraw/zinc/40/82/31/458408231.db2.gz QARYXSKWMAHFHC-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000430133680 458408235 /nfs/dbraw/zinc/40/82/35/458408235.db2.gz QARYXSKWMAHFHC-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP CC[N@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000495431167 458854928 /nfs/dbraw/zinc/85/49/28/458854928.db2.gz BBEQUAKWYCWIBD-SWLSCSKDSA-N 2 1 325.840 3.111 20 5 EGBDMP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000595015255 459216333 /nfs/dbraw/zinc/21/63/33/459216333.db2.gz ZBYLEQNKKZOVEU-CHWSQXEVSA-N 2 1 332.404 3.095 20 5 EGBDMP CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@H]1[NH3+] ZINC000592427552 459598678 /nfs/dbraw/zinc/59/86/78/459598678.db2.gz BTHHOUODAFAISU-CXAGYDPISA-N 2 1 329.400 3.414 20 5 EGBDMP C[N@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC1CC[NH+](C)CC1 ZINC000602462941 459951201 /nfs/dbraw/zinc/95/12/01/459951201.db2.gz QAVROVUYQHGMNN-UHFFFAOYSA-N 2 1 345.365 3.387 20 5 EGBDMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602512539 459976808 /nfs/dbraw/zinc/97/68/08/459976808.db2.gz CBJALVSZHGQKCG-AWEZNQCLSA-N 2 1 346.431 3.480 20 5 EGBDMP CCCC[N@@H+](C)CC1CC[NH+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000603856884 460349708 /nfs/dbraw/zinc/34/97/08/460349708.db2.gz AIJRVFWGSQHQRF-UHFFFAOYSA-N 2 1 349.475 3.418 20 5 EGBDMP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000887133348 1303686001 /nfs/dbraw/zinc/68/60/01/1303686001.db2.gz ZGWAFUOUKVSTTM-CABCVRRESA-N 2 1 326.400 3.262 20 5 EGBDMP C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000887133348 1303686004 /nfs/dbraw/zinc/68/60/04/1303686004.db2.gz ZGWAFUOUKVSTTM-CABCVRRESA-N 2 1 326.400 3.262 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)c(CNC2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)c1 ZINC000903127106 1317659005 /nfs/dbraw/zinc/65/90/05/1317659005.db2.gz VVVNIXBMVOCMGU-LQDVMPOASA-N 2 1 335.835 3.496 20 5 EGBDMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169046375 1384100350 /nfs/dbraw/zinc/10/03/50/1384100350.db2.gz LNHRGAQQGKTICD-LPHOPBHVSA-N 2 1 349.450 3.167 20 5 EGBDMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169046375 1384100355 /nfs/dbraw/zinc/10/03/55/1384100355.db2.gz LNHRGAQQGKTICD-LPHOPBHVSA-N 2 1 349.450 3.167 20 5 EGBDMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170318955 1384290186 /nfs/dbraw/zinc/29/01/86/1384290186.db2.gz TYDNXIBOQVPTDB-ZBFHGGJFSA-N 2 1 349.475 3.387 20 5 EGBDMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170318955 1384290192 /nfs/dbraw/zinc/29/01/92/1384290192.db2.gz TYDNXIBOQVPTDB-ZBFHGGJFSA-N 2 1 349.475 3.387 20 5 EGBDMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172913627 1384876497 /nfs/dbraw/zinc/87/64/97/1384876497.db2.gz XXEANJBEKCQZNU-AKHDSKFASA-N 2 1 343.471 3.447 20 5 EGBDMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172913627 1384876508 /nfs/dbraw/zinc/87/65/08/1384876508.db2.gz XXEANJBEKCQZNU-AKHDSKFASA-N 2 1 343.471 3.447 20 5 EGBDMP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C1=CCC[N@@H+](C)C1 ZINC001175578227 1385337514 /nfs/dbraw/zinc/33/75/14/1385337514.db2.gz IWDCEUXZAFPTEJ-UHFFFAOYSA-N 2 1 348.450 3.431 20 5 EGBDMP C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185723447 455605819 /nfs/dbraw/zinc/60/58/19/455605819.db2.gz UPZFKNOMHIPFLB-JKSUJKDBSA-N 2 1 347.459 3.216 20 5 EGBDMP Cc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000278375615 455833759 /nfs/dbraw/zinc/83/37/59/455833759.db2.gz CCOKUQKLIUWBRC-JKSUJKDBSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000278375615 455833763 /nfs/dbraw/zinc/83/37/63/455833763.db2.gz CCOKUQKLIUWBRC-JKSUJKDBSA-N 2 1 335.448 3.055 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000277303443 456769424 /nfs/dbraw/zinc/76/94/24/456769424.db2.gz UJBJRWOYZYBUAT-UHFFFAOYSA-N 2 1 346.431 3.145 20 5 EGBDMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000277303443 456769430 /nfs/dbraw/zinc/76/94/30/456769430.db2.gz UJBJRWOYZYBUAT-UHFFFAOYSA-N 2 1 346.431 3.145 20 5 EGBDMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447506509 458300582 /nfs/dbraw/zinc/30/05/82/458300582.db2.gz CXYMHJRXORGIII-BRWVUGGUSA-N 2 1 349.479 3.129 20 5 EGBDMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447506512 458302017 /nfs/dbraw/zinc/30/20/17/458302017.db2.gz CXYMHJRXORGIII-ZACQAIPSSA-N 2 1 349.479 3.129 20 5 EGBDMP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000430134656 458407677 /nfs/dbraw/zinc/40/76/77/458407677.db2.gz REQXWBQRBJRBBE-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000430134656 458407681 /nfs/dbraw/zinc/40/76/81/458407681.db2.gz REQXWBQRBJRBBE-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000430134656 458407683 /nfs/dbraw/zinc/40/76/83/458407683.db2.gz REQXWBQRBJRBBE-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000430134656 458407686 /nfs/dbraw/zinc/40/76/86/458407686.db2.gz REQXWBQRBJRBBE-IBGZPJMESA-N 2 1 341.411 3.382 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000470170697 458620750 /nfs/dbraw/zinc/62/07/50/458620750.db2.gz ZFIGHXAIUJNREK-IFGOMPEGSA-N 2 1 329.444 3.414 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000470170697 458620754 /nfs/dbraw/zinc/62/07/54/458620754.db2.gz ZFIGHXAIUJNREK-IFGOMPEGSA-N 2 1 329.444 3.414 20 5 EGBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000534328441 459315881 /nfs/dbraw/zinc/31/58/81/459315881.db2.gz IRZURNGJVHOWGA-GJZGRUSLSA-N 2 1 337.489 3.397 20 5 EGBDMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000610818831 460241946 /nfs/dbraw/zinc/24/19/46/460241946.db2.gz GQQNVAAQIHRARV-MAUKXSAKSA-N 2 1 347.459 3.197 20 5 EGBDMP C[N@@H+]1CCC[C@]2(CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)C1 ZINC000601169679 460740375 /nfs/dbraw/zinc/74/03/75/460740375.db2.gz PCIZDFPQFRFIGZ-SFHVURJKSA-N 2 1 326.400 3.065 20 5 EGBDMP C[N@H+]1CCC[C@]2(CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)C1 ZINC000601169679 460740378 /nfs/dbraw/zinc/74/03/78/460740378.db2.gz PCIZDFPQFRFIGZ-SFHVURJKSA-N 2 1 326.400 3.065 20 5 EGBDMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153753050 528338060 /nfs/dbraw/zinc/33/80/60/528338060.db2.gz AUCFTNHLEZGYQB-IBGZPJMESA-N 2 1 349.475 3.072 20 5 EGBDMP Cc1[nH]c(C2CC[NH+](CCOc3ccccc3[N+](=O)[O-])CC2)[nH+]c1C ZINC000886668623 1303549342 /nfs/dbraw/zinc/54/93/42/1303549342.db2.gz WIUKLIJSAVFMGH-UHFFFAOYSA-N 2 1 344.415 3.193 20 5 EGBDMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815559754 1319014859 /nfs/dbraw/zinc/01/48/59/1319014859.db2.gz PFVOASKBXZMGHK-HUUCEWRRSA-N 2 1 334.464 3.482 20 5 EGBDMP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000866393435 1330106040 /nfs/dbraw/zinc/10/60/40/1330106040.db2.gz OEBAPHCGUBDWBN-HOCLYGCPSA-N 2 1 349.450 3.377 20 5 EGBDMP CCCC(C[NH3+])(CCC)Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001163041015 1382953766 /nfs/dbraw/zinc/95/37/66/1382953766.db2.gz ZSGAQGQWMIBKRZ-JXMROGBWSA-N 2 1 335.452 3.232 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169000867 1384083986 /nfs/dbraw/zinc/08/39/86/1384083986.db2.gz YZEXOACFLYXCER-DSLXNQLJSA-N 2 1 349.450 3.343 20 5 EGBDMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170318954 1384289736 /nfs/dbraw/zinc/28/97/36/1384289736.db2.gz TYDNXIBOQVPTDB-HOCLYGCPSA-N 2 1 349.475 3.387 20 5 EGBDMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170318954 1384289739 /nfs/dbraw/zinc/28/97/39/1384289739.db2.gz TYDNXIBOQVPTDB-HOCLYGCPSA-N 2 1 349.475 3.387 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)CC[C@H](n1c[nH+]cc1C1CC[NH2+]CC1)CC2 ZINC001172919300 1384878231 /nfs/dbraw/zinc/87/82/31/1384878231.db2.gz FMXCSIPWVNCZSK-QGZVFWFLSA-N 2 1 340.427 3.378 20 5 EGBDMP C[C@H]1C[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000344610632 144198021 /nfs/dbraw/zinc/19/80/21/144198021.db2.gz AYRUXAOPTKYLDT-KBPBESRZSA-N 2 1 329.400 3.427 20 5 EGBDMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000344610632 144198022 /nfs/dbraw/zinc/19/80/22/144198022.db2.gz AYRUXAOPTKYLDT-KBPBESRZSA-N 2 1 329.400 3.427 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000344792447 144225336 /nfs/dbraw/zinc/22/53/36/144225336.db2.gz MSIMUQPFQXIPFF-KQGZCTBQSA-N 2 1 328.416 3.429 20 5 EGBDMP Cc1c([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000278385797 268000947 /nfs/dbraw/zinc/00/09/47/268000947.db2.gz CNVGXATZDRWYFW-GDBMZVCRSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1c([C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000278385797 268000951 /nfs/dbraw/zinc/00/09/51/268000951.db2.gz CNVGXATZDRWYFW-GDBMZVCRSA-N 2 1 335.448 3.055 20 5 EGBDMP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000347019989 277283295 /nfs/dbraw/zinc/28/32/95/277283295.db2.gz MOEPJHIPPGSVPU-CQSZACIVSA-N 2 1 329.400 3.286 20 5 EGBDMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000347019989 277283297 /nfs/dbraw/zinc/28/32/97/277283297.db2.gz MOEPJHIPPGSVPU-CQSZACIVSA-N 2 1 329.400 3.286 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]4C[NH2+]C[C@@H]4C3)s2)cc1 ZINC000579719034 325150682 /nfs/dbraw/zinc/15/06/82/325150682.db2.gz RGVOJRUPEQIOPY-HUUCEWRRSA-N 2 1 343.452 3.365 20 5 EGBDMP O=[N+]([O-])c1ccc(OC2CC[NH+](CCC[NH+]3CCCCC3)CC2)cc1 ZINC000161316393 455558209 /nfs/dbraw/zinc/55/82/09/455558209.db2.gz FSHBMSNEYYKBTG-UHFFFAOYSA-N 2 1 347.459 3.314 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000248173144 455693532 /nfs/dbraw/zinc/69/35/32/455693532.db2.gz VDFQQSFDRLIMFD-FCEWJHQRSA-N 2 1 349.475 3.382 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000248173144 455693538 /nfs/dbraw/zinc/69/35/38/455693538.db2.gz VDFQQSFDRLIMFD-FCEWJHQRSA-N 2 1 349.475 3.382 20 5 EGBDMP CCOc1cc(C[N@H+](C)CCCn2cc[nH+]c2C)ccc1[N+](=O)[O-] ZINC000276908591 456616457 /nfs/dbraw/zinc/61/64/57/456616457.db2.gz MVUGKRACPDCPAY-UHFFFAOYSA-N 2 1 332.404 3.021 20 5 EGBDMP CCOc1cc(C[N@@H+](C)CCCn2cc[nH+]c2C)ccc1[N+](=O)[O-] ZINC000276908591 456616463 /nfs/dbraw/zinc/61/64/63/456616463.db2.gz MVUGKRACPDCPAY-UHFFFAOYSA-N 2 1 332.404 3.021 20 5 EGBDMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1[NH3+] ZINC000435373292 458124618 /nfs/dbraw/zinc/12/46/18/458124618.db2.gz DGJZOMYZBXCHMR-BLLLJJGKSA-N 2 1 331.441 3.492 20 5 EGBDMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1[NH3+] ZINC000435377361 458126896 /nfs/dbraw/zinc/12/68/96/458126896.db2.gz ARJHNTSVZKTHGH-SWLSCSKDSA-N 2 1 331.441 3.492 20 5 EGBDMP CC(C)[C@H]([NH3+])CC[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000430572308 458463497 /nfs/dbraw/zinc/46/34/97/458463497.db2.gz FJWPZGBHOMEBNY-MRXNPFEDSA-N 2 1 346.431 3.098 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592433670 459599942 /nfs/dbraw/zinc/59/99/42/459599942.db2.gz PEXDCNMOCBTFAM-CVEARBPZSA-N 2 1 347.459 3.205 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592492591 459612962 /nfs/dbraw/zinc/61/29/62/459612962.db2.gz BGIIZXHSFZDHPD-UONOGXRCSA-N 2 1 337.851 3.460 20 5 EGBDMP Cc1cc(N[C@H]2C[N@H+](C)Cc3ccccc32)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000543047073 459619283 /nfs/dbraw/zinc/61/92/83/459619283.db2.gz PADZZCZYPSJDFC-FQEVSTJZSA-N 2 1 348.406 3.472 20 5 EGBDMP Cn1c[nH+]cc1CCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000594005771 460051871 /nfs/dbraw/zinc/05/18/71/460051871.db2.gz NUZOOENUOGWWIW-MRXNPFEDSA-N 2 1 328.416 3.141 20 5 EGBDMP Cn1c[nH+]cc1CCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000594005771 460051877 /nfs/dbraw/zinc/05/18/77/460051877.db2.gz NUZOOENUOGWWIW-MRXNPFEDSA-N 2 1 328.416 3.141 20 5 EGBDMP CC[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000610818834 460242227 /nfs/dbraw/zinc/24/22/27/460242227.db2.gz HMCOQGQIUZJESO-MOPGFXCFSA-N 2 1 347.459 3.279 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@@H](CC[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000904404738 1317843918 /nfs/dbraw/zinc/84/39/18/1317843918.db2.gz FHOAPUSBZSLSPX-CYBMUJFWSA-N 2 1 345.399 3.034 20 5 EGBDMP [NH3+]C[C@H]1C[N@@H+](Cc2c3ccccc3c3cc4ccccc4oc2-3)C[C@@H]1O ZINC001206530346 1371084996 /nfs/dbraw/zinc/08/49/96/1371084996.db2.gz GGZLPTFPIWBHGD-YWZLYKJASA-N 2 1 346.430 3.442 20 5 EGBDMP C[NH+](C)/C=C/c1cc(N2C(C)(C)CC([NH3+])CC2(C)C)ncc1[N+](=O)[O-] ZINC001156775570 1380632664 /nfs/dbraw/zinc/63/26/64/1380632664.db2.gz VTSLWBZDRNZSPE-BQYQJAHWSA-N 2 1 347.463 3.007 20 5 EGBDMP O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001169018929 1384091485 /nfs/dbraw/zinc/09/14/85/1384091485.db2.gz DQHRLVKTTZTHPR-FUHWJXTLSA-N 2 1 347.459 3.013 20 5 EGBDMP C[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169040358 1384097984 /nfs/dbraw/zinc/09/79/84/1384097984.db2.gz ZJBSHDLCFGHDPT-PMACEKPBSA-N 2 1 345.487 3.276 20 5 EGBDMP COc1ccc(C[C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170307592 1384287099 /nfs/dbraw/zinc/28/70/99/1384287099.db2.gz HWVSWCMQCWLLRE-CVEARBPZSA-N 2 1 349.475 3.389 20 5 EGBDMP Cc1c([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cccc1[N+](=O)[O-] ZINC000132961895 223377012 /nfs/dbraw/zinc/37/70/12/223377012.db2.gz SHFABLLCWMPKEU-JKSUJKDBSA-N 2 1 347.459 3.055 20 5 EGBDMP O=[N+]([O-])c1ccccc1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000192920340 153266778 /nfs/dbraw/zinc/26/67/78/153266778.db2.gz FOZBDSFRPGXFKK-QGZVFWFLSA-N 2 1 325.412 3.207 20 5 EGBDMP O=[N+]([O-])c1ccccc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192920340 153266784 /nfs/dbraw/zinc/26/67/84/153266784.db2.gz FOZBDSFRPGXFKK-QGZVFWFLSA-N 2 1 325.412 3.207 20 5 EGBDMP C[C@@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423423704 309399821 /nfs/dbraw/zinc/39/98/21/309399821.db2.gz DVNQWILHJKSXQG-XPZRHXQJSA-N 2 1 329.425 3.192 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+]3CC[C@@H]([NH3+])C[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000571578019 317218982 /nfs/dbraw/zinc/21/89/82/317218982.db2.gz DCXXQXDGAUPFJW-QWHCGFSZSA-N 2 1 345.399 3.175 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@@H]([NH3+])C[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000571578019 317218985 /nfs/dbraw/zinc/21/89/85/317218985.db2.gz DCXXQXDGAUPFJW-QWHCGFSZSA-N 2 1 345.399 3.175 20 5 EGBDMP CCC[N@H+](C)C[C@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601120316 460718363 /nfs/dbraw/zinc/71/83/63/460718363.db2.gz JSISTBXJSSXSIR-CQSZACIVSA-N 2 1 328.416 3.311 20 5 EGBDMP CCC[N@@H+](C)C[C@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601120316 460718369 /nfs/dbraw/zinc/71/83/69/460718369.db2.gz JSISTBXJSSXSIR-CQSZACIVSA-N 2 1 328.416 3.311 20 5 EGBDMP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596058802 459503858 /nfs/dbraw/zinc/50/38/58/459503858.db2.gz JLXBEVNPKOLIDR-OPQSBORISA-N 2 1 329.444 3.320 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)s1 ZINC000574638091 459846115 /nfs/dbraw/zinc/84/61/15/459846115.db2.gz KVERDKRFHFOTIK-UONOGXRCSA-N 2 1 343.452 3.365 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]3C[NH2+]C[C@@H]3C2)s1 ZINC000574638091 459846120 /nfs/dbraw/zinc/84/61/20/459846120.db2.gz KVERDKRFHFOTIK-UONOGXRCSA-N 2 1 343.452 3.365 20 5 EGBDMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602687348 460067318 /nfs/dbraw/zinc/06/73/18/460067318.db2.gz KEFXNBAHUHMLPE-LBPRGKRZSA-N 2 1 345.365 3.435 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3C[C@H]4C[NH2+]C[C@@H]4C3)o2)c(Cl)c1 ZINC000611287813 460330521 /nfs/dbraw/zinc/33/05/21/460330521.db2.gz PKVUXWYJZONPIQ-VXGBXAGGSA-N 2 1 347.802 3.159 20 5 EGBDMP CC(C)[NH+]1CCC(CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)CC1 ZINC001156501374 1380584693 /nfs/dbraw/zinc/58/46/93/1380584693.db2.gz NLHHYVSZRZNQPK-BQYQJAHWSA-N 2 1 347.463 3.054 20 5 EGBDMP CC(C)[NH+]1CCC(CNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)CC1 ZINC001166635776 1383451233 /nfs/dbraw/zinc/45/12/33/1383451233.db2.gz GNDJUKMWMGBBKR-UHFFFAOYSA-N 2 1 346.475 3.115 20 5 EGBDMP CC(C)[NH+]1CCC(CNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)CC1 ZINC001166635776 1383451235 /nfs/dbraw/zinc/45/12/35/1383451235.db2.gz GNDJUKMWMGBBKR-UHFFFAOYSA-N 2 1 346.475 3.115 20 5 EGBDMP O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)o1 ZINC001319841505 1386329691 /nfs/dbraw/zinc/32/96/91/1386329691.db2.gz JACQXDRSFNUDMZ-RYUDHWBXSA-N 2 1 347.802 3.159 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000349127710 156361580 /nfs/dbraw/zinc/36/15/80/156361580.db2.gz JCDQWLGCBSFXNX-MRXNPFEDSA-N 2 1 347.459 3.157 20 5 EGBDMP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000278564540 268039663 /nfs/dbraw/zinc/03/96/63/268039663.db2.gz PGQODKDXQBJHDC-IAGOWNOFSA-N 2 1 349.475 3.006 20 5 EGBDMP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC000278564540 268039666 /nfs/dbraw/zinc/03/96/66/268039666.db2.gz PGQODKDXQBJHDC-IAGOWNOFSA-N 2 1 349.475 3.006 20 5 EGBDMP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000278564546 268040608 /nfs/dbraw/zinc/04/06/08/268040608.db2.gz PGQODKDXQBJHDC-SJORKVTESA-N 2 1 349.475 3.006 20 5 EGBDMP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC000278564546 268040611 /nfs/dbraw/zinc/04/06/11/268040611.db2.gz PGQODKDXQBJHDC-SJORKVTESA-N 2 1 349.475 3.006 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000571955451 317270981 /nfs/dbraw/zinc/27/09/81/317270981.db2.gz MHANURQILPDKSW-JKSUJKDBSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC000571955451 317270982 /nfs/dbraw/zinc/27/09/82/317270982.db2.gz MHANURQILPDKSW-JKSUJKDBSA-N 2 1 335.448 3.055 20 5 EGBDMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000581071179 325326978 /nfs/dbraw/zinc/32/69/78/325326978.db2.gz HMZLQKVEIFWMPB-ZDUSSCGKSA-N 2 1 331.441 3.494 20 5 EGBDMP Cc1cc(NC[C@@H]2CC[N@H+](C3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000326375079 456693065 /nfs/dbraw/zinc/69/30/65/456693065.db2.gz WJUWKBSZZOEOQR-ZDUSSCGKSA-N 2 1 326.400 3.348 20 5 EGBDMP C[C@@H]1C[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000435368841 458120794 /nfs/dbraw/zinc/12/07/94/458120794.db2.gz CESIZNXTLUBVFU-OLZOCXBDSA-N 2 1 331.441 3.492 20 5 EGBDMP C[C@@H]1C[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000435368839 458121167 /nfs/dbraw/zinc/12/11/67/458121167.db2.gz CESIZNXTLUBVFU-CHWSQXEVSA-N 2 1 331.441 3.492 20 5 EGBDMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435399127 458137164 /nfs/dbraw/zinc/13/71/64/458137164.db2.gz VLKYIBLBAJCXCB-ZDUSSCGKSA-N 2 1 331.441 3.494 20 5 EGBDMP C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC[C@H]1CCCC[NH+]1C ZINC000441330105 458920916 /nfs/dbraw/zinc/92/09/16/458920916.db2.gz LGGMIEYBCYJHAD-MRXNPFEDSA-N 2 1 335.448 3.170 20 5 EGBDMP C[NH+](CCCOc1ccc([N+](=O)[O-])cc1)CC[C@H]1CCCC[N@@H+]1C ZINC000441330105 458920919 /nfs/dbraw/zinc/92/09/19/458920919.db2.gz LGGMIEYBCYJHAD-MRXNPFEDSA-N 2 1 335.448 3.170 20 5 EGBDMP C[NH+](CCCOc1ccc([N+](=O)[O-])cc1)CC[C@H]1CCCC[N@H+]1C ZINC000441330105 458920923 /nfs/dbraw/zinc/92/09/23/458920923.db2.gz LGGMIEYBCYJHAD-MRXNPFEDSA-N 2 1 335.448 3.170 20 5 EGBDMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886040792 1303330807 /nfs/dbraw/zinc/33/08/07/1303330807.db2.gz DIYMFPJEPVKCKT-INIZCTEOSA-N 2 1 346.475 3.466 20 5 EGBDMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886040792 1303330815 /nfs/dbraw/zinc/33/08/15/1303330815.db2.gz DIYMFPJEPVKCKT-INIZCTEOSA-N 2 1 346.475 3.466 20 5 EGBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000859211893 1328947051 /nfs/dbraw/zinc/94/70/51/1328947051.db2.gz CBPRJQCWJGZRDB-UHFFFAOYSA-N 2 1 331.391 3.428 20 5 EGBDMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168998251 1384083206 /nfs/dbraw/zinc/08/32/06/1384083206.db2.gz KNPVVEUXIYVFMP-FHWLQOOXSA-N 2 1 345.487 3.322 20 5 EGBDMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168998251 1384083214 /nfs/dbraw/zinc/08/32/14/1384083214.db2.gz KNPVVEUXIYVFMP-FHWLQOOXSA-N 2 1 345.487 3.322 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC)C2)cc1[N+](=O)[O-] ZINC001336874899 1389193063 /nfs/dbraw/zinc/19/30/63/1389193063.db2.gz WVZUTCHMLCNCNP-HUUCEWRRSA-N 2 1 335.448 3.376 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC)C2)cc1[N+](=O)[O-] ZINC001336874899 1389193067 /nfs/dbraw/zinc/19/30/67/1389193067.db2.gz WVZUTCHMLCNCNP-HUUCEWRRSA-N 2 1 335.448 3.376 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC)C2)cc1[N+](=O)[O-] ZINC001336874896 1389193388 /nfs/dbraw/zinc/19/33/88/1389193388.db2.gz WVZUTCHMLCNCNP-CABCVRRESA-N 2 1 335.448 3.376 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC)C2)cc1[N+](=O)[O-] ZINC001336874896 1389193393 /nfs/dbraw/zinc/19/33/93/1389193393.db2.gz WVZUTCHMLCNCNP-CABCVRRESA-N 2 1 335.448 3.376 20 5 EGBDMP C[NH2+][C@@H](C)CC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC001331419836 1389740484 /nfs/dbraw/zinc/74/04/84/1389740484.db2.gz SPJARZPRZINLAR-HNNXBMFYSA-N 2 1 342.443 3.450 20 5 EGBDMP C[C@@H]1C[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000344610638 144198008 /nfs/dbraw/zinc/19/80/08/144198008.db2.gz AYRUXAOPTKYLDT-KGLIPLIRSA-N 2 1 329.400 3.427 20 5 EGBDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1C ZINC000344610638 144198009 /nfs/dbraw/zinc/19/80/09/144198009.db2.gz AYRUXAOPTKYLDT-KGLIPLIRSA-N 2 1 329.400 3.427 20 5 EGBDMP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000449101613 310037199 /nfs/dbraw/zinc/03/71/99/310037199.db2.gz FYYISUNYANEUIZ-ZACQAIPSSA-N 2 1 349.475 3.005 20 5 EGBDMP CN(c1ccccc1)c1ccc(C[N@H+](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000579230751 325080601 /nfs/dbraw/zinc/08/06/01/325080601.db2.gz VVWSOAWBCMLCNX-UHFFFAOYSA-N 2 1 328.416 3.143 20 5 EGBDMP CN(c1ccccc1)c1ccc(C[N@@H+](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000579230751 325080605 /nfs/dbraw/zinc/08/06/05/325080605.db2.gz VVWSOAWBCMLCNX-UHFFFAOYSA-N 2 1 328.416 3.143 20 5 EGBDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000283856888 455603512 /nfs/dbraw/zinc/60/35/12/455603512.db2.gz BKQWLAVUGWVRCN-AWEZNQCLSA-N 2 1 342.443 3.480 20 5 EGBDMP C[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185736359 455609924 /nfs/dbraw/zinc/60/99/24/455609924.db2.gz IOKGLUOUZZYFFJ-HOTGVXAUSA-N 2 1 347.459 3.216 20 5 EGBDMP Cc1[nH+]ccn1CCC[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000270572153 455986135 /nfs/dbraw/zinc/98/61/35/455986135.db2.gz BBMPUCKEYTXZHS-UHFFFAOYSA-N 2 1 344.415 3.033 20 5 EGBDMP Cc1[nH+]ccn1CCCNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000272830520 456083995 /nfs/dbraw/zinc/08/39/95/456083995.db2.gz KZZHXNHJUCFHIZ-UHFFFAOYSA-N 2 1 325.372 3.459 20 5 EGBDMP CCC[N@H+](C)C[C@@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601120315 460719107 /nfs/dbraw/zinc/71/91/07/460719107.db2.gz JSISTBXJSSXSIR-AWEZNQCLSA-N 2 1 328.416 3.311 20 5 EGBDMP CCC[N@@H+](C)C[C@@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601120315 460719112 /nfs/dbraw/zinc/71/91/12/460719112.db2.gz JSISTBXJSSXSIR-AWEZNQCLSA-N 2 1 328.416 3.311 20 5 EGBDMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435391917 458136146 /nfs/dbraw/zinc/13/61/46/458136146.db2.gz UTSLZKOTOHOLJO-CYBMUJFWSA-N 2 1 331.441 3.365 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000470179018 458620618 /nfs/dbraw/zinc/62/06/18/458620618.db2.gz RDYALZYMKDJVMY-QMJOVRGKSA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000470179018 458620623 /nfs/dbraw/zinc/62/06/23/458620623.db2.gz RDYALZYMKDJVMY-QMJOVRGKSA-N 2 1 329.444 3.416 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000187012819 528664001 /nfs/dbraw/zinc/66/40/01/528664001.db2.gz QFSXZIROJOVLEI-CRAIPNDOSA-N 2 1 349.475 3.130 20 5 EGBDMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000187012819 528664007 /nfs/dbraw/zinc/66/40/07/528664007.db2.gz QFSXZIROJOVLEI-CRAIPNDOSA-N 2 1 349.475 3.130 20 5 EGBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000872022700 1296664951 /nfs/dbraw/zinc/66/49/51/1296664951.db2.gz YPFGQZGCSLZPDH-STQMWFEESA-N 2 1 335.473 3.452 20 5 EGBDMP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000872022700 1296664968 /nfs/dbraw/zinc/66/49/68/1296664968.db2.gz YPFGQZGCSLZPDH-STQMWFEESA-N 2 1 335.473 3.452 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000765977681 1302363472 /nfs/dbraw/zinc/36/34/72/1302363472.db2.gz RWZITGDAQHXARU-YJBOKZPZSA-N 2 1 347.459 3.197 20 5 EGBDMP CCCC[N@H+](C)C[C@@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000810245332 1317985491 /nfs/dbraw/zinc/98/54/91/1317985491.db2.gz ZFAOICVJZGZREJ-MRXNPFEDSA-N 2 1 348.491 3.274 20 5 EGBDMP CCCC[N@@H+](C)C[C@@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000810245332 1317985494 /nfs/dbraw/zinc/98/54/94/1317985494.db2.gz ZFAOICVJZGZREJ-MRXNPFEDSA-N 2 1 348.491 3.274 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126570 1321474509 /nfs/dbraw/zinc/47/45/09/1321474509.db2.gz KMXYZKSPUIXBKL-ZIAGYGMSSA-N 2 1 337.851 3.460 20 5 EGBDMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000274362491 267224940 /nfs/dbraw/zinc/22/49/40/267224940.db2.gz NVGSZGFTPFRRKH-AEFFLSMTSA-N 2 1 342.443 3.491 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000414195404 309066166 /nfs/dbraw/zinc/06/61/66/309066166.db2.gz UUSOJPOZHOJYRC-HUUCEWRRSA-N 2 1 335.448 3.376 20 5 EGBDMP CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420322016 309282121 /nfs/dbraw/zinc/28/21/21/309282121.db2.gz DQPXWMJWFUEHGR-HZPDHXFCSA-N 2 1 347.459 3.204 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+]3CC[C@H]([NH3+])C[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000571578018 317218713 /nfs/dbraw/zinc/21/87/13/317218713.db2.gz DCXXQXDGAUPFJW-OLZOCXBDSA-N 2 1 345.399 3.175 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@H]([NH3+])C[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000571578018 317218715 /nfs/dbraw/zinc/21/87/15/317218715.db2.gz DCXXQXDGAUPFJW-OLZOCXBDSA-N 2 1 345.399 3.175 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]4C[NH2+]C[C@@H]4C3)s2)cc1 ZINC000579719036 325150943 /nfs/dbraw/zinc/15/09/43/325150943.db2.gz RGVOJRUPEQIOPY-LSDHHAIUSA-N 2 1 343.452 3.365 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000153037672 454754926 /nfs/dbraw/zinc/75/49/26/454754926.db2.gz DFNVFSLILITDQQ-HUUCEWRRSA-N 2 1 335.448 3.376 20 5 EGBDMP CCC[C@@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000128432018 455055696 /nfs/dbraw/zinc/05/56/96/455055696.db2.gz CVPCDHJZAWUAPQ-LJQANCHMSA-N 2 1 348.491 3.053 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H](N[C@H](C)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000245418526 455293277 /nfs/dbraw/zinc/29/32/77/455293277.db2.gz AVSXQXSQTZTOES-MDZRGWNJSA-N 2 1 349.475 3.382 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000245418526 455293286 /nfs/dbraw/zinc/29/32/86/455293286.db2.gz AVSXQXSQTZTOES-MDZRGWNJSA-N 2 1 349.475 3.382 20 5 EGBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000271849952 455786100 /nfs/dbraw/zinc/78/61/00/455786100.db2.gz IKUNTOQRWVEKBR-HNNXBMFYSA-N 2 1 335.473 3.317 20 5 EGBDMP C[N@@H+]1CCC[C@@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC[C@H]21 ZINC000601130626 460722549 /nfs/dbraw/zinc/72/25/49/460722549.db2.gz NDQHDBLGZCGAPN-CXAGYDPISA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@H+]1CCC[C@@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC[C@H]21 ZINC000601130626 460722556 /nfs/dbraw/zinc/72/25/56/460722556.db2.gz NDQHDBLGZCGAPN-CXAGYDPISA-N 2 1 326.400 3.064 20 5 EGBDMP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000347049097 457204083 /nfs/dbraw/zinc/20/40/83/457204083.db2.gz PZDPVAWNIPHKMH-CQSZACIVSA-N 2 1 329.400 3.286 20 5 EGBDMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000347049097 457204091 /nfs/dbraw/zinc/20/40/91/457204091.db2.gz PZDPVAWNIPHKMH-CQSZACIVSA-N 2 1 329.400 3.286 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000373113180 458400409 /nfs/dbraw/zinc/40/04/09/458400409.db2.gz SGKMQKLTVWTGEY-CQSZACIVSA-N 2 1 344.415 3.107 20 5 EGBDMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000459734158 458462063 /nfs/dbraw/zinc/46/20/63/458462063.db2.gz OGAMHNSNTIHPLC-GFCCVEGCSA-N 2 1 343.374 3.018 20 5 EGBDMP CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000424283167 458603478 /nfs/dbraw/zinc/60/34/78/458603478.db2.gz AXDFBHKBYKHXFI-OAHLLOKOSA-N 2 1 347.459 3.346 20 5 EGBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000534328439 459315688 /nfs/dbraw/zinc/31/56/88/459315688.db2.gz IRZURNGJVHOWGA-CABCVRRESA-N 2 1 337.489 3.397 20 5 EGBDMP CC[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@@H]1[NH3+] ZINC000592427668 459598411 /nfs/dbraw/zinc/59/84/11/459598411.db2.gz PASSTOGJLPUYQP-DYVFJYSZSA-N 2 1 329.400 3.414 20 5 EGBDMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)CC1 ZINC000809756538 1317891578 /nfs/dbraw/zinc/89/15/78/1317891578.db2.gz SDNPXOPXJTYDOL-CQSZACIVSA-N 2 1 337.851 3.412 20 5 EGBDMP CCC[N@H+](CC)C[C@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000810261215 1317989522 /nfs/dbraw/zinc/98/95/22/1317989522.db2.gz CMHGPAJPLAXTJQ-INIZCTEOSA-N 2 1 348.491 3.274 20 5 EGBDMP CCC[N@@H+](CC)C[C@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000810261215 1317989526 /nfs/dbraw/zinc/98/95/26/1317989526.db2.gz CMHGPAJPLAXTJQ-INIZCTEOSA-N 2 1 348.491 3.274 20 5 EGBDMP O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000819128952 1319643461 /nfs/dbraw/zinc/64/34/61/1319643461.db2.gz VLRMPCHCLPNPKX-LJQANCHMSA-N 2 1 347.459 3.015 20 5 EGBDMP C[C@H]1CCCC[N@@H+]1CCCNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001156928253 1380731466 /nfs/dbraw/zinc/73/14/66/1380731466.db2.gz JPOUZSOJFMSFNT-JQVXPOPVSA-N 2 1 347.463 3.199 20 5 EGBDMP C[C@H]1CCCC[N@H+]1CCCNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001156928253 1380731469 /nfs/dbraw/zinc/73/14/69/1380731469.db2.gz JPOUZSOJFMSFNT-JQVXPOPVSA-N 2 1 347.463 3.199 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC[N@@H+]1Cc1ccccc1 ZINC001168966011 1384072847 /nfs/dbraw/zinc/07/28/47/1384072847.db2.gz FRJRVIHEZXKRIP-QXCFHYIPSA-N 2 1 331.460 3.075 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC[N@H+]1Cc1ccccc1 ZINC001168966011 1384072851 /nfs/dbraw/zinc/07/28/51/1384072851.db2.gz FRJRVIHEZXKRIP-QXCFHYIPSA-N 2 1 331.460 3.075 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001169018930 1384091828 /nfs/dbraw/zinc/09/18/28/1384091828.db2.gz DQHRLVKTTZTHPR-SJLPKXTDSA-N 2 1 347.459 3.013 20 5 EGBDMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169030344 1384094290 /nfs/dbraw/zinc/09/42/90/1384094290.db2.gz YXZDQJHTPKXTLT-ICSRJNTNSA-N 2 1 345.487 3.418 20 5 EGBDMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169049138 1384100541 /nfs/dbraw/zinc/10/05/41/1384100541.db2.gz VZMXLPZCCOBEHL-APWZRJJASA-N 2 1 349.450 3.167 20 5 EGBDMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169049138 1384100543 /nfs/dbraw/zinc/10/05/43/1384100543.db2.gz VZMXLPZCCOBEHL-APWZRJJASA-N 2 1 349.450 3.167 20 5 EGBDMP COc1ccc(C[C@@H](C)n2c[nH+]cc2C2CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001170351393 1384298079 /nfs/dbraw/zinc/29/80/79/1384298079.db2.gz FZDZTSVNPIAQOX-CYBMUJFWSA-N 2 1 344.415 3.071 20 5 EGBDMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172913628 1384877158 /nfs/dbraw/zinc/87/71/58/1384877158.db2.gz XXEANJBEKCQZNU-OKYOBFRVSA-N 2 1 343.471 3.447 20 5 EGBDMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172913628 1384877162 /nfs/dbraw/zinc/87/71/62/1384877162.db2.gz XXEANJBEKCQZNU-OKYOBFRVSA-N 2 1 343.471 3.447 20 5 EGBDMP COCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000159113272 225149739 /nfs/dbraw/zinc/14/97/39/225149739.db2.gz FYGMKJJEEUZKEA-OAHLLOKOSA-N 2 1 335.448 3.055 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCc3[nH+]ccn3C1)CCC2 ZINC000279025975 275297003 /nfs/dbraw/zinc/29/70/03/275297003.db2.gz VLJOHRFVDUROMQ-CXAGYDPISA-N 2 1 326.400 3.021 20 5 EGBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000414172158 309064556 /nfs/dbraw/zinc/06/45/56/309064556.db2.gz FBMYVLHMTSTYBA-CRAIPNDOSA-N 2 1 331.460 3.237 20 5 EGBDMP C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC[NH2+]C1 ZINC000414851403 309105431 /nfs/dbraw/zinc/10/54/31/309105431.db2.gz JDVZOZLSLQUHIO-KGLIPLIRSA-N 2 1 329.400 3.333 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000134932043 454610620 /nfs/dbraw/zinc/61/06/20/454610620.db2.gz ORESVFSAKUYRPP-VQIMIIECSA-N 2 1 329.444 3.086 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000134932043 454610626 /nfs/dbraw/zinc/61/06/26/454610626.db2.gz ORESVFSAKUYRPP-VQIMIIECSA-N 2 1 329.444 3.086 20 5 EGBDMP Cc1nccn1CCC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000136296233 454733674 /nfs/dbraw/zinc/73/36/74/454733674.db2.gz FMLFZAPRPSZCPF-UHFFFAOYSA-N 2 1 346.431 3.409 20 5 EGBDMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000136296233 454733676 /nfs/dbraw/zinc/73/36/76/454733676.db2.gz FMLFZAPRPSZCPF-UHFFFAOYSA-N 2 1 346.431 3.409 20 5 EGBDMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000136296233 454733683 /nfs/dbraw/zinc/73/36/83/454733683.db2.gz FMLFZAPRPSZCPF-UHFFFAOYSA-N 2 1 346.431 3.409 20 5 EGBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCn1cc[nH+]c1C ZINC000271024141 456100979 /nfs/dbraw/zinc/10/09/79/456100979.db2.gz AWRHNHISTHGOJV-AWEZNQCLSA-N 2 1 334.445 3.260 20 5 EGBDMP CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000435377774 458128841 /nfs/dbraw/zinc/12/88/41/458128841.db2.gz ATNGUDUHGCRMJU-MRXNPFEDSA-N 2 1 340.427 3.143 20 5 EGBDMP CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000435377774 458128846 /nfs/dbraw/zinc/12/88/46/458128846.db2.gz ATNGUDUHGCRMJU-MRXNPFEDSA-N 2 1 340.427 3.143 20 5 EGBDMP [NH3+]C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000435394770 458136668 /nfs/dbraw/zinc/13/66/68/458136668.db2.gz LQOQRXJQEXEFEO-UHFFFAOYSA-N 2 1 335.791 3.431 20 5 EGBDMP CC(C)[N@@H+](C)CC1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609133560 459907626 /nfs/dbraw/zinc/90/76/26/459907626.db2.gz VIYISGIIWVXLSS-UHFFFAOYSA-N 2 1 349.475 3.416 20 5 EGBDMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602519109 459979762 /nfs/dbraw/zinc/97/97/62/459979762.db2.gz VUWJCJPZNZNUMC-UHFFFAOYSA-N 2 1 342.321 3.298 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000765977679 1302360641 /nfs/dbraw/zinc/36/06/41/1302360641.db2.gz RWZITGDAQHXARU-MAUKXSAKSA-N 2 1 347.459 3.197 20 5 EGBDMP C[C@H]1CN(c2cc[nH+]cc2)CCN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000884853994 1303000475 /nfs/dbraw/zinc/00/04/75/1303000475.db2.gz YYOKCPNAKAPNTN-AWEZNQCLSA-N 2 1 349.394 3.253 20 5 EGBDMP CC1(C)CCC[N@@H+]1CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000825327728 1320328870 /nfs/dbraw/zinc/32/88/70/1320328870.db2.gz VCULKFWUQZOBLZ-UHFFFAOYSA-N 2 1 346.475 3.028 20 5 EGBDMP CC1(C)CCC[N@H+]1CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000825327728 1320328872 /nfs/dbraw/zinc/32/88/72/1320328872.db2.gz VCULKFWUQZOBLZ-UHFFFAOYSA-N 2 1 346.475 3.028 20 5 EGBDMP CCCC[N@H+](C)C[C@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000808733634 1317726167 /nfs/dbraw/zinc/72/61/67/1317726167.db2.gz ZFAOICVJZGZREJ-INIZCTEOSA-N 2 1 348.491 3.274 20 5 EGBDMP CCCC[N@@H+](C)C[C@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000808733634 1317726173 /nfs/dbraw/zinc/72/61/73/1317726173.db2.gz ZFAOICVJZGZREJ-INIZCTEOSA-N 2 1 348.491 3.274 20 5 EGBDMP C[N@H+](Cc1c2ccccc2c(Cl)c2ccccc21)C[C@H](O)C[NH3+] ZINC000841091855 1321217251 /nfs/dbraw/zinc/21/72/51/1321217251.db2.gz HTXNSVAGKAPSTF-CYBMUJFWSA-N 2 1 328.843 3.398 20 5 EGBDMP COc1ccc(C[C@H](C)[N@H+]2CCCC[C@@H](CCC[NH3+])C2)c([N+](=O)[O-])c1 ZINC001170326142 1384291578 /nfs/dbraw/zinc/29/15/78/1384291578.db2.gz FKCKVXYARBCGTP-HOTGVXAUSA-N 2 1 349.475 3.375 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH+]1CCC([NH+]3CCC3)CC1)CC2 ZINC001172913528 1384877044 /nfs/dbraw/zinc/87/70/44/1384877044.db2.gz RLHDEADWLSKVLX-QGZVFWFLSA-N 2 1 329.444 3.012 20 5 EGBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC[N@H+](CC2CCCC2)C1 ZINC001173221405 1384938229 /nfs/dbraw/zinc/93/82/29/1384938229.db2.gz MZVYFTMXDNLCQV-QAPCUYQASA-N 2 1 331.460 3.380 20 5 EGBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC001173221405 1384938234 /nfs/dbraw/zinc/93/82/34/1384938234.db2.gz MZVYFTMXDNLCQV-QAPCUYQASA-N 2 1 331.460 3.380 20 5 EGBDMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC001319383656 1386094017 /nfs/dbraw/zinc/09/40/17/1386094017.db2.gz OTYVDCXDECWAGV-MAUKXSAKSA-N 2 1 331.460 3.237 20 5 EGBDMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC001319383657 1386094511 /nfs/dbraw/zinc/09/45/11/1386094511.db2.gz OTYVDCXDECWAGV-QAPCUYQASA-N 2 1 331.460 3.237 20 5 EGBDMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]12 ZINC000346852150 156165179 /nfs/dbraw/zinc/16/51/79/156165179.db2.gz WKFMKWYTOXHFMW-KBRIMQKVSA-N 2 1 327.384 3.024 20 5 EGBDMP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C[NH3+])CC(C)C ZINC000423257847 309392609 /nfs/dbraw/zinc/39/26/09/309392609.db2.gz AIPQDTPDFDRUKU-KBPBESRZSA-N 2 1 325.478 3.429 20 5 EGBDMP C[NH2+]CC1CC[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000435391119 309731533 /nfs/dbraw/zinc/73/15/33/309731533.db2.gz VKLQCKXGSALAQU-UHFFFAOYSA-N 2 1 346.456 3.150 20 5 EGBDMP CC[NH+](CC)CCO[C@@H]1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490030517 311130415 /nfs/dbraw/zinc/13/04/15/311130415.db2.gz LVRNYVNYTPLMKS-SJLPKXTDSA-N 2 1 349.475 3.397 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000571955448 317270629 /nfs/dbraw/zinc/27/06/29/317270629.db2.gz MHANURQILPDKSW-CVEARBPZSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC000571955448 317270631 /nfs/dbraw/zinc/27/06/31/317270631.db2.gz MHANURQILPDKSW-CVEARBPZSA-N 2 1 335.448 3.055 20 5 EGBDMP O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000075836279 453929786 /nfs/dbraw/zinc/92/97/86/453929786.db2.gz UJPCOYLXVXKDKE-KRWDZBQOSA-N 2 1 347.459 3.172 20 5 EGBDMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)C1 ZINC000245502915 455315547 /nfs/dbraw/zinc/31/55/47/455315547.db2.gz HCDLFQKOVVCOES-HUUCEWRRSA-N 2 1 335.448 3.376 20 5 EGBDMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)C1 ZINC000245502915 455315552 /nfs/dbraw/zinc/31/55/52/455315552.db2.gz HCDLFQKOVVCOES-HUUCEWRRSA-N 2 1 335.448 3.376 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000249459036 455756725 /nfs/dbraw/zinc/75/67/25/455756725.db2.gz QFSXZIROJOVLEI-YJBOKZPZSA-N 2 1 349.475 3.130 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000249459036 455756730 /nfs/dbraw/zinc/75/67/30/455756730.db2.gz QFSXZIROJOVLEI-YJBOKZPZSA-N 2 1 349.475 3.130 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+]3CC[C@@](C)(C[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000261617017 455915292 /nfs/dbraw/zinc/91/52/92/455915292.db2.gz BTGOUHPWRRNMCX-SFHVURJKSA-N 2 1 345.399 3.034 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@@](C)(C[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000261617017 455915298 /nfs/dbraw/zinc/91/52/98/455915298.db2.gz BTGOUHPWRRNMCX-SFHVURJKSA-N 2 1 345.399 3.034 20 5 EGBDMP Cc1cc(NC[C@H]2CC[N@H+](C3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000326375077 456693674 /nfs/dbraw/zinc/69/36/74/456693674.db2.gz WJUWKBSZZOEOQR-CYBMUJFWSA-N 2 1 326.400 3.348 20 5 EGBDMP CC[N@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000495431165 458854535 /nfs/dbraw/zinc/85/45/35/458854535.db2.gz BBEQUAKWYCWIBD-DOMZBBRYSA-N 2 1 325.840 3.111 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)s1 ZINC000574638092 459845461 /nfs/dbraw/zinc/84/54/61/459845461.db2.gz KVERDKRFHFOTIK-ZIAGYGMSSA-N 2 1 343.452 3.365 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)s1 ZINC000574638092 459845470 /nfs/dbraw/zinc/84/54/70/459845470.db2.gz KVERDKRFHFOTIK-ZIAGYGMSSA-N 2 1 343.452 3.365 20 5 EGBDMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)CC1 ZINC000809756537 1317891791 /nfs/dbraw/zinc/89/17/91/1317891791.db2.gz SDNPXOPXJTYDOL-AWEZNQCLSA-N 2 1 337.851 3.412 20 5 EGBDMP CC(C)[N@@H+]1CC[C@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)[C@H](C)C1 ZINC001163367476 1383032949 /nfs/dbraw/zinc/03/29/49/1383032949.db2.gz ZIGAZBCHRLKWDG-BIYNOUFRSA-N 2 1 347.463 3.053 20 5 EGBDMP CC(C)[N@H+]1CC[C@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)[C@H](C)C1 ZINC001163367476 1383032951 /nfs/dbraw/zinc/03/29/51/1383032951.db2.gz ZIGAZBCHRLKWDG-BIYNOUFRSA-N 2 1 347.463 3.053 20 5 EGBDMP C[N@@H+](CCC[NH+]1CCCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910463 1384876105 /nfs/dbraw/zinc/87/61/05/1384876105.db2.gz ALODKAWPSHRODD-SFHVURJKSA-N 2 1 331.460 3.260 20 5 EGBDMP C[C@@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000344633078 144202195 /nfs/dbraw/zinc/20/21/95/144202195.db2.gz QSBVAVYWRILRAS-UKRRQHHQSA-N 2 1 329.400 3.427 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1C ZINC000344633078 144202197 /nfs/dbraw/zinc/20/21/97/144202197.db2.gz QSBVAVYWRILRAS-UKRRQHHQSA-N 2 1 329.400 3.427 20 5 EGBDMP CC[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278724641 275268878 /nfs/dbraw/zinc/26/88/78/275268878.db2.gz WCDMBXZNXWSENM-CRAIPNDOSA-N 2 1 335.448 3.136 20 5 EGBDMP CC[C@@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278724641 275268880 /nfs/dbraw/zinc/26/88/80/275268880.db2.gz WCDMBXZNXWSENM-CRAIPNDOSA-N 2 1 335.448 3.136 20 5 EGBDMP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000414811428 309102970 /nfs/dbraw/zinc/10/29/70/309102970.db2.gz WGKRJOMZQSBBGA-XJKSGUPXSA-N 2 1 346.456 3.325 20 5 EGBDMP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414831687 309104476 /nfs/dbraw/zinc/10/44/76/309104476.db2.gz DKQAPSJEYNRHFC-LLVKDONJSA-N 2 1 337.807 3.453 20 5 EGBDMP O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000415005019 309113754 /nfs/dbraw/zinc/11/37/54/309113754.db2.gz OOHIFLFWNPNZEJ-FUHWJXTLSA-N 2 1 343.402 3.217 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CCCC2 ZINC000417331900 309201996 /nfs/dbraw/zinc/20/19/96/309201996.db2.gz WOTFJISLTJNDKU-KUHUBIRLSA-N 2 1 329.444 3.436 20 5 EGBDMP CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420322014 309282103 /nfs/dbraw/zinc/28/21/03/309282103.db2.gz DQPXWMJWFUEHGR-CVEARBPZSA-N 2 1 347.459 3.204 20 5 EGBDMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)C1 ZINC000153145405 454764641 /nfs/dbraw/zinc/76/46/41/454764641.db2.gz HCDLFQKOVVCOES-GJZGRUSLSA-N 2 1 335.448 3.376 20 5 EGBDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)C1 ZINC000153145405 454764644 /nfs/dbraw/zinc/76/46/44/454764644.db2.gz HCDLFQKOVVCOES-GJZGRUSLSA-N 2 1 335.448 3.376 20 5 EGBDMP C[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185723465 455606272 /nfs/dbraw/zinc/60/62/72/455606272.db2.gz UPZFKNOMHIPFLB-HZPDHXFCSA-N 2 1 347.459 3.216 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000248173145 455693617 /nfs/dbraw/zinc/69/36/17/455693617.db2.gz VDFQQSFDRLIMFD-MDZRGWNJSA-N 2 1 349.475 3.382 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000248173145 455693620 /nfs/dbraw/zinc/69/36/20/455693620.db2.gz VDFQQSFDRLIMFD-MDZRGWNJSA-N 2 1 349.475 3.382 20 5 EGBDMP COCCC[NH+]1CCC([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192806969 455697260 /nfs/dbraw/zinc/69/72/60/455697260.db2.gz UVADNWGQHOPLPT-LJQANCHMSA-N 2 1 347.459 3.063 20 5 EGBDMP CC[NH2+]CC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000347173555 457271064 /nfs/dbraw/zinc/27/10/64/457271064.db2.gz PCGDSQXCAUIYBW-UHFFFAOYSA-N 2 1 343.374 3.018 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H]4[NH2+]CC[C@H]4C3)o2)cc1 ZINC000427134562 457946775 /nfs/dbraw/zinc/94/67/75/457946775.db2.gz ZKYQRJFJKXLASA-YOEHRIQHSA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]4[NH2+]CC[C@H]4C3)o2)cc1 ZINC000427134562 457946780 /nfs/dbraw/zinc/94/67/80/457946780.db2.gz ZKYQRJFJKXLASA-YOEHRIQHSA-N 2 1 327.384 3.039 20 5 EGBDMP Cn1ccnc1[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000377189943 458485784 /nfs/dbraw/zinc/48/57/84/458485784.db2.gz SDHWPBLWTOXYNT-ZDUSSCGKSA-N 2 1 334.807 3.361 20 5 EGBDMP CC[N@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000495431166 458854956 /nfs/dbraw/zinc/85/49/56/458854956.db2.gz BBEQUAKWYCWIBD-IUODEOHRSA-N 2 1 325.840 3.111 20 5 EGBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000887133350 1303686437 /nfs/dbraw/zinc/68/64/37/1303686437.db2.gz ZGWAFUOUKVSTTM-HUUCEWRRSA-N 2 1 326.400 3.262 20 5 EGBDMP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC000887133350 1303686444 /nfs/dbraw/zinc/68/64/44/1303686444.db2.gz ZGWAFUOUKVSTTM-HUUCEWRRSA-N 2 1 326.400 3.262 20 5 EGBDMP CC[N@@H+]1C[C@H]2CN(Cc3ccc4ccc5cccnc5c4n3)C[C@H]2C1 ZINC001232227636 1376420241 /nfs/dbraw/zinc/42/02/41/1376420241.db2.gz JUEBHLUIGQHOTO-HDICACEKSA-N 2 1 332.451 3.167 20 5 EGBDMP CC[N@H+]1C[C@@H]2C[NH+](Cc3ccc4ccc5cccnc5c4n3)C[C@@H]2C1 ZINC001232227636 1376420245 /nfs/dbraw/zinc/42/02/45/1376420245.db2.gz JUEBHLUIGQHOTO-HDICACEKSA-N 2 1 332.451 3.167 20 5 EGBDMP CC[N@@H+]1C[C@@H]2C[NH+](Cc3ccc4ccc5cccnc5c4n3)C[C@@H]2C1 ZINC001232227636 1376420249 /nfs/dbraw/zinc/42/02/49/1376420249.db2.gz JUEBHLUIGQHOTO-HDICACEKSA-N 2 1 332.451 3.167 20 5 EGBDMP CC[NH+]1C[C@@H]2C[N@@H+](Cc3ccc4ccc5cccnc5c4n3)C[C@@H]2C1 ZINC001232227636 1376420250 /nfs/dbraw/zinc/42/02/50/1376420250.db2.gz JUEBHLUIGQHOTO-HDICACEKSA-N 2 1 332.451 3.167 20 5 EGBDMP CC[NH+]1C[C@@H]2C[N@H+](Cc3ccc4ccc5cccnc5c4n3)C[C@@H]2C1 ZINC001232227636 1376420253 /nfs/dbraw/zinc/42/02/53/1376420253.db2.gz JUEBHLUIGQHOTO-HDICACEKSA-N 2 1 332.451 3.167 20 5 EGBDMP C[N@@H+]1CCc2c(c([N+](=O)[O-])ccc2N2C(C)(C)CC([NH3+])CC2(C)C)C1 ZINC001167626308 1383692638 /nfs/dbraw/zinc/69/26/38/1383692638.db2.gz FKDIQSLGJTYWGO-UHFFFAOYSA-N 2 1 346.475 3.067 20 5 EGBDMP C[N@H+]1CCc2c(c([N+](=O)[O-])ccc2N2C(C)(C)CC([NH3+])CC2(C)C)C1 ZINC001167626308 1383692641 /nfs/dbraw/zinc/69/26/41/1383692641.db2.gz FKDIQSLGJTYWGO-UHFFFAOYSA-N 2 1 346.475 3.067 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC[N@@H+]1Cc1ccccc1 ZINC001168966010 1384072723 /nfs/dbraw/zinc/07/27/23/1384072723.db2.gz FRJRVIHEZXKRIP-OQIJWPOYSA-N 2 1 331.460 3.075 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC[N@H+]1Cc1ccccc1 ZINC001168966010 1384072727 /nfs/dbraw/zinc/07/27/27/1384072727.db2.gz FRJRVIHEZXKRIP-OQIJWPOYSA-N 2 1 331.460 3.075 20 5 EGBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C)([NH+]2CCCC2)CC1 ZINC001173233356 1384941753 /nfs/dbraw/zinc/94/17/53/1384941753.db2.gz VSOVKHXBGUGSID-INIZCTEOSA-N 2 1 331.460 3.476 20 5 EGBDMP CC[NH+](CC)C1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC001329351211 1389072372 /nfs/dbraw/zinc/07/23/72/1389072372.db2.gz ZWHUUQLZDZQAAI-UHFFFAOYSA-N 2 1 328.416 3.454 20 5 EGBDMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@H]21 ZINC000346836758 156158223 /nfs/dbraw/zinc/15/82/23/156158223.db2.gz VOBVDRLQLHLROF-BMGDILEWSA-N 2 1 341.411 3.414 20 5 EGBDMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000347019986 277275570 /nfs/dbraw/zinc/27/55/70/277275570.db2.gz MOEPJHIPPGSVPU-AWEZNQCLSA-N 2 1 329.400 3.286 20 5 EGBDMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000347019986 277275571 /nfs/dbraw/zinc/27/55/71/277275571.db2.gz MOEPJHIPPGSVPU-AWEZNQCLSA-N 2 1 329.400 3.286 20 5 EGBDMP C[C@@]1(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCC[NH2+]C1 ZINC000414896454 309107997 /nfs/dbraw/zinc/10/79/97/309107997.db2.gz BVVCHYHJGBGZLZ-GOSISDBHSA-N 2 1 329.400 3.334 20 5 EGBDMP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000125517357 454829511 /nfs/dbraw/zinc/82/95/11/454829511.db2.gz SSFABCQSCWTRGZ-AWEZNQCLSA-N 2 1 329.400 3.238 20 5 EGBDMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000125517357 454829516 /nfs/dbraw/zinc/82/95/16/454829516.db2.gz SSFABCQSCWTRGZ-AWEZNQCLSA-N 2 1 329.400 3.238 20 5 EGBDMP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271493888 455659177 /nfs/dbraw/zinc/65/91/77/455659177.db2.gz KVZHCZTXESYTSQ-FHWLQOOXSA-N 2 1 347.459 3.013 20 5 EGBDMP CC[N@H+]1CC[C@@H]([NH+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000354209183 457131957 /nfs/dbraw/zinc/13/19/57/457131957.db2.gz QKMLURYKTZASKX-DOTOQJQBSA-N 2 1 335.448 3.168 20 5 EGBDMP CC[NH+]1CC[C@@H]([N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000354209183 457131961 /nfs/dbraw/zinc/13/19/61/457131961.db2.gz QKMLURYKTZASKX-DOTOQJQBSA-N 2 1 335.448 3.168 20 5 EGBDMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000354209183 457131964 /nfs/dbraw/zinc/13/19/64/457131964.db2.gz QKMLURYKTZASKX-DOTOQJQBSA-N 2 1 335.448 3.168 20 5 EGBDMP C[C@H]([NH3+])[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000347145800 457256313 /nfs/dbraw/zinc/25/63/13/457256313.db2.gz YGWDPDKCOYPJQZ-ZFWWWQNUSA-N 2 1 329.400 3.414 20 5 EGBDMP C[NH+](C)CCCC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000444691234 457941598 /nfs/dbraw/zinc/94/15/98/457941598.db2.gz XXZGTJFTANMDKG-UHFFFAOYSA-N 2 1 345.447 3.025 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H]4[NH2+]CC[C@H]4C3)o2)c1 ZINC000427132941 457946798 /nfs/dbraw/zinc/94/67/98/457946798.db2.gz IVBSJFBHQYDPNG-WMLDXEAASA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H]4[NH2+]CC[C@H]4C3)o2)c1 ZINC000427132941 457946809 /nfs/dbraw/zinc/94/68/09/457946809.db2.gz IVBSJFBHQYDPNG-WMLDXEAASA-N 2 1 327.384 3.039 20 5 EGBDMP [NH3+]CC[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000442928088 459061481 /nfs/dbraw/zinc/06/14/81/459061481.db2.gz PIHYLUJAMSITBP-AWEZNQCLSA-N 2 1 329.400 3.416 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000593736239 459966660 /nfs/dbraw/zinc/96/66/60/459966660.db2.gz KHQKOXUBOXQTHN-IUVQAAGXSA-N 2 1 347.459 3.183 20 5 EGBDMP C[NH+]1CCC([C@@H]2CC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000589197684 460051514 /nfs/dbraw/zinc/05/15/14/460051514.db2.gz UANRJTBIDHEGCM-WLPBJKJWSA-N 2 1 329.444 3.272 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001169018928 1384091542 /nfs/dbraw/zinc/09/15/42/1384091542.db2.gz DQHRLVKTTZTHPR-AEFFLSMTSA-N 2 1 347.459 3.013 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000372449966 157333584 /nfs/dbraw/zinc/33/35/84/157333584.db2.gz OBAYXWJYPLNRFM-NUEKZKHPSA-N 2 1 333.432 3.271 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000372449966 157333586 /nfs/dbraw/zinc/33/35/86/157333586.db2.gz OBAYXWJYPLNRFM-NUEKZKHPSA-N 2 1 333.432 3.271 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000132960228 307665313 /nfs/dbraw/zinc/66/53/13/307665313.db2.gz NRRPRLAWJFIVBN-JKSUJKDBSA-N 2 1 347.459 3.055 20 5 EGBDMP C[C@H]([NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423423703 309399964 /nfs/dbraw/zinc/39/99/64/309399964.db2.gz DVNQWILHJKSXQG-JCKZUZKGSA-N 2 1 329.425 3.192 20 5 EGBDMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000095968179 454242494 /nfs/dbraw/zinc/24/24/94/454242494.db2.gz ZKQWYMXVXYADSG-HZPDHXFCSA-N 2 1 347.459 3.055 20 5 EGBDMP CCC[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1cccc([N+](=O)[O-])c1 ZINC000268844442 455715448 /nfs/dbraw/zinc/71/54/48/455715448.db2.gz BJMHNYLQBLEGOM-MOPGFXCFSA-N 2 1 349.475 3.263 20 5 EGBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000271849956 455785991 /nfs/dbraw/zinc/78/59/91/455785991.db2.gz IKUNTOQRWVEKBR-OAHLLOKOSA-N 2 1 335.473 3.317 20 5 EGBDMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272603609 456010569 /nfs/dbraw/zinc/01/05/69/456010569.db2.gz JJFXWXPFVPOYIG-LALPHHSUSA-N 2 1 325.840 3.109 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)o1 ZINC000427138858 457949160 /nfs/dbraw/zinc/94/91/60/457949160.db2.gz ZNULIDBAUYLQBF-XJKSGUPXSA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)o1 ZINC000427138858 457949166 /nfs/dbraw/zinc/94/91/66/457949166.db2.gz ZNULIDBAUYLQBF-XJKSGUPXSA-N 2 1 327.384 3.039 20 5 EGBDMP C[C@@H]1C[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000435373698 458125183 /nfs/dbraw/zinc/12/51/83/458125183.db2.gz OCQDKMOWLQFUAC-CHWSQXEVSA-N 2 1 331.441 3.492 20 5 EGBDMP [NH3+]CC[C@@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000442921489 459061495 /nfs/dbraw/zinc/06/14/95/459061495.db2.gz NLYPQJITSVRHJG-ZDUSSCGKSA-N 2 1 346.456 3.279 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000593736236 459967129 /nfs/dbraw/zinc/96/71/29/459967129.db2.gz KHQKOXUBOXQTHN-FPXQBCRKSA-N 2 1 347.459 3.183 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000611516358 460384932 /nfs/dbraw/zinc/38/49/32/460384932.db2.gz LHADSLKKRLHNMT-OAHLLOKOSA-N 2 1 326.400 3.181 20 5 EGBDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000788673898 1305993613 /nfs/dbraw/zinc/99/36/13/1305993613.db2.gz YVVKTFPLDFVWMG-CABCVRRESA-N 2 1 334.464 3.196 20 5 EGBDMP [NH3+]C[C@H]1C[N@@H+](Cc2ccc3ccc4cccc5ccc2c3c45)C[C@@H]1O ZINC001206511838 1371078083 /nfs/dbraw/zinc/07/80/83/1371078083.db2.gz DHYYJZLDRAQLMH-ICSRJNTNSA-N 2 1 330.431 3.335 20 5 EGBDMP CC[NH+]1C[C@@H]2C[NH+](Cc3ccc4ccc5cccnc5c4n3)C[C@H]2C1 ZINC001232227638 1376419904 /nfs/dbraw/zinc/41/99/04/1376419904.db2.gz JUEBHLUIGQHOTO-QZTJIDSGSA-N 2 1 332.451 3.167 20 5 EGBDMP C[C@@H]1CCCC[N@@H+]1CCCNc1ccc([N+](=O)[O-])c2c1CC[NH+](C)C2 ZINC001167754903 1383732833 /nfs/dbraw/zinc/73/28/33/1383732833.db2.gz XHNLRRIZIKZUFG-OAHLLOKOSA-N 2 1 346.475 3.259 20 5 EGBDMP C[C@@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c2c1CC[NH+](C)C2 ZINC001167754903 1383732841 /nfs/dbraw/zinc/73/28/41/1383732841.db2.gz XHNLRRIZIKZUFG-OAHLLOKOSA-N 2 1 346.475 3.259 20 5 EGBDMP C[C@@H]1CCCC[NH+]1CCCNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2 ZINC001167754903 1383732842 /nfs/dbraw/zinc/73/28/42/1383732842.db2.gz XHNLRRIZIKZUFG-OAHLLOKOSA-N 2 1 346.475 3.259 20 5 EGBDMP C[C@@H]1CCCC[NH+]1CCCNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2 ZINC001167754903 1383732848 /nfs/dbraw/zinc/73/28/48/1383732848.db2.gz XHNLRRIZIKZUFG-OAHLLOKOSA-N 2 1 346.475 3.259 20 5 EGBDMP O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001168982909 1384078800 /nfs/dbraw/zinc/07/88/00/1384078800.db2.gz JEWSWXIUMXEFRN-IVDHNXQLSA-N 2 1 343.471 3.217 20 5 EGBDMP O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001169018931 1384091350 /nfs/dbraw/zinc/09/13/50/1384091350.db2.gz DQHRLVKTTZTHPR-WMZOPIPTSA-N 2 1 347.459 3.013 20 5 EGBDMP COc1ccc(C[C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC001170307594 1384287044 /nfs/dbraw/zinc/28/70/44/1384287044.db2.gz HWVSWCMQCWLLRE-HZPDHXFCSA-N 2 1 349.475 3.389 20 5 EGBDMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172900019 1384874358 /nfs/dbraw/zinc/87/43/58/1384874358.db2.gz RHFOSXHWUVOMFF-CRAIPNDOSA-N 2 1 331.460 3.164 20 5 EGBDMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC001319383654 1386093715 /nfs/dbraw/zinc/09/37/15/1386093715.db2.gz OTYVDCXDECWAGV-CRAIPNDOSA-N 2 1 331.460 3.237 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000344792448 533384443 /nfs/dbraw/zinc/38/44/43/533384443.db2.gz MSIMUQPFQXIPFF-MZLJFPOFSA-N 2 1 328.416 3.429 20 5 EGBDMP C[C@@H]1CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000246806921 141035858 /nfs/dbraw/zinc/03/58/58/141035858.db2.gz QXCFVDDCZXEJEN-WFEZPHLISA-N 2 1 326.400 3.388 20 5 EGBDMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@H]21 ZINC000346848811 156162671 /nfs/dbraw/zinc/16/26/71/156162671.db2.gz RLMORLSAEQEMGL-BMGDILEWSA-N 2 1 341.411 3.414 20 5 EGBDMP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000414811427 309103081 /nfs/dbraw/zinc/10/30/81/309103081.db2.gz WGKRJOMZQSBBGA-CZUORRHYSA-N 2 1 346.456 3.325 20 5 EGBDMP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C[NH3+])CC(C)C ZINC000423257853 309392690 /nfs/dbraw/zinc/39/26/90/309392690.db2.gz AIPQDTPDFDRUKU-ZIAGYGMSSA-N 2 1 325.478 3.429 20 5 EGBDMP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000536858806 314150527 /nfs/dbraw/zinc/15/05/27/314150527.db2.gz SIEDCJJGNUDLLX-BBWFWOEESA-N 2 1 349.475 3.443 20 5 EGBDMP C[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185736318 455610314 /nfs/dbraw/zinc/61/03/14/455610314.db2.gz IOKGLUOUZZYFFJ-JKSUJKDBSA-N 2 1 347.459 3.216 20 5 EGBDMP [NH3+]C[C@@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000261918763 455971724 /nfs/dbraw/zinc/97/17/24/455971724.db2.gz ZCRKNBLWCQDJDB-AAYGWRJKSA-N 2 1 337.423 3.282 20 5 EGBDMP C[N@H+]1CC[C@H]2[C@@H](CCCN2c2ccnc3ccc([N+](=O)[O-])cc32)C1 ZINC000601131938 460723742 /nfs/dbraw/zinc/72/37/42/460723742.db2.gz RVXXHXFZODSMIA-GUYCJALGSA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@@H+]1CC[C@H]2[C@@H](CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601131938 460723751 /nfs/dbraw/zinc/72/37/51/460723751.db2.gz RVXXHXFZODSMIA-GUYCJALGSA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@H+]1CC[C@H]2[C@@H](CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601131938 460723758 /nfs/dbraw/zinc/72/37/58/460723758.db2.gz RVXXHXFZODSMIA-GUYCJALGSA-N 2 1 326.400 3.064 20 5 EGBDMP Cc1cc(N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302106443 456289671 /nfs/dbraw/zinc/28/96/71/456289671.db2.gz XUGUDIHNBQUNBJ-KBXCAEBGSA-N 2 1 340.427 3.372 20 5 EGBDMP C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000283278372 456749959 /nfs/dbraw/zinc/74/99/59/456749959.db2.gz WZQAONPYUPQOFK-HIFRSBDPSA-N 2 1 335.423 3.477 20 5 EGBDMP C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000283278372 456749964 /nfs/dbraw/zinc/74/99/64/456749964.db2.gz WZQAONPYUPQOFK-HIFRSBDPSA-N 2 1 335.423 3.477 20 5 EGBDMP C[NH+]1CCC([C@H]2CC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000589197683 460050526 /nfs/dbraw/zinc/05/05/26/460050526.db2.gz UANRJTBIDHEGCM-SUZKBHRPSA-N 2 1 329.444 3.272 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)o2)c1 ZINC000262134598 1296619232 /nfs/dbraw/zinc/61/92/32/1296619232.db2.gz YOIWBBGXAGHGJF-UHFFFAOYSA-N 2 1 341.411 3.430 20 5 EGBDMP C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788509465 1305958913 /nfs/dbraw/zinc/95/89/13/1305958913.db2.gz YEWPVTPKNHELSX-CQSZACIVSA-N 2 1 334.464 3.482 20 5 EGBDMP C[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788509465 1305958919 /nfs/dbraw/zinc/95/89/19/1305958919.db2.gz YEWPVTPKNHELSX-CQSZACIVSA-N 2 1 334.464 3.482 20 5 EGBDMP CC(C)[N@@H+]1CC[C@@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)[C@H](C)C1 ZINC001163367477 1383033439 /nfs/dbraw/zinc/03/34/39/1383033439.db2.gz ZIGAZBCHRLKWDG-UVMHCMFPSA-N 2 1 347.463 3.053 20 5 EGBDMP CC(C)[N@H+]1CC[C@@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)[C@H](C)C1 ZINC001163367477 1383033442 /nfs/dbraw/zinc/03/34/42/1383033442.db2.gz ZIGAZBCHRLKWDG-UVMHCMFPSA-N 2 1 347.463 3.053 20 5 EGBDMP C[NH+](C)C1(CNc2cc3ccccc3c([N+](=O)[O-])c2)CC[NH+](C)CC1 ZINC001164215596 1383167015 /nfs/dbraw/zinc/16/70/15/1383167015.db2.gz HDPOHGCPFZSNCX-UHFFFAOYSA-N 2 1 342.443 3.186 20 5 EGBDMP Cn1ccnc1C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000131213050 162393804 /nfs/dbraw/zinc/39/38/04/162393804.db2.gz ZJONKRVTKCLRFB-ZDUSSCGKSA-N 2 1 348.834 3.436 20 5 EGBDMP Cn1ccnc1C[C@@H]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000131213050 162393806 /nfs/dbraw/zinc/39/38/06/162393806.db2.gz ZJONKRVTKCLRFB-ZDUSSCGKSA-N 2 1 348.834 3.436 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000414195405 309066202 /nfs/dbraw/zinc/06/62/02/309066202.db2.gz UUSOJPOZHOJYRC-LSDHHAIUSA-N 2 1 335.448 3.376 20 5 EGBDMP C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC[NH2+]C1 ZINC000414851401 309105545 /nfs/dbraw/zinc/10/55/45/309105545.db2.gz JDVZOZLSLQUHIO-KBPBESRZSA-N 2 1 329.400 3.333 20 5 EGBDMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272603611 456009606 /nfs/dbraw/zinc/00/96/06/456009606.db2.gz JJFXWXPFVPOYIG-XUJVJEKNSA-N 2 1 325.840 3.109 20 5 EGBDMP CCC[N@@H+](C)C[C@H]1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000081516797 453880979 /nfs/dbraw/zinc/88/09/79/453880979.db2.gz WMARIJRCZPWVLM-MRXNPFEDSA-N 2 1 335.448 3.027 20 5 EGBDMP CCC[NH+](C)C[C@H]1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000081516797 453880981 /nfs/dbraw/zinc/88/09/81/453880981.db2.gz WMARIJRCZPWVLM-MRXNPFEDSA-N 2 1 335.448 3.027 20 5 EGBDMP CCC[NH+](C)C[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000081516797 453880984 /nfs/dbraw/zinc/88/09/84/453880984.db2.gz WMARIJRCZPWVLM-MRXNPFEDSA-N 2 1 335.448 3.027 20 5 EGBDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000247250446 455579051 /nfs/dbraw/zinc/57/90/51/455579051.db2.gz ZPWMWVNURYKUQA-MAUKXSAKSA-N 2 1 331.460 3.237 20 5 EGBDMP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271493891 455659301 /nfs/dbraw/zinc/65/93/01/455659301.db2.gz KVZHCZTXESYTSQ-GBESFXJTSA-N 2 1 347.459 3.013 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCCn1cc[nH+]c1C ZINC000348267328 456583602 /nfs/dbraw/zinc/58/36/02/456583602.db2.gz QKZFKSCIQVAPBZ-UHFFFAOYSA-N 2 1 332.404 3.021 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCCn1cc[nH+]c1C ZINC000348267328 456583605 /nfs/dbraw/zinc/58/36/05/456583605.db2.gz QKZFKSCIQVAPBZ-UHFFFAOYSA-N 2 1 332.404 3.021 20 5 EGBDMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000354088024 457053455 /nfs/dbraw/zinc/05/34/55/457053455.db2.gz JOORFOWWPPZQPC-YPLUBFQTSA-N 2 1 347.459 3.041 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@@H]([C@H](C)[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000435368638 458120132 /nfs/dbraw/zinc/12/01/32/458120132.db2.gz BXWKQNSRQJZGHH-QWHCGFSZSA-N 2 1 345.399 3.033 20 5 EGBDMP [NH3+]CC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000442921364 459061659 /nfs/dbraw/zinc/06/16/59/459061659.db2.gz MUIKZGNEOGKACZ-AWEZNQCLSA-N 2 1 329.400 3.416 20 5 EGBDMP C[N@H+]1CCCC[C@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000599070095 460150198 /nfs/dbraw/zinc/15/01/98/460150198.db2.gz KUODJMAQTKOPFQ-CRAIPNDOSA-N 2 1 331.460 3.237 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000599070623 460150870 /nfs/dbraw/zinc/15/08/70/460150870.db2.gz MBEIKPSISYKULF-HUUCEWRRSA-N 2 1 335.448 3.376 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000599070623 460150880 /nfs/dbraw/zinc/15/08/80/460150880.db2.gz MBEIKPSISYKULF-HUUCEWRRSA-N 2 1 335.448 3.376 20 5 EGBDMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610448144 460154431 /nfs/dbraw/zinc/15/44/31/460154431.db2.gz BLJNWIGOGWSJSD-QGZVFWFLSA-N 2 1 347.459 3.027 20 5 EGBDMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610448144 460154435 /nfs/dbraw/zinc/15/44/35/460154435.db2.gz BLJNWIGOGWSJSD-QGZVFWFLSA-N 2 1 347.459 3.027 20 5 EGBDMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610448144 460154437 /nfs/dbraw/zinc/15/44/37/460154437.db2.gz BLJNWIGOGWSJSD-QGZVFWFLSA-N 2 1 347.459 3.027 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115628088 1293192511 /nfs/dbraw/zinc/19/25/11/1293192511.db2.gz RIHCSKNHBIMFRP-SJLPKXTDSA-N 2 1 349.475 3.130 20 5 EGBDMP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115628088 1293192514 /nfs/dbraw/zinc/19/25/14/1293192514.db2.gz RIHCSKNHBIMFRP-SJLPKXTDSA-N 2 1 349.475 3.130 20 5 EGBDMP [NH3+]CC[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000904406745 1317843176 /nfs/dbraw/zinc/84/31/76/1317843176.db2.gz ZHQCOADKOXTHJN-CYBMUJFWSA-N 2 1 331.441 3.494 20 5 EGBDMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169046377 1384100248 /nfs/dbraw/zinc/10/02/48/1384100248.db2.gz LNHRGAQQGKTICD-VQIMIIECSA-N 2 1 349.450 3.167 20 5 EGBDMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169046377 1384100252 /nfs/dbraw/zinc/10/02/52/1384100252.db2.gz LNHRGAQQGKTICD-VQIMIIECSA-N 2 1 349.450 3.167 20 5 EGBDMP CCC[N@@H+](CCC[NH+](C)C)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170353807 1384299506 /nfs/dbraw/zinc/29/95/06/1384299506.db2.gz FIPWDGPVXGVRKA-HNNXBMFYSA-N 2 1 337.464 3.198 20 5 EGBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C)([NH+]2CCCC2)CC1 ZINC001173233358 1384941495 /nfs/dbraw/zinc/94/14/95/1384941495.db2.gz VSOVKHXBGUGSID-MRXNPFEDSA-N 2 1 331.460 3.476 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000078378126 217045387 /nfs/dbraw/zinc/04/53/87/217045387.db2.gz IKBVDLFFDWXPCH-UHFFFAOYSA-N 2 1 339.439 3.392 20 5 EGBDMP C[N@H+]1C[C@@H]2C[NH+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C[C@@H]2C1 ZINC000194535398 266126307 /nfs/dbraw/zinc/12/63/07/266126307.db2.gz TVCMHKQFFCJRMI-GASCZTMLSA-N 2 1 343.452 3.317 20 5 EGBDMP C[N@@H+]1C[C@@H]2C[NH+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C[C@@H]2C1 ZINC000194535398 266126309 /nfs/dbraw/zinc/12/63/09/266126309.db2.gz TVCMHKQFFCJRMI-GASCZTMLSA-N 2 1 343.452 3.317 20 5 EGBDMP C[NH+]1C[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C[C@@H]2C1 ZINC000194535398 266126311 /nfs/dbraw/zinc/12/63/11/266126311.db2.gz TVCMHKQFFCJRMI-GASCZTMLSA-N 2 1 343.452 3.317 20 5 EGBDMP C[NH+]1C[C@@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C[C@@H]2C1 ZINC000194535398 266126315 /nfs/dbraw/zinc/12/63/15/266126315.db2.gz TVCMHKQFFCJRMI-GASCZTMLSA-N 2 1 343.452 3.317 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CCC2 ZINC000192700141 275037750 /nfs/dbraw/zinc/03/77/50/275037750.db2.gz OFEZHRUAUYACTL-IBGZPJMESA-N 2 1 329.444 3.436 20 5 EGBDMP CC[N@@H+]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000279609676 275343832 /nfs/dbraw/zinc/34/38/32/275343832.db2.gz XGUMQDTWKJUFKR-IAQYHMDHSA-N 2 1 345.365 3.434 20 5 EGBDMP CC[N@H+]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@H](C)C1 ZINC000279609676 275343834 /nfs/dbraw/zinc/34/38/34/275343834.db2.gz XGUMQDTWKJUFKR-IAQYHMDHSA-N 2 1 345.365 3.434 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CCCC2 ZINC000417331903 309202031 /nfs/dbraw/zinc/20/20/31/309202031.db2.gz WOTFJISLTJNDKU-LIRRHRJNSA-N 2 1 329.444 3.436 20 5 EGBDMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451545980 310184674 /nfs/dbraw/zinc/18/46/74/310184674.db2.gz ILLIXBZLWLNKQR-KRWDZBQOSA-N 2 1 328.416 3.369 20 5 EGBDMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451545980 310184675 /nfs/dbraw/zinc/18/46/75/310184675.db2.gz ILLIXBZLWLNKQR-KRWDZBQOSA-N 2 1 328.416 3.369 20 5 EGBDMP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000125517473 454829322 /nfs/dbraw/zinc/82/93/22/454829322.db2.gz SSFABCQSCWTRGZ-CQSZACIVSA-N 2 1 329.400 3.238 20 5 EGBDMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000125517473 454829327 /nfs/dbraw/zinc/82/93/27/454829327.db2.gz SSFABCQSCWTRGZ-CQSZACIVSA-N 2 1 329.400 3.238 20 5 EGBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192824190 455700837 /nfs/dbraw/zinc/70/08/37/455700837.db2.gz ZWNAGBAZERFJFB-FZKQIMNGSA-N 2 1 328.416 3.403 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CCC[C@H](C[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000435392106 458135217 /nfs/dbraw/zinc/13/52/17/458135217.db2.gz GAQKAFAJGYPOFV-CYBMUJFWSA-N 2 1 345.399 3.034 20 5 EGBDMP Cc1cc(N2CC[C@]3(C2)CCC[N@H+](C)C3)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000590141920 459092109 /nfs/dbraw/zinc/09/21/09/459092109.db2.gz KHLHVEONGMXLQK-LJQANCHMSA-N 2 1 340.427 3.374 20 5 EGBDMP Cc1cc(N[C@@H]2C[N@H+](C)Cc3ccccc32)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000543047074 459619630 /nfs/dbraw/zinc/61/96/30/459619630.db2.gz PADZZCZYPSJDFC-HXUWFJFHSA-N 2 1 348.406 3.472 20 5 EGBDMP O=[N+]([O-])c1ccc(C[N@@H+]2CCCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000602846013 460158505 /nfs/dbraw/zinc/15/85/05/460158505.db2.gz OKYXHMDJWSZXMI-UHFFFAOYSA-N 2 1 346.818 3.356 20 5 EGBDMP O=[N+]([O-])c1ccc(C[N@H+]2CCCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000602846013 460158511 /nfs/dbraw/zinc/15/85/11/460158511.db2.gz OKYXHMDJWSZXMI-UHFFFAOYSA-N 2 1 346.818 3.356 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCN(c3cc[nH+]cc3)CC2)c1 ZINC000878744899 1300171834 /nfs/dbraw/zinc/17/18/34/1300171834.db2.gz ZJPOHEQEQPHGLW-UHFFFAOYSA-N 2 1 346.818 3.356 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCN(c3cc[nH+]cc3)CC2)c1 ZINC000878744899 1300171837 /nfs/dbraw/zinc/17/18/37/1300171837.db2.gz ZJPOHEQEQPHGLW-UHFFFAOYSA-N 2 1 346.818 3.356 20 5 EGBDMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815559753 1319014628 /nfs/dbraw/zinc/01/46/28/1319014628.db2.gz PFVOASKBXZMGHK-GJZGRUSLSA-N 2 1 334.464 3.482 20 5 EGBDMP [NH3+]C[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CCCCC1 ZINC000841039554 1321206973 /nfs/dbraw/zinc/20/69/73/1321206973.db2.gz TYGHOHPRCHRIAI-LJQANCHMSA-N 2 1 346.475 3.061 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c1 ZINC000843127896 1321474458 /nfs/dbraw/zinc/47/44/58/1321474458.db2.gz UICDNCUMXDJEDY-KBPBESRZSA-N 2 1 337.851 3.460 20 5 EGBDMP C[N@@H+](CCCC1CC[NH2+]CC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000843357688 1321505687 /nfs/dbraw/zinc/50/56/87/1321505687.db2.gz NNZYOTCMWIOFIG-UHFFFAOYSA-N 2 1 325.840 3.460 20 5 EGBDMP COc1ccc(C[C@H](C)[NH2+][C@H]2CC[N@H+](C(C)C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC001170329327 1384292525 /nfs/dbraw/zinc/29/25/25/1384292525.db2.gz OMYPATNMJDHEOF-VKJFTORMSA-N 2 1 349.475 3.243 20 5 EGBDMP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CC2 ZINC001172912953 1384876755 /nfs/dbraw/zinc/87/67/55/1384876755.db2.gz SAXNDFYRBZOKJB-MRXNPFEDSA-N 2 1 329.444 3.059 20 5 EGBDMP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC([NH+]2CCC(F)CC2)CC1 ZINC001173232477 1384941658 /nfs/dbraw/zinc/94/16/58/1384941658.db2.gz HBCMQTMKBTZCIN-HNNXBMFYSA-N 2 1 349.450 3.424 20 5 EGBDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178696296 232385643 /nfs/dbraw/zinc/38/56/43/232385643.db2.gz SFXUOVJFCZTSGK-KDOFPFPSSA-N 2 1 342.443 3.347 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)o2)cc1 ZINC000261918904 153750370 /nfs/dbraw/zinc/75/03/70/153750370.db2.gz BKQSVQMILFIBLD-UHFFFAOYSA-N 2 1 341.411 3.430 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H]4C[NH2+]C[C@H]4CC3)o2)c1 ZINC000414772991 309100020 /nfs/dbraw/zinc/10/00/20/309100020.db2.gz WBFGVCJVRTWXHR-IYBDPMFKSA-N 2 1 341.411 3.286 20 5 EGBDMP C[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCC[NH2+]C1 ZINC000414847629 309105249 /nfs/dbraw/zinc/10/52/49/309105249.db2.gz FWIIMTCMRPHSSV-HIFRSBDPSA-N 2 1 329.400 3.333 20 5 EGBDMP O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000075836278 453929889 /nfs/dbraw/zinc/92/98/89/453929889.db2.gz UJPCOYLXVXKDKE-QGZVFWFLSA-N 2 1 347.459 3.172 20 5 EGBDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000151098842 454937366 /nfs/dbraw/zinc/93/73/66/454937366.db2.gz ZPWMWVNURYKUQA-YJBOKZPZSA-N 2 1 331.460 3.237 20 5 EGBDMP Cc1c(C[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000261603753 455911128 /nfs/dbraw/zinc/91/11/28/455911128.db2.gz AVQKDFBBNQUEAB-MSOLQXFVSA-N 2 1 325.412 3.078 20 5 EGBDMP C[N@@H+]1CCC[C@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC[C@@H]21 ZINC000601130630 460722148 /nfs/dbraw/zinc/72/21/48/460722148.db2.gz NDQHDBLGZCGAPN-GUYCJALGSA-N 2 1 326.400 3.064 20 5 EGBDMP C[N@H+]1CCC[C@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC[C@@H]21 ZINC000601130630 460722154 /nfs/dbraw/zinc/72/21/54/460722154.db2.gz NDQHDBLGZCGAPN-GUYCJALGSA-N 2 1 326.400 3.064 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@]4(CC[NH2+]C4)C3)o2)cc1 ZINC000352546480 457455704 /nfs/dbraw/zinc/45/57/04/457455704.db2.gz VWSCUCBSINZIGO-IBGZPJMESA-N 2 1 341.411 3.430 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)o2)cc1 ZINC000352546480 457455707 /nfs/dbraw/zinc/45/57/07/457455707.db2.gz VWSCUCBSINZIGO-IBGZPJMESA-N 2 1 341.411 3.430 20 5 EGBDMP C[C@H]1C[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000435373700 458123946 /nfs/dbraw/zinc/12/39/46/458123946.db2.gz OCQDKMOWLQFUAC-QWHCGFSZSA-N 2 1 331.441 3.492 20 5 EGBDMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447506511 458301794 /nfs/dbraw/zinc/30/17/94/458301794.db2.gz CXYMHJRXORGIII-IXDOHACOSA-N 2 1 349.479 3.129 20 5 EGBDMP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000595026559 459220453 /nfs/dbraw/zinc/22/04/53/459220453.db2.gz PPFUGEFHZJPWDJ-CYBMUJFWSA-N 2 1 332.404 3.239 20 5 EGBDMP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c(Cl)c1 ZINC000592433665 459600237 /nfs/dbraw/zinc/60/02/37/459600237.db2.gz OOAILWWNNBQFCW-KBPBESRZSA-N 2 1 337.851 3.460 20 5 EGBDMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602514612 459978896 /nfs/dbraw/zinc/97/88/96/459978896.db2.gz OJAFPWWWBUFSAK-CQSZACIVSA-N 2 1 346.431 3.338 20 5 EGBDMP C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CCC([NH3+])CC1 ZINC000157905867 1294190754 /nfs/dbraw/zinc/19/07/54/1294190754.db2.gz BLAFLNQIMQNJJS-UHFFFAOYSA-N 2 1 342.237 3.059 20 5 EGBDMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776580614 1304173394 /nfs/dbraw/zinc/17/33/94/1304173394.db2.gz XFRVAFYMWSQFIT-LJQANCHMSA-N 2 1 349.475 3.072 20 5 EGBDMP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)cc1Cl ZINC000843127256 1321474000 /nfs/dbraw/zinc/47/40/00/1321474000.db2.gz PCPIFSKDNDETND-HUUCEWRRSA-N 2 1 337.851 3.460 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c1 ZINC000843127899 1321474589 /nfs/dbraw/zinc/47/45/89/1321474589.db2.gz UICDNCUMXDJEDY-KGLIPLIRSA-N 2 1 337.851 3.460 20 5 EGBDMP CC[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278724647 275269089 /nfs/dbraw/zinc/26/90/89/275269089.db2.gz WCDMBXZNXWSENM-QAPCUYQASA-N 2 1 335.448 3.136 20 5 EGBDMP CC[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278724647 275269091 /nfs/dbraw/zinc/26/90/91/275269091.db2.gz WCDMBXZNXWSENM-QAPCUYQASA-N 2 1 335.448 3.136 20 5 EGBDMP CCC[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cccc([N+](=O)[O-])c1 ZINC000278941327 275289707 /nfs/dbraw/zinc/28/97/07/275289707.db2.gz KDZMGACJKADKKL-YOEHRIQHSA-N 2 1 328.416 3.485 20 5 EGBDMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C[C@H]12 ZINC000414670816 309094749 /nfs/dbraw/zinc/09/47/49/309094749.db2.gz NAVKNEBUQHJFKF-VBNZEHGJSA-N 2 1 343.452 3.492 20 5 EGBDMP CC[NH+](CC)C[C@H]1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000076004341 453948888 /nfs/dbraw/zinc/94/88/88/453948888.db2.gz VLMOAKYYNUBFKR-MRXNPFEDSA-N 2 1 335.448 3.027 20 5 EGBDMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000076004341 453948892 /nfs/dbraw/zinc/94/88/92/453948892.db2.gz VLMOAKYYNUBFKR-MRXNPFEDSA-N 2 1 335.448 3.027 20 5 EGBDMP Cc1cc(NC[C@H](C)[N@@H+](C)C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000301802071 456217255 /nfs/dbraw/zinc/21/72/55/456217255.db2.gz ADAACCDBEGYYSY-ZDUSSCGKSA-N 2 1 341.415 3.255 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H]4[NH2+]CC[C@@H]4C3)o2)cc1 ZINC000427134560 457946347 /nfs/dbraw/zinc/94/63/47/457946347.db2.gz ZKYQRJFJKXLASA-RHSMWYFYSA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]4[NH2+]CC[C@@H]4C3)o2)cc1 ZINC000427134560 457946355 /nfs/dbraw/zinc/94/63/55/457946355.db2.gz ZKYQRJFJKXLASA-RHSMWYFYSA-N 2 1 327.384 3.039 20 5 EGBDMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000459734162 458462229 /nfs/dbraw/zinc/46/22/29/458462229.db2.gz OGAMHNSNTIHPLC-LBPRGKRZSA-N 2 1 343.374 3.018 20 5 EGBDMP O=[N+]([O-])c1ccccc1C[N@H+](Cc1cc2c(s1)CC[NH2+]C2)C1CC1 ZINC000873203289 1297347986 /nfs/dbraw/zinc/34/79/86/1297347986.db2.gz XCALKKISBCRBET-UHFFFAOYSA-N 2 1 343.452 3.467 20 5 EGBDMP O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)C1CC1 ZINC000873203289 1297347998 /nfs/dbraw/zinc/34/79/98/1297347998.db2.gz XCALKKISBCRBET-UHFFFAOYSA-N 2 1 343.452 3.467 20 5 EGBDMP C[NH+](C)CCC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153969563 224182720 /nfs/dbraw/zinc/18/27/20/224182720.db2.gz VKFASVSHBLILEA-UHFFFAOYSA-N 2 1 325.840 3.412 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000246840517 141037213 /nfs/dbraw/zinc/03/72/13/141037213.db2.gz ORESVFSAKUYRPP-QFBILLFUSA-N 2 1 329.444 3.086 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000246840517 141037216 /nfs/dbraw/zinc/03/72/16/141037216.db2.gz ORESVFSAKUYRPP-QFBILLFUSA-N 2 1 329.444 3.086 20 5 EGBDMP O=[N+]([O-])c1ccc(CC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000246840517 141037219 /nfs/dbraw/zinc/03/72/19/141037219.db2.gz ORESVFSAKUYRPP-QFBILLFUSA-N 2 1 329.444 3.086 20 5 EGBDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000283856891 455604043 /nfs/dbraw/zinc/60/40/43/455604043.db2.gz BKQWLAVUGWVRCN-CQSZACIVSA-N 2 1 342.443 3.480 20 5 EGBDMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000271488582 455656959 /nfs/dbraw/zinc/65/69/59/455656959.db2.gz KBYKQOOFDKNBNA-ZOCIIQOWSA-N 2 1 347.459 3.013 20 5 EGBDMP [NH3+]C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000261890710 455966178 /nfs/dbraw/zinc/96/61/78/455966178.db2.gz ZQPLYVUHZMSBAG-WBVHZDCISA-N 2 1 345.830 3.423 20 5 EGBDMP [NH3+]C[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000261890710 455966185 /nfs/dbraw/zinc/96/61/85/455966185.db2.gz ZQPLYVUHZMSBAG-WBVHZDCISA-N 2 1 345.830 3.423 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H]4[NH2+]CC[C@H]4C3)o2)cc1 ZINC000427134561 457946241 /nfs/dbraw/zinc/94/62/41/457946241.db2.gz ZKYQRJFJKXLASA-WMLDXEAASA-N 2 1 327.384 3.039 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]4[NH2+]CC[C@H]4C3)o2)cc1 ZINC000427134561 457946246 /nfs/dbraw/zinc/94/62/46/457946246.db2.gz ZKYQRJFJKXLASA-WMLDXEAASA-N 2 1 327.384 3.039 20 5 EGBDMP CC[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@H]1[NH3+] ZINC000592427667 459598599 /nfs/dbraw/zinc/59/85/99/459598599.db2.gz PASSTOGJLPUYQP-CXAGYDPISA-N 2 1 329.400 3.414 20 5 EGBDMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788525027 1305961809 /nfs/dbraw/zinc/96/18/09/1305961809.db2.gz AVCZHKAHUDWWIB-LSDHHAIUSA-N 2 1 334.464 3.340 20 5 EGBDMP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)cc1Cl ZINC000843127255 1321474169 /nfs/dbraw/zinc/47/41/69/1321474169.db2.gz PCPIFSKDNDETND-GJZGRUSLSA-N 2 1 337.851 3.460 20 5 EGBDMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000866262006 1330087088 /nfs/dbraw/zinc/08/70/88/1330087088.db2.gz ZBVHAYIFKNUXIZ-CABCVRRESA-N 2 1 337.439 3.375 20 5 EGBDMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866272025 1330088724 /nfs/dbraw/zinc/08/87/24/1330088724.db2.gz IKFGOZFCPKJPII-ZDUSSCGKSA-N 2 1 334.395 3.240 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000349155598 156368536 /nfs/dbraw/zinc/36/85/36/156368536.db2.gz WBVXVLYRAKDHSO-SCOADAFUSA-N 2 1 326.400 3.221 20 5 EGBDMP O=[N+]([O-])c1cc(C[NH2+]C2CC[NH2+]CC2)ccc1Oc1ccc(F)cc1 ZINC000414793227 309101795 /nfs/dbraw/zinc/10/17/95/309101795.db2.gz UCWCUOFBTGOFGG-UHFFFAOYSA-N 2 1 345.374 3.368 20 5 EGBDMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C[NH3+] ZINC000415131424 309122766 /nfs/dbraw/zinc/12/27/66/309122766.db2.gz SFIYNDXOKAUVPS-ZFWWWQNUSA-N 2 1 329.400 3.272 20 5 EGBDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000449212951 310045066 /nfs/dbraw/zinc/04/50/66/310045066.db2.gz UMSMKTSIXNDRNB-IAGOWNOFSA-N 2 1 333.476 3.483 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000513831480 312218589 /nfs/dbraw/zinc/21/85/89/312218589.db2.gz SAIGIKPQLVRFAP-AHCXZYCDSA-N 2 1 331.460 3.378 20 5 EGBDMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000513831480 312218590 /nfs/dbraw/zinc/21/85/90/312218590.db2.gz SAIGIKPQLVRFAP-AHCXZYCDSA-N 2 1 331.460 3.378 20 5 EGBDMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000095968178 454242251 /nfs/dbraw/zinc/24/22/51/454242251.db2.gz ZKQWYMXVXYADSG-HOTGVXAUSA-N 2 1 347.459 3.055 20 5 EGBDMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000095968177 454242515 /nfs/dbraw/zinc/24/25/15/454242515.db2.gz ZKQWYMXVXYADSG-CVEARBPZSA-N 2 1 347.459 3.055 20 5 EGBDMP Cc1cccc(NCCNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)[nH+]1 ZINC000340803433 456694456 /nfs/dbraw/zinc/69/44/56/456694456.db2.gz SDQGMEDYGXGHRB-UHFFFAOYSA-N 2 1 337.383 3.101 20 5 EGBDMP C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000283278378 456749307 /nfs/dbraw/zinc/74/93/07/456749307.db2.gz WZQAONPYUPQOFK-UKRRQHHQSA-N 2 1 335.423 3.477 20 5 EGBDMP C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000283278378 456749314 /nfs/dbraw/zinc/74/93/14/456749314.db2.gz WZQAONPYUPQOFK-UKRRQHHQSA-N 2 1 335.423 3.477 20 5 EGBDMP CC[N@H+]1CC[C@H]([NH+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000354209186 457131497 /nfs/dbraw/zinc/13/14/97/457131497.db2.gz QKMLURYKTZASKX-WBVHZDCISA-N 2 1 335.448 3.168 20 5 EGBDMP CC[NH+]1CC[C@H]([N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000354209186 457131502 /nfs/dbraw/zinc/13/15/02/457131502.db2.gz QKMLURYKTZASKX-WBVHZDCISA-N 2 1 335.448 3.168 20 5 EGBDMP CC[NH+]1CC[C@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000354209186 457131506 /nfs/dbraw/zinc/13/15/06/457131506.db2.gz QKMLURYKTZASKX-WBVHZDCISA-N 2 1 335.448 3.168 20 5 EGBDMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1[NH3+] ZINC000435373293 458125247 /nfs/dbraw/zinc/12/52/47/458125247.db2.gz DGJZOMYZBXCHMR-LRDDRELGSA-N 2 1 331.441 3.492 20 5 EGBDMP C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCC[NH2+]CC1 ZINC000435435459 458145714 /nfs/dbraw/zinc/14/57/14/458145714.db2.gz BJNRRUDDNAMYOJ-HNNXBMFYSA-N 2 1 329.400 3.429 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000470170699 458622139 /nfs/dbraw/zinc/62/21/39/458622139.db2.gz ZFIGHXAIUJNREK-XXHWWPLSSA-N 2 1 329.444 3.414 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000470170699 458622145 /nfs/dbraw/zinc/62/21/45/458622145.db2.gz ZFIGHXAIUJNREK-XXHWWPLSSA-N 2 1 329.444 3.414 20 5 EGBDMP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596094025 459518917 /nfs/dbraw/zinc/51/89/17/459518917.db2.gz HBPFAERNHZBHAQ-CRAIPNDOSA-N 2 1 329.444 3.294 20 5 EGBDMP CC[C@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@H]1[NH3+] ZINC000592427670 459598350 /nfs/dbraw/zinc/59/83/50/459598350.db2.gz PASSTOGJLPUYQP-SUMWQHHRSA-N 2 1 329.400 3.414 20 5 EGBDMP O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592433712 459600056 /nfs/dbraw/zinc/60/00/56/459600056.db2.gz PPLXAVZENZHAKO-PGHYUYILSA-N 2 1 329.444 3.320 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)s1 ZINC000574638090 459846048 /nfs/dbraw/zinc/84/60/48/459846048.db2.gz KVERDKRFHFOTIK-KGLIPLIRSA-N 2 1 343.452 3.365 20 5 EGBDMP O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)s1 ZINC000574638090 459846055 /nfs/dbraw/zinc/84/60/55/459846055.db2.gz KVERDKRFHFOTIK-KGLIPLIRSA-N 2 1 343.452 3.365 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000152865218 528607434 /nfs/dbraw/zinc/60/74/34/528607434.db2.gz UGUSMMHSVRWPLY-KBPBESRZSA-N 2 1 333.432 3.128 20 5 EGBDMP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000734510143 575504789 /nfs/dbraw/zinc/50/47/89/575504789.db2.gz RIHCSKNHBIMFRP-WMZOPIPTSA-N 2 1 349.475 3.130 20 5 EGBDMP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000734510143 575504794 /nfs/dbraw/zinc/50/47/94/575504794.db2.gz RIHCSKNHBIMFRP-WMZOPIPTSA-N 2 1 349.475 3.130 20 5 EGBDMP C[C@@H]([NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788541159 1305967037 /nfs/dbraw/zinc/96/70/37/1305967037.db2.gz XALXFMJGTMRPLC-QLFBSQMISA-N 2 1 334.464 3.196 20 5 EGBDMP C[C@@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788541159 1305967046 /nfs/dbraw/zinc/96/70/46/1305967046.db2.gz XALXFMJGTMRPLC-QLFBSQMISA-N 2 1 334.464 3.196 20 5 EGBDMP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000817906916 1319458731 /nfs/dbraw/zinc/45/87/31/1319458731.db2.gz GXPUZUNSKPUAFY-JTQLQIEISA-N 2 1 334.807 3.261 20 5 EGBDMP O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126569 1321474341 /nfs/dbraw/zinc/47/43/41/1321474341.db2.gz KMXYZKSPUIXBKL-UONOGXRCSA-N 2 1 337.851 3.460 20 5 EGBDMP COc1ccc(C[C@H](C)[NH2+][C@@H]2CC[N@H+](C(C)C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC001170329326 1384292821 /nfs/dbraw/zinc/29/28/21/1384292821.db2.gz OMYPATNMJDHEOF-RVKKMQEKSA-N 2 1 349.475 3.243 20 5 EGBDMP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000122046618 152387291 /nfs/dbraw/zinc/38/72/91/152387291.db2.gz WGCYJWUUASPACK-UHFFFAOYSA-N 2 1 349.475 3.165 20 5 EGBDMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]12 ZINC000346821584 156152084 /nfs/dbraw/zinc/15/20/84/156152084.db2.gz IUEWYBKHYQTBEX-KBRIMQKVSA-N 2 1 327.384 3.024 20 5 EGBDMP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@H]21 ZINC000346822074 156153071 /nfs/dbraw/zinc/15/30/71/156153071.db2.gz FDUPIZSKTFGOKH-IAOVAPTHSA-N 2 1 341.411 3.414 20 5 EGBDMP C[C@H]1C[N@H+](CCC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000278379269 275255834 /nfs/dbraw/zinc/25/58/34/275255834.db2.gz CXRCKPJZBHNEAY-HNAYVOBHSA-N 2 1 347.459 3.063 20 5 EGBDMP C[C@H]1C[N@@H+](CCC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000278379269 275255835 /nfs/dbraw/zinc/25/58/35/275255835.db2.gz CXRCKPJZBHNEAY-HNAYVOBHSA-N 2 1 347.459 3.063 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+](C)CC(C)(C)C[NH3+])o2)c([N+](=O)[O-])c1 ZINC000414658837 309094202 /nfs/dbraw/zinc/09/42/02/309094202.db2.gz KCAQKAXVOIHKGT-UHFFFAOYSA-N 2 1 347.415 3.280 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H]4C[NH2+]C[C@H]4CC3)o2)cc1 ZINC000414765861 309099521 /nfs/dbraw/zinc/09/95/21/309099521.db2.gz GNYLQJMAPGOLHD-IYBDPMFKSA-N 2 1 341.411 3.286 20 5 EGBDMP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC([NH3+])C1 ZINC000414782224 309100909 /nfs/dbraw/zinc/10/09/09/309100909.db2.gz XHCIUCCOTPHMIB-UHFFFAOYSA-N 2 1 335.791 3.430 20 5 EGBDMP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC([NH3+])C1 ZINC000414782224 309100910 /nfs/dbraw/zinc/10/09/10/309100910.db2.gz XHCIUCCOTPHMIB-UHFFFAOYSA-N 2 1 335.791 3.430 20 5 EGBDMP COc1ccc(-c2ccc(C[NH2+]CC[C@H]3CCC[NH2+]3)o2)c([N+](=O)[O-])c1 ZINC000414909689 309108643 /nfs/dbraw/zinc/10/86/43/309108643.db2.gz UFABJCQBDOYQOK-CYBMUJFWSA-N 2 1 345.399 3.095 20 5 EGBDMP COCCC[NH+]1CCC([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192806984 455697808 /nfs/dbraw/zinc/69/78/08/455697808.db2.gz UVADNWGQHOPLPT-IBGZPJMESA-N 2 1 347.459 3.063 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@]4(CC[NH2+]C4)C3)o2)cc1 ZINC000352546481 457455913 /nfs/dbraw/zinc/45/59/13/457455913.db2.gz VWSCUCBSINZIGO-LJQANCHMSA-N 2 1 341.411 3.430 20 5 EGBDMP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)o2)cc1 ZINC000352546481 457455916 /nfs/dbraw/zinc/45/59/16/457455916.db2.gz VWSCUCBSINZIGO-LJQANCHMSA-N 2 1 341.411 3.430 20 5 EGBDMP C[C@H]1C[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000435368845 458120657 /nfs/dbraw/zinc/12/06/57/458120657.db2.gz CESIZNXTLUBVFU-STQMWFEESA-N 2 1 331.441 3.492 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@H]([C@H](C)[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000435368639 458121202 /nfs/dbraw/zinc/12/12/02/458121202.db2.gz BXWKQNSRQJZGHH-STQMWFEESA-N 2 1 345.399 3.033 20 5 EGBDMP [NH3+]CC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000442930083 459062725 /nfs/dbraw/zinc/06/27/25/459062725.db2.gz SODIHQVLFHMSEX-AWEZNQCLSA-N 2 1 329.400 3.416 20 5 EGBDMP CC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@H]1[NH3+] ZINC000592427555 459598127 /nfs/dbraw/zinc/59/81/27/459598127.db2.gz BTHHOUODAFAISU-SUMWQHHRSA-N 2 1 329.400 3.414 20 5 EGBDMP Cn1c[nH+]cc1CCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000594005767 460052271 /nfs/dbraw/zinc/05/22/71/460052271.db2.gz NUZOOENUOGWWIW-INIZCTEOSA-N 2 1 328.416 3.141 20 5 EGBDMP Cn1c[nH+]cc1CCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000594005767 460052277 /nfs/dbraw/zinc/05/22/77/460052277.db2.gz NUZOOENUOGWWIW-INIZCTEOSA-N 2 1 328.416 3.141 20 5 EGBDMP CC[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000610818836 460241648 /nfs/dbraw/zinc/24/16/48/460241648.db2.gz HMCOQGQIUZJESO-RBUKOAKNSA-N 2 1 347.459 3.279 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000152865399 528607414 /nfs/dbraw/zinc/60/74/14/528607414.db2.gz UGUSMMHSVRWPLY-UONOGXRCSA-N 2 1 333.432 3.128 20 5 EGBDMP COc1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000769308906 1303089436 /nfs/dbraw/zinc/08/94/36/1303089436.db2.gz BPJHSJSLFSPETH-UHFFFAOYSA-N 2 1 343.427 3.297 20 5 EGBDMP [NH3+]C[C@H]1C[N@@H+](Cc2ccc3ccc4cccc5ccc2c3c45)C[C@H]1O ZINC001206463727 1371062455 /nfs/dbraw/zinc/06/24/55/1371062455.db2.gz DHYYJZLDRAQLMH-AZUAARDMSA-N 2 1 330.431 3.335 20 5 EGBDMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168999916 1384084189 /nfs/dbraw/zinc/08/41/89/1384084189.db2.gz WGYPZXBQZYTZDG-DKIMLUQUSA-N 2 1 349.450 3.343 20 5 EGBDMP COc1ccc(C[C@@H](C)[N@H+]2CCCC[C@@H](CCC[NH3+])C2)c([N+](=O)[O-])c1 ZINC001170326141 1384291610 /nfs/dbraw/zinc/29/16/10/1384291610.db2.gz FKCKVXYARBCGTP-CVEARBPZSA-N 2 1 349.475 3.375 20 5 EGBDMP Cc1c([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000278385811 268000831 /nfs/dbraw/zinc/00/08/31/268000831.db2.gz CNVGXATZDRWYFW-ZBFHGGJFSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1c([C@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000278385811 268000833 /nfs/dbraw/zinc/00/08/33/268000833.db2.gz CNVGXATZDRWYFW-ZBFHGGJFSA-N 2 1 335.448 3.055 20 5 EGBDMP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414831266 309104528 /nfs/dbraw/zinc/10/45/28/309104528.db2.gz CUDSEANKWIOAKI-CYBMUJFWSA-N 2 1 347.390 3.471 20 5 EGBDMP COc1ccc(-c2ccc(C[N@@H+]3CC[C@](C)(C[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000261617015 455914633 /nfs/dbraw/zinc/91/46/33/455914633.db2.gz BTGOUHPWRRNMCX-GOSISDBHSA-N 2 1 345.399 3.034 20 5 EGBDMP COc1ccc(-c2ccc(C[N@H+]3CC[C@](C)(C[NH3+])C3)o2)c([N+](=O)[O-])c1 ZINC000261617015 455914638 /nfs/dbraw/zinc/91/46/38/455914638.db2.gz BTGOUHPWRRNMCX-GOSISDBHSA-N 2 1 345.399 3.034 20 5 EGBDMP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@H]21 ZINC000346822081 457178769 /nfs/dbraw/zinc/17/87/69/457178769.db2.gz FDUPIZSKTFGOKH-KBRIMQKVSA-N 2 1 341.411 3.414 20 5 EGBDMP Cc1cc(N2CC[C@@]3(C2)CCC[N@H+](C)C3)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000590141919 459092834 /nfs/dbraw/zinc/09/28/34/459092834.db2.gz KHLHVEONGMXLQK-IBGZPJMESA-N 2 1 340.427 3.374 20 5 EGBDMP CCOc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000591582293 459407327 /nfs/dbraw/zinc/40/73/27/459407327.db2.gz FISUIONZBXVKDK-ZFWWWQNUSA-N 2 1 333.432 3.319 20 5 EGBDMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153753160 528339324 /nfs/dbraw/zinc/33/93/24/528339324.db2.gz AUCFTNHLEZGYQB-LJQANCHMSA-N 2 1 349.475 3.072 20 5 EGBDMP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000887133349 1303686198 /nfs/dbraw/zinc/68/61/98/1303686198.db2.gz ZGWAFUOUKVSTTM-GJZGRUSLSA-N 2 1 326.400 3.262 20 5 EGBDMP C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC000887133349 1303686204 /nfs/dbraw/zinc/68/62/04/1303686204.db2.gz ZGWAFUOUKVSTTM-GJZGRUSLSA-N 2 1 326.400 3.262 20 5 EGBDMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)CC1 ZINC000809756944 1317892045 /nfs/dbraw/zinc/89/20/45/1317892045.db2.gz VGJPTYCTJQDUHZ-HNNXBMFYSA-N 2 1 337.851 3.412 20 5 EGBDMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000859214777 1328947855 /nfs/dbraw/zinc/94/78/55/1328947855.db2.gz SIYKQIIQSHVVPO-UHFFFAOYSA-N 2 1 343.427 3.167 20 5 EGBDMP COc1ccc(C[C@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c([N+](=O)[O-])c1 ZINC001170317963 1384290166 /nfs/dbraw/zinc/29/01/66/1384290166.db2.gz MZDPOUMGLHRHJA-QSPRXWTASA-N 2 1 347.459 3.139 20 5 EGBDMP COc1ccc(C[C@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1 ZINC001170317963 1384290170 /nfs/dbraw/zinc/29/01/70/1384290170.db2.gz MZDPOUMGLHRHJA-QSPRXWTASA-N 2 1 347.459 3.139 20 5 EGBDMP C[N@@H+](C1CC1)C1CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172918511 1384878389 /nfs/dbraw/zinc/87/83/89/1384878389.db2.gz BKBGPPUGHCTPSC-IBGZPJMESA-N 2 1 343.471 3.401 20 5 EGBDMP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC([NH+]2CCC(F)CC2)CC1 ZINC001173232481 1384941712 /nfs/dbraw/zinc/94/17/12/1384941712.db2.gz HBCMQTMKBTZCIN-OAHLLOKOSA-N 2 1 349.450 3.424 20 5 EGBDMP C[NH2+]CCC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414860319 309105899 /nfs/dbraw/zinc/10/58/99/309105899.db2.gz PIOUSUWWUXZBBL-UHFFFAOYSA-N 2 1 333.363 3.225 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-] ZINC000296029867 308386660 /nfs/dbraw/zinc/38/66/60/308386660.db2.gz SSWHLOIJINJBPM-OHRKKDJYSA-N 2 1 333.432 3.269 20 5 EGBDMP CCOc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000296029867 308386661 /nfs/dbraw/zinc/38/66/61/308386661.db2.gz SSWHLOIJINJBPM-OHRKKDJYSA-N 2 1 333.432 3.269 20 5 EGBDMP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000245586272 455335761 /nfs/dbraw/zinc/33/57/61/455335761.db2.gz JWRPICUVZNOMMD-PBHICJAKSA-N 2 1 344.415 3.273 20 5 EGBDMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000247040723 455549819 /nfs/dbraw/zinc/54/98/19/455549819.db2.gz OCPBTNRUOPHABC-OWCLPIDISA-N 2 1 335.448 3.135 20 5 EGBDMP Cc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000278375602 455833597 /nfs/dbraw/zinc/83/35/97/455833597.db2.gz CCOKUQKLIUWBRC-CVEARBPZSA-N 2 1 335.448 3.055 20 5 EGBDMP Cc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000278375602 455833600 /nfs/dbraw/zinc/83/36/00/455833600.db2.gz CCOKUQKLIUWBRC-CVEARBPZSA-N 2 1 335.448 3.055 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@]4(CC[NH2+]C4)C3)o2)c1 ZINC000352545219 457453961 /nfs/dbraw/zinc/45/39/61/457453961.db2.gz HGYCBVBOJSMIJP-LJQANCHMSA-N 2 1 341.411 3.430 20 5 EGBDMP O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)o2)c1 ZINC000352545219 457453967 /nfs/dbraw/zinc/45/39/67/457453967.db2.gz HGYCBVBOJSMIJP-LJQANCHMSA-N 2 1 341.411 3.430 20 5 EGBDMP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000430133681 458407944 /nfs/dbraw/zinc/40/79/44/458407944.db2.gz QARYXSKWMAHFHC-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000430133681 458407948 /nfs/dbraw/zinc/40/79/48/458407948.db2.gz QARYXSKWMAHFHC-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000430133681 458407951 /nfs/dbraw/zinc/40/79/51/458407951.db2.gz QARYXSKWMAHFHC-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000430133681 458407957 /nfs/dbraw/zinc/40/79/57/458407957.db2.gz QARYXSKWMAHFHC-LJQANCHMSA-N 2 1 341.411 3.382 20 5 EGBDMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC000432369823 458726710 /nfs/dbraw/zinc/72/67/10/458726710.db2.gz XIAQUSKELMGPSC-TXQCQQFXSA-N 2 1 347.459 3.089 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000567907534 459188378 /nfs/dbraw/zinc/18/83/78/459188378.db2.gz KUAYDNZPAGAYGM-SKTWIKFTSA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000567907534 459188380 /nfs/dbraw/zinc/18/83/80/459188380.db2.gz KUAYDNZPAGAYGM-SKTWIKFTSA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000567907534 459188385 /nfs/dbraw/zinc/18/83/85/459188385.db2.gz KUAYDNZPAGAYGM-SKTWIKFTSA-N 2 1 329.444 3.416 20 5 EGBDMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000567907534 459188388 /nfs/dbraw/zinc/18/83/88/459188388.db2.gz KUAYDNZPAGAYGM-SKTWIKFTSA-N 2 1 329.444 3.416 20 5 EGBDMP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000595015568 459217037 /nfs/dbraw/zinc/21/70/37/459217037.db2.gz ZBYLEQNKKZOVEU-STQMWFEESA-N 2 1 332.404 3.095 20 5 EGBDMP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596094028 459518468 /nfs/dbraw/zinc/51/84/68/459518468.db2.gz HBPFAERNHZBHAQ-YJBOKZPZSA-N 2 1 329.444 3.294 20 5 EGBDMP [NH3+]C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CCCCC1 ZINC000841039553 1321206585 /nfs/dbraw/zinc/20/65/85/1321206585.db2.gz TYGHOHPRCHRIAI-IBGZPJMESA-N 2 1 346.475 3.061 20 5 EGBDMP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000866393433 1330105995 /nfs/dbraw/zinc/10/59/95/1330105995.db2.gz OEBAPHCGUBDWBN-GOEBONIOSA-N 2 1 349.450 3.377 20 5 EGBDMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168998254 1384083019 /nfs/dbraw/zinc/08/30/19/1384083019.db2.gz KNPVVEUXIYVFMP-QYZOEREBSA-N 2 1 345.487 3.322 20 5 EGBDMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168998254 1384083023 /nfs/dbraw/zinc/08/30/23/1384083023.db2.gz KNPVVEUXIYVFMP-QYZOEREBSA-N 2 1 345.487 3.322 20 5 EGBDMP