smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccccc1C[C@@H](C)N(C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430218740 1015074836 /nfs/dbraw/zinc/07/48/36/1015074836.db2.gz KXHVCLKCXYLBML-CQSZACIVSA-N 0 3 344.411 3.675 20 5 EHBDHN CC[C@@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000340153740 1016507307 /nfs/dbraw/zinc/50/73/07/1016507307.db2.gz BKZUJMQUUZUVBB-RDTXWAMCSA-N 0 3 341.411 3.971 20 5 EHBDHN C[C@H]1CCC[C@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001167226895 1016663500 /nfs/dbraw/zinc/66/35/00/1016663500.db2.gz DJIBNAFALYIQGT-AAEUAGOBSA-N 0 3 339.823 3.697 20 5 EHBDHN CC[C@H](NCCOc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000538188642 1032206468 /nfs/dbraw/zinc/20/64/68/1032206468.db2.gz UHZBDPBBBMGCBO-HNNXBMFYSA-N 0 3 336.338 3.993 20 5 EHBDHN COc1ccc(C2CCN([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)nc1 ZINC000593040580 1032675487 /nfs/dbraw/zinc/67/54/87/1032675487.db2.gz HPRRGILURWWBTC-AWEZNQCLSA-N 0 3 341.411 3.939 20 5 EHBDHN CC(C)n1ncc2c1C[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000377246774 1017523376 /nfs/dbraw/zinc/52/33/76/1017523376.db2.gz WKOKZPOXFLXEKQ-AWEZNQCLSA-N 0 3 348.834 3.673 20 5 EHBDHN CC(C)n1ncc2c1C[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000377246775 1017523699 /nfs/dbraw/zinc/52/36/99/1017523699.db2.gz WKOKZPOXFLXEKQ-CQSZACIVSA-N 0 3 348.834 3.673 20 5 EHBDHN CCOc1cc(CN2CC[C@H](c3cc(C)ccn3)C2)ccc1[N+](=O)[O-] ZINC000579608381 1019258836 /nfs/dbraw/zinc/25/88/36/1019258836.db2.gz RZURRZXMDNDFFZ-INIZCTEOSA-N 0 3 341.411 3.686 20 5 EHBDHN CC(C)[C@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)c1cccnc1 ZINC000602573474 1032979830 /nfs/dbraw/zinc/97/98/30/1032979830.db2.gz QMPYKQMGLTZUCF-HNNXBMFYSA-N 0 3 340.383 3.660 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCC[C@H]1CCCCO1 ZINC000602595504 1032990590 /nfs/dbraw/zinc/99/05/90/1032990590.db2.gz BNGQLVXSZUFKOS-CYBMUJFWSA-N 0 3 332.322 3.662 20 5 EHBDHN CC(C)c1ccc(CN(CCn2cc([N+](=O)[O-])cn2)C2CC2)cc1 ZINC000471717324 1021828068 /nfs/dbraw/zinc/82/80/68/1021828068.db2.gz YAMDKQQTSCEQED-UHFFFAOYSA-N 0 3 328.416 3.579 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441295803 1022138139 /nfs/dbraw/zinc/13/81/39/1022138139.db2.gz UATQVSYPTUBEPB-CVEARBPZSA-N 0 3 348.443 3.631 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNC[C@H]3CCCC(F)(F)C3)nc2c1 ZINC000602652520 1033040874 /nfs/dbraw/zinc/04/08/74/1033040874.db2.gz MDGJPWWIVTXTDQ-JTQLQIEISA-N 0 3 325.315 3.651 20 5 EHBDHN CC[C@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)CC(F)(F)F ZINC000602692229 1033072459 /nfs/dbraw/zinc/07/24/59/1033072459.db2.gz WLCWDZCXZTYFKE-VIFPVBQESA-N 0 3 331.294 3.804 20 5 EHBDHN CCO[C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000610930482 1023877501 /nfs/dbraw/zinc/87/75/01/1023877501.db2.gz SMUSNBJDDDJKOQ-INIZCTEOSA-N 0 3 330.384 3.856 20 5 EHBDHN C[C@@H](NC1CC(OCc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000463385173 1024333537 /nfs/dbraw/zinc/33/35/37/1024333537.db2.gz AAPIMBPREPRLMO-ODIFPOPNSA-N 0 3 326.396 3.993 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CN[C@@H]3C[C@H]4CCC[C@H]43)cs2)c1 ZINC000897952464 1033259468 /nfs/dbraw/zinc/25/94/68/1033259468.db2.gz GRIRILLYCPDBSO-HFBAOOFYSA-N 0 3 329.425 3.997 20 5 EHBDHN CO[C@@H](CNC(C)(C)c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000451057494 1025479302 /nfs/dbraw/zinc/47/93/02/1025479302.db2.gz SWSAVXVBRLMFIU-MRXNPFEDSA-N 0 3 328.412 3.677 20 5 EHBDHN CC[C@H](N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000121056829 1025621616 /nfs/dbraw/zinc/62/16/16/1025621616.db2.gz BCTYOOSJPPJNRL-ZBFHGGJFSA-N 0 3 341.411 3.971 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451412184 1025945056 /nfs/dbraw/zinc/94/50/56/1025945056.db2.gz FWFSNZZCDLBFFL-KURKYZTESA-N 0 3 348.443 3.507 20 5 EHBDHN CCOc1ccccc1OCCN(C)CCc1ccccc1[N+](=O)[O-] ZINC000511109433 1026069218 /nfs/dbraw/zinc/06/92/18/1026069218.db2.gz RWKVGWOCXNZFOK-UHFFFAOYSA-N 0 3 344.411 3.547 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2ncccc2[O-])s1 ZINC000475345114 1026503802 /nfs/dbraw/zinc/50/38/02/1026503802.db2.gz ZRUHADMZCLSIOU-UHFFFAOYSA-N 0 3 341.392 3.714 20 5 EHBDHN C[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000563418284 1026790050 /nfs/dbraw/zinc/79/00/50/1026790050.db2.gz NVLNIOWGVDTDBA-ACJLOTCBSA-N 0 3 349.394 3.514 20 5 EHBDHN C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000310435247 1027005200 /nfs/dbraw/zinc/00/52/00/1027005200.db2.gz OFOAGBQALWHMSP-UPJWGTAASA-N 0 3 337.420 3.547 20 5 EHBDHN O=[N+]([O-])c1ccccc1CNC[C@@H](c1ccco1)N1CCCCC1 ZINC000061013464 1027268876 /nfs/dbraw/zinc/26/88/76/1027268876.db2.gz ADGDTRPNNYCVNE-KRWDZBQOSA-N 0 3 329.400 3.505 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000420945041 1027906185 /nfs/dbraw/zinc/90/61/85/1027906185.db2.gz KEZDZFBYOUDFNJ-LBPRGKRZSA-N 0 3 332.322 3.638 20 5 EHBDHN Cc1cnc(NC[C@H]2CCCN(Cc3cccs3)C2)c([N+](=O)[O-])c1 ZINC000078656082 1028046477 /nfs/dbraw/zinc/04/64/77/1028046477.db2.gz ORPDITTUJGKMLN-CQSZACIVSA-N 0 3 346.456 3.684 20 5 EHBDHN CCO[C@H]1C[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(CC)CC ZINC000444691013 1028163970 /nfs/dbraw/zinc/16/39/70/1028163970.db2.gz WRENWHMBJIWOAU-HOTGVXAUSA-N 0 3 346.431 3.545 20 5 EHBDHN O=[N+]([O-])c1cccc(CNCCOc2ccc(C(F)(F)F)cc2)c1 ZINC000237844897 1029458723 /nfs/dbraw/zinc/45/87/23/1029458723.db2.gz NXRAVWHPBNLNLS-UHFFFAOYSA-N 0 3 340.301 3.782 20 5 EHBDHN CC[C@H](C)[C@@H](C)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285223 1029574385 /nfs/dbraw/zinc/57/43/85/1029574385.db2.gz XUAKTXAIKNBLPT-GXTWGEPZSA-N 0 3 333.432 3.741 20 5 EHBDHN CC[C@H](C)N[C@H](CNc1nc(C)cc(C)c1[N+](=O)[O-])c1ccco1 ZINC000343258794 1029959625 /nfs/dbraw/zinc/95/96/25/1029959625.db2.gz WDZPYGKJWYWTFV-GXTWGEPZSA-N 0 3 332.404 3.741 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN2CCC3(CC2)C(F)(F)C3(F)F)cc1 ZINC000593054974 1031171995 /nfs/dbraw/zinc/17/19/95/1031171995.db2.gz OTBZLCPMDBKFEK-UHFFFAOYSA-N 0 3 332.297 3.504 20 5 EHBDHN Cc1cc(NC[C@@H](c2cccs2)N2CCCC2)ncc1[N+](=O)[O-] ZINC000080585176 1031196950 /nfs/dbraw/zinc/19/69/50/1031196950.db2.gz GQYRYKQAFHGPKC-AWEZNQCLSA-N 0 3 332.429 3.609 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@@H]3CO[C@@H](C4CC4)C3)o2)c1 ZINC000599006382 1033640125 /nfs/dbraw/zinc/64/01/25/1033640125.db2.gz HTWYBDMZTYYTAF-KBXCAEBGSA-N 0 3 328.368 3.512 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NC[C@@H](CO)CC2CC2)c2ccccc2)c1 ZINC000595089276 1033699214 /nfs/dbraw/zinc/69/92/14/1033699214.db2.gz NBWMPSDUGGHEPQ-OXJNMPFZSA-N 0 3 340.423 3.682 20 5 EHBDHN CN(Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@H]1CCc2ccccc21 ZINC000595881795 1034017859 /nfs/dbraw/zinc/01/78/59/1034017859.db2.gz WSSMANCLKGFVCX-CQSZACIVSA-N 0 3 337.379 3.898 20 5 EHBDHN CCCN(CC(=O)Nc1ccccc1[N+](=O)[O-])CC1CCCCC1 ZINC000060495833 1034600780 /nfs/dbraw/zinc/60/07/80/1034600780.db2.gz SAYKZSIPLAQHIB-UHFFFAOYSA-N 0 3 333.432 3.826 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC([C@H]2CCCCO2)CC1 ZINC000597225015 1034625583 /nfs/dbraw/zinc/62/55/83/1034625583.db2.gz LOTZPSJAFNQSCE-WSSFADSRSA-N 0 3 330.428 3.889 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@@H]1CCC[C@@H]1OCc1ccccc1 ZINC000450975426 1034975276 /nfs/dbraw/zinc/97/52/76/1034975276.db2.gz XMDWBJDPGIUIPV-MJGOQNOKSA-N 0 3 326.396 3.822 20 5 EHBDHN Cc1c(F)cccc1NC(=O)CCN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000411766360 1035013680 /nfs/dbraw/zinc/01/36/80/1035013680.db2.gz BODZRTHIROCZTM-ZDUSSCGKSA-N 0 3 345.374 3.722 20 5 EHBDHN CC(C)(C)c1ccc([C@@H]2CCCN2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000472452593 1035127325 /nfs/dbraw/zinc/12/73/25/1035127325.db2.gz YMMNZCBSAZQKRF-SFHVURJKSA-N 0 3 342.443 3.926 20 5 EHBDHN COc1cc(CCNCc2ccc([N+](=O)[O-])cc2F)ccc1Cl ZINC000590196467 1036793906 /nfs/dbraw/zinc/79/39/06/1036793906.db2.gz BNJNKOFBVSARRY-UHFFFAOYSA-N 0 3 338.766 3.728 20 5 EHBDHN C[C@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)Oc1ccccc1F ZINC000761526609 1037102052 /nfs/dbraw/zinc/10/20/52/1037102052.db2.gz PCCWADCHRHTIQH-LLVKDONJSA-N 0 3 338.766 3.944 20 5 EHBDHN Cc1ccc(-c2noc([C@H](C)N3[C@H](C)CC[C@H]3C)n2)cc1[N+](=O)[O-] ZINC000443206330 1037136927 /nfs/dbraw/zinc/13/69/27/1037136927.db2.gz WFRXGZGNSDPHSO-UPJWGTAASA-N 0 3 330.388 3.887 20 5 EHBDHN CO[C@@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000493308450 1037242564 /nfs/dbraw/zinc/24/25/64/1037242564.db2.gz YPFXHIWGHXBHSG-RBUKOAKNSA-N 0 3 328.412 3.945 20 5 EHBDHN CCN(CCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177012126 1037323353 /nfs/dbraw/zinc/32/33/53/1037323353.db2.gz NFEGWQLDCDYXDT-UHFFFAOYSA-N 0 3 325.368 3.801 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@@H]2CCCOc3ccc(F)cc32)cc1 ZINC000540170177 1037639221 /nfs/dbraw/zinc/63/92/21/1037639221.db2.gz ZHAWBIZKYDYEAE-QGZVFWFLSA-N 0 3 346.358 3.616 20 5 EHBDHN Cc1cc(C)cc([C@@H](C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000540410481 1037907528 /nfs/dbraw/zinc/90/75/28/1037907528.db2.gz ZNLCJWYWDFNHES-CABCVRRESA-N 0 3 341.411 3.889 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCNC1(c2ccc(Cl)cc2)CC1 ZINC000553333063 1039981273 /nfs/dbraw/zinc/98/12/73/1039981273.db2.gz BLNXDEIKLIBXOV-UHFFFAOYSA-N 0 3 332.787 3.906 20 5 EHBDHN CCOc1cc(NC[C@H](c2cccc(F)c2)N(C)C)ccc1[N+](=O)[O-] ZINC000486449160 1040145941 /nfs/dbraw/zinc/14/59/41/1040145941.db2.gz IMBXQKSVBHFBAK-QGZVFWFLSA-N 0 3 347.390 3.847 20 5 EHBDHN CC[C@H]1CCCCCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000150735775 1040885441 /nfs/dbraw/zinc/88/54/41/1040885441.db2.gz SHPRGLJINCGHBX-AWEZNQCLSA-N 0 3 330.388 3.799 20 5 EHBDHN COc1ccccc1[C@@H]1CCN(Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000093593194 1042375976 /nfs/dbraw/zinc/37/59/76/1042375976.db2.gz PTUAHWYBLSWISY-MRXNPFEDSA-N 0 3 326.396 3.901 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CNC[C@@H](c1ccco1)N1CCCCC1 ZINC000183422375 1125556015 /nfs/dbraw/zinc/55/60/15/1125556015.db2.gz LEBHYGKXXSRZLY-SFHVURJKSA-N 0 3 343.427 3.813 20 5 EHBDHN C[C@H](NCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000185547051 1126932825 /nfs/dbraw/zinc/93/28/25/1126932825.db2.gz XILLVHZSWMXRDZ-NHYWBVRUSA-N 0 3 332.787 3.903 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(C[C@H](O)c2cccc(Cl)c2)C2CC2)cc1 ZINC000764491632 1127499048 /nfs/dbraw/zinc/49/90/48/1127499048.db2.gz DLYJTQIFZXOEDH-SFHVURJKSA-N 0 3 346.814 3.946 20 5 EHBDHN CC(C)(C)[C@@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000273063151 1128438685 /nfs/dbraw/zinc/43/86/85/1128438685.db2.gz MVAURWNQFASBPI-DOMZBBRYSA-N 0 3 326.824 3.932 20 5 EHBDHN C[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CN1C1CC1 ZINC000301554965 1128496529 /nfs/dbraw/zinc/49/65/29/1128496529.db2.gz ICXPBAWNVXSAHO-MWLCHTKSSA-N 0 3 329.322 3.651 20 5 EHBDHN Cc1nc(NC[C@@H](c2ccc(Cl)cc2)N(C)C)ccc1[N+](=O)[O-] ZINC000301633302 1128778732 /nfs/dbraw/zinc/77/87/32/1128778732.db2.gz DHDBCYHDJKPFOH-HNNXBMFYSA-N 0 3 334.807 3.666 20 5 EHBDHN CC(C)N(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC1CCC1 ZINC000193202303 1120975309 /nfs/dbraw/zinc/97/53/09/1120975309.db2.gz VDESHMOBECWEDV-UHFFFAOYSA-N 0 3 330.388 3.655 20 5 EHBDHN CC(C)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1CCC1 ZINC000193216784 1120985506 /nfs/dbraw/zinc/98/55/06/1120985506.db2.gz AMXCVJNZMWWTIS-UHFFFAOYSA-N 0 3 339.823 3.697 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)cnc1N[C@@H](CN1CCCC1)c1ccccc1 ZINC000301737761 1129012982 /nfs/dbraw/zinc/01/29/82/1129012982.db2.gz IPRLWUZLOQZDCD-HNNXBMFYSA-N 0 3 346.818 3.892 20 5 EHBDHN COC(=O)Nc1cccc(CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000496676990 1122152832 /nfs/dbraw/zinc/15/28/32/1122152832.db2.gz FIXJDTTWGGCZDR-MRXNPFEDSA-N 0 3 341.367 3.550 20 5 EHBDHN Cc1nc2c(o1)CCC[C@H]2NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000925463872 1123031979 /nfs/dbraw/zinc/03/19/79/1123031979.db2.gz BBJHFMUQSMJAMX-MRXNPFEDSA-N 0 3 329.400 3.881 20 5 EHBDHN CCCN(Cn1nc(C)c([N+](=O)[O-])c1C)[C@H]1CCc2ccccc2C1 ZINC000919951298 1123243725 /nfs/dbraw/zinc/24/37/25/1123243725.db2.gz QNXXOHVUDFGCKE-SFHVURJKSA-N 0 3 342.443 3.635 20 5 EHBDHN Cc1cc(F)ccc1[C@H](O)CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130744584 1123554254 /nfs/dbraw/zinc/55/42/54/1123554254.db2.gz LAXLRXJCQCVPFF-LJQANCHMSA-N 0 3 344.386 3.740 20 5 EHBDHN CC[C@]1(NCc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)CCOC1 ZINC000616487693 1124011629 /nfs/dbraw/zinc/01/16/29/1124011629.db2.gz CISCFLLVXZDXOL-SFHVURJKSA-N 0 3 346.383 3.522 20 5 EHBDHN COc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000922538808 1129565805 /nfs/dbraw/zinc/56/58/05/1129565805.db2.gz WKMYQYYEKMNKGT-CYBMUJFWSA-N 0 3 330.384 3.771 20 5 EHBDHN COc1ccc([C@H]2CCN(Cc3ccc(OC)c([N+](=O)[O-])c3)C2)cc1 ZINC000155214939 1129619629 /nfs/dbraw/zinc/61/96/29/1129619629.db2.gz HVUKIXAKCTWXNN-INIZCTEOSA-N 0 3 342.395 3.602 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(C(=O)N(C)C(C)C)CC1 ZINC000330738182 1129644205 /nfs/dbraw/zinc/64/42/05/1129644205.db2.gz ZBKKHNNNDSBRBC-OAHLLOKOSA-N 0 3 347.459 3.543 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@H]3C3CCCC3)n2)cc1 ZINC000055927280 1129790488 /nfs/dbraw/zinc/79/04/88/1129790488.db2.gz ZTKOZVOKWGNXQT-INIZCTEOSA-N 0 3 342.399 3.799 20 5 EHBDHN CC(C)(NCCC(=O)Nc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000429227610 1130068724 /nfs/dbraw/zinc/06/87/24/1130068724.db2.gz PLUSNHQETZOSKY-UHFFFAOYSA-N 0 3 345.374 3.587 20 5 EHBDHN Cn1cc(CN2CCC[C@H]3CCC[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000245561735 1130239053 /nfs/dbraw/zinc/23/90/53/1130239053.db2.gz OHBGQELCUQLXGE-RDTXWAMCSA-N 0 3 340.427 3.760 20 5 EHBDHN CC(C)n1cnnc1[C@@H]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246191464 1130353893 /nfs/dbraw/zinc/35/38/93/1130353893.db2.gz UBSOWEIZGBFNTQ-GDBMZVCRSA-N 0 3 343.431 3.708 20 5 EHBDHN CC1(C)CCc2cc(CNCc3ccc([N+](=O)[O-])cc3)ccc2O1 ZINC000731677545 1130831142 /nfs/dbraw/zinc/83/11/42/1130831142.db2.gz UTYVERWGRQOALY-UHFFFAOYSA-N 0 3 326.396 3.988 20 5 EHBDHN CCC1CCC(N(C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000742147040 1131691262 /nfs/dbraw/zinc/69/12/62/1131691262.db2.gz YTOHJMCJVRSJPX-UHFFFAOYSA-N 0 3 343.431 3.711 20 5 EHBDHN CC(=O)[C@H](N[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172901662 1131885327 /nfs/dbraw/zinc/88/53/27/1131885327.db2.gz PRNYAYTUACMKCI-ICSRJNTNSA-N 0 3 338.407 3.762 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@@H]3CCC[C@H]32)c1F ZINC001173196494 1131996767 /nfs/dbraw/zinc/99/67/67/1131996767.db2.gz NAAHBAXLNOBTRT-KCQAQPDRSA-N 0 3 336.407 3.938 20 5 EHBDHN Cc1nn(CN2CCC[C@H]2CCC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000767766238 1133050293 /nfs/dbraw/zinc/05/02/93/1133050293.db2.gz RLKANKYCLLOLJY-AWEZNQCLSA-N 0 3 331.420 3.506 20 5 EHBDHN C[C@H]1CCc2nc(CNCCc3ccccc3[N+](=O)[O-])sc2C1 ZINC001178609606 1133185856 /nfs/dbraw/zinc/18/58/56/1133185856.db2.gz IMMNCLDZLQESON-LBPRGKRZSA-N 0 3 331.441 3.508 20 5 EHBDHN COC[C@H](CC(C)(C)C)NCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001179034823 1133225306 /nfs/dbraw/zinc/22/53/06/1133225306.db2.gz RBIYFMLAXAOKNA-LBPRGKRZSA-N 0 3 346.374 3.737 20 5 EHBDHN COC[C@@H](CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC001179662715 1133272084 /nfs/dbraw/zinc/27/20/84/1133272084.db2.gz TYFYCQRFKRKSFH-CQSZACIVSA-N 0 3 349.456 3.727 20 5 EHBDHN CCN(C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H](O)c1ccc(C)cc1 ZINC000769483375 1133288984 /nfs/dbraw/zinc/28/89/84/1133288984.db2.gz MNSYVIMCBYMZKI-CPSHHHPTSA-N 0 3 340.423 3.972 20 5 EHBDHN CC(C)C[C@@]1(CO)CCCN1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000789508204 1134288238 /nfs/dbraw/zinc/28/82/38/1134288238.db2.gz ZUZYNILOULPDBO-MRXNPFEDSA-N 0 3 326.824 3.621 20 5 EHBDHN CC[C@](C)(NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000775389786 1134704037 /nfs/dbraw/zinc/70/40/37/1134704037.db2.gz HBEHNSPECMIUGB-IBGZPJMESA-N 0 3 341.411 3.757 20 5 EHBDHN COc1ccc(C[C@H](C)NCc2cc(F)ccc2F)c([N+](=O)[O-])c1 ZINC001170298093 1134737892 /nfs/dbraw/zinc/73/78/92/1134737892.db2.gz ZXPSZIMHVBTIPF-NSHDSACASA-N 0 3 336.338 3.602 20 5 EHBDHN CC[C@H](C)N1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC001170316300 1134745491 /nfs/dbraw/zinc/74/54/91/1134745491.db2.gz WGMSFYCLZNMNMT-LBPRGKRZSA-N 0 3 345.365 3.530 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCC(OC3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170334496 1134751649 /nfs/dbraw/zinc/75/16/49/1134751649.db2.gz FPQYDHKQZDHAFM-AWEZNQCLSA-N 0 3 348.443 3.568 20 5 EHBDHN CCN(CC)[C@@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804386454 1135052729 /nfs/dbraw/zinc/05/27/29/1135052729.db2.gz CHORWQKFYOVTMZ-AWEZNQCLSA-N 0 3 348.359 3.591 20 5 EHBDHN CC(C)O[C@H]1C[C@@H](NCc2cc(Cl)ccc2[N+](=O)[O-])C1(C)C ZINC001194457534 1135270094 /nfs/dbraw/zinc/27/00/94/1135270094.db2.gz NVYPKEHUIDKLNS-CABCVRRESA-N 0 3 326.824 3.930 20 5 EHBDHN Cc1c(CN2C[C@H](C)C[C@@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195250333 1135398862 /nfs/dbraw/zinc/39/88/62/1135398862.db2.gz MBUCTEKVNBDKTA-CZUORRHYSA-N 0 3 348.443 3.703 20 5 EHBDHN CCCCC[C@H]1CCCCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001196329082 1135546390 /nfs/dbraw/zinc/54/63/90/1135546390.db2.gz KZTXKRFUMCOYPX-INIZCTEOSA-N 0 3 333.432 3.629 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@H](C3CCOCC3)C2)c(F)c1 ZINC001197283386 1135672690 /nfs/dbraw/zinc/67/26/90/1135672690.db2.gz BHKRZLWOBZZZHT-HNNXBMFYSA-N 0 3 336.407 3.763 20 5 EHBDHN Cc1cc(F)ccc1-c1ccc(C(=O)OCC(C)[N+](=O)[O-])cc1F ZINC000813102679 1136288322 /nfs/dbraw/zinc/28/83/22/1136288322.db2.gz ISDRLHGESFCIOL-NSHDSACASA-N 0 3 335.306 3.762 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776591252 1136451238 /nfs/dbraw/zinc/45/12/38/1136451238.db2.gz IETFKUXXOIPIBY-RTBURBONSA-N 0 3 344.386 3.995 20 5 EHBDHN Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818961854 1136891111 /nfs/dbraw/zinc/89/11/11/1136891111.db2.gz VVOIPONRXYOYGE-IRXDYDNUSA-N 0 3 344.411 3.833 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCCc3c(F)cc(F)cc32)c1 ZINC000819333739 1136932398 /nfs/dbraw/zinc/93/23/98/1136932398.db2.gz REAOCOISQOVEML-ZWKOTPCHSA-N 0 3 348.349 3.574 20 5 EHBDHN CC([C@@H](OC(=O)CCc1cccs1)c1ccccc1F)[N+](=O)[O-] ZINC000845872280 1137315848 /nfs/dbraw/zinc/31/58/48/1137315848.db2.gz FWPYYYIQNXWHLP-MEDUHNTESA-N 0 3 337.372 3.770 20 5 EHBDHN CC([C@@H](OC(=O)CCc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845874222 1137316106 /nfs/dbraw/zinc/31/61/06/1137316106.db2.gz YJZIRLBEZGCSOV-FZKQIMNGSA-N 0 3 331.343 3.708 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H](C)c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881190 1137316797 /nfs/dbraw/zinc/31/67/97/1137316797.db2.gz ZENLTFVNDZVPQR-OGHNNQOOSA-N 0 3 331.343 3.879 20 5 EHBDHN CSCCCCC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881443 1137316824 /nfs/dbraw/zinc/31/68/24/1137316824.db2.gz ZTCMPFOSWJGHPN-IAQYHMDHSA-N 0 3 329.393 3.609 20 5 EHBDHN C[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)[C@](C)(O)c1ccccc1 ZINC000846040882 1137329122 /nfs/dbraw/zinc/32/91/22/1137329122.db2.gz XRFBEITZJGTOBL-SJCJKPOMSA-N 0 3 334.803 3.634 20 5 EHBDHN COc1ccc(CNCc2cc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC001649161060 1137487378 /nfs/dbraw/zinc/48/73/78/1137487378.db2.gz JTKWQHVPMQVWMN-UHFFFAOYSA-N 0 3 332.425 3.834 20 5 EHBDHN COc1ccc(CCN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000872017164 1137564732 /nfs/dbraw/zinc/56/47/32/1137564732.db2.gz VPCAWVSRPBJJPS-LBPRGKRZSA-N 0 3 348.374 3.644 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@H](O)c2c(Cl)cccc2Cl)cc1 ZINC000124251781 1137584423 /nfs/dbraw/zinc/58/44/23/1137584423.db2.gz DEFUHJPZXQVDNF-AWEZNQCLSA-N 0 3 341.194 3.725 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(CN[C@@H]2CCC[C@@H]3C[C@@H]32)o1 ZINC000878705296 1137725669 /nfs/dbraw/zinc/72/56/69/1137725669.db2.gz UEQVTYOAUNOPCU-JIMOISOXSA-N 0 3 348.790 3.576 20 5 EHBDHN COC[C@H]1C[C@@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000883320095 1137854622 /nfs/dbraw/zinc/85/46/22/1137854622.db2.gz ARHPVMOLUINKSY-YJLNNSPDSA-N 0 3 326.396 3.699 20 5 EHBDHN Cc1ccccc1[C@@H](C)N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000120951751 1137953879 /nfs/dbraw/zinc/95/38/79/1137953879.db2.gz QQIPFWUIKSHWOM-ZIAGYGMSSA-N 0 3 327.384 3.581 20 5 EHBDHN COCc1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192636335 1140541536 /nfs/dbraw/zinc/54/15/36/1140541536.db2.gz LFTHQIDFRKTJLE-IBGZPJMESA-N 0 3 326.396 3.908 20 5 EHBDHN CN(C)Cc1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000047460109 201108209 /nfs/dbraw/zinc/10/82/09/201108209.db2.gz UHZJDZMYIIFHJB-UHFFFAOYSA-N 0 3 333.775 3.562 20 5 EHBDHN C[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000339503480 1014601666 /nfs/dbraw/zinc/60/16/66/1014601666.db2.gz BRMDSBXTLIXBTL-DSVHZNLOSA-N 0 3 344.436 3.696 20 5 EHBDHN C[C@H](NC[C@@H](O)c1ccc(F)cc1Cl)c1ccccc1[N+](=O)[O-] ZINC000274824579 1015437778 /nfs/dbraw/zinc/43/77/78/1015437778.db2.gz KRUQDRPNIAYHFF-MGPLVRAMSA-N 0 3 338.766 3.772 20 5 EHBDHN CCOCCNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000120657241 1015777306 /nfs/dbraw/zinc/77/73/06/1015777306.db2.gz CSZJPBSJKDRPFJ-UHFFFAOYSA-N 0 3 334.347 3.652 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000339905660 1015874361 /nfs/dbraw/zinc/87/43/61/1015874361.db2.gz ACRSNBYAROOWAZ-MRXNPFEDSA-N 0 3 336.395 3.609 20 5 EHBDHN CCC[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCC1 ZINC000459790222 1032476376 /nfs/dbraw/zinc/47/63/76/1032476376.db2.gz GKYKHMIHYKOPKK-HNNXBMFYSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1cccc(C)c1[C@H](C)N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000544893825 1017259370 /nfs/dbraw/zinc/25/93/70/1017259370.db2.gz MUWINFAPGHEBSM-LSDHHAIUSA-N 0 3 341.411 3.889 20 5 EHBDHN Cc1cnc(N[C@H](CN2CCCCC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610284255 1017622494 /nfs/dbraw/zinc/62/24/94/1017622494.db2.gz DWBMCJURVYCAOS-QGZVFWFLSA-N 0 3 340.427 3.937 20 5 EHBDHN Cc1nc2ccccc2nc1CN(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282396150 1018108283 /nfs/dbraw/zinc/10/82/83/1018108283.db2.gz HGUKHJYHDJEIKL-UHFFFAOYSA-N 0 3 336.395 3.521 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@H]2CCCCN2C2CC2)c(OC(F)F)c1 ZINC000433802581 1019646347 /nfs/dbraw/zinc/64/63/47/1019646347.db2.gz JPWCLJLDDYUXOH-CYBMUJFWSA-N 0 3 341.358 3.625 20 5 EHBDHN CCCN(Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000610476502 1020415199 /nfs/dbraw/zinc/41/51/99/1020415199.db2.gz WIKVCDAYICLDAS-USXIJHARSA-N 0 3 336.407 3.759 20 5 EHBDHN CCN(CC)C(=O)C1(NCc2ccc(C)c([N+](=O)[O-])c2)CCCCC1 ZINC000237000025 1020509470 /nfs/dbraw/zinc/50/94/70/1020509470.db2.gz VBQFNFUDHSPBQG-UHFFFAOYSA-N 0 3 347.459 3.564 20 5 EHBDHN CO[C@H]([C@@H](C)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000449627034 1032923820 /nfs/dbraw/zinc/92/38/20/1032923820.db2.gz FOKDNRWCYAKQKN-KZULUSFZSA-N 0 3 330.384 3.758 20 5 EHBDHN O=[N+]([O-])c1sc(CNCCCC(F)(F)F)cc1Br ZINC000602557617 1032973010 /nfs/dbraw/zinc/97/30/10/1032973010.db2.gz YIYRINXAZZZWDB-UHFFFAOYSA-N 0 3 347.156 3.851 20 5 EHBDHN CC(C)[C@@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)c1cccnc1 ZINC000602573484 1032980553 /nfs/dbraw/zinc/98/05/53/1032980553.db2.gz QMPYKQMGLTZUCF-OAHLLOKOSA-N 0 3 340.383 3.660 20 5 EHBDHN COc1cc(CN2CC(C)(C)[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000516670758 1021639117 /nfs/dbraw/zinc/63/91/17/1021639117.db2.gz RHBUNVPQVBMEIP-ZIAGYGMSSA-N 0 3 334.416 3.623 20 5 EHBDHN CCC(CC)N(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000519192566 1021915589 /nfs/dbraw/zinc/91/55/89/1021915589.db2.gz KPUGICGZJNLRRN-UHFFFAOYSA-N 0 3 330.388 3.798 20 5 EHBDHN CC(F)(F)CCCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602671548 1033049224 /nfs/dbraw/zinc/04/92/24/1033049224.db2.gz KXPCDOOHXBNTCS-UHFFFAOYSA-N 0 3 343.193 3.944 20 5 EHBDHN CC(=O)c1cc(NC[C@H](c2ccc(C)cc2)N(C)C)ccc1[N+](=O)[O-] ZINC000550386439 1022418473 /nfs/dbraw/zinc/41/84/73/1022418473.db2.gz GXCXETBOYKLLRX-LJQANCHMSA-N 0 3 341.411 3.821 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(Cc3cn4ccnc4s3)C2)cc1 ZINC000894722124 1022818364 /nfs/dbraw/zinc/81/83/64/1022818364.db2.gz ILSODVDMWCWXSL-CQSZACIVSA-N 0 3 342.424 3.684 20 5 EHBDHN Cc1c(CN(CCO)[C@@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510697645 1022903443 /nfs/dbraw/zinc/90/34/43/1022903443.db2.gz IEQQEGLSNQLCNF-HXUWFJFHSA-N 0 3 340.423 3.775 20 5 EHBDHN C[C@@H](c1ccccc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000507003549 1023081623 /nfs/dbraw/zinc/08/16/23/1023081623.db2.gz WLQJUULOZPGUBZ-ZFWWWQNUSA-N 0 3 329.375 3.981 20 5 EHBDHN Cn1cc(CN2CCC(CCF)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000602734326 1033124595 /nfs/dbraw/zinc/12/45/95/1033124595.db2.gz QAJNCNKNCFALDQ-UHFFFAOYSA-N 0 3 346.406 3.567 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CC[C@H](c2ccc3cccnc3n2)C1 ZINC000602889967 1033244334 /nfs/dbraw/zinc/24/43/34/1033244334.db2.gz XROGWXZLYJIYCE-HNNXBMFYSA-N 0 3 334.379 3.528 20 5 EHBDHN CC[C@@H](C)[C@@H](C)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240800 1025489294 /nfs/dbraw/zinc/48/92/94/1025489294.db2.gz RFGPMOAFHOPEDG-TZMCWYRMSA-N 0 3 333.432 3.741 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC(c2ccn(C)n2)CC1 ZINC000896495173 1025499922 /nfs/dbraw/zinc/49/99/22/1025499922.db2.gz IKVAQTMRKBOHFU-NTCAYCPXSA-N 0 3 340.427 3.611 20 5 EHBDHN C[C@@H]1CCC[C@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478227 1025658981 /nfs/dbraw/zinc/65/89/81/1025658981.db2.gz HEEKVOKEPUDIPW-OCCSQVGLSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CO1 ZINC000516063419 1025948986 /nfs/dbraw/zinc/94/89/86/1025948986.db2.gz SXSUOJOGLYPKTA-WDEREUQCSA-N 0 3 336.775 3.775 20 5 EHBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1F)[C@@H]1Oc2ccccc2[C@H]1C ZINC000478209353 1026024324 /nfs/dbraw/zinc/02/43/24/1026024324.db2.gz QJXRUOQAJHUSFM-FTLABTOESA-N 0 3 330.359 3.777 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2c1NCC2 ZINC000469870662 1026125003 /nfs/dbraw/zinc/12/50/03/1026125003.db2.gz LDHXDAKYBROUKM-UHFFFAOYSA-N 0 3 325.412 3.973 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN3CCCc4ccccc4CC3)nc2c1 ZINC000451711836 1026244700 /nfs/dbraw/zinc/24/47/00/1026244700.db2.gz PKBPWJNNDMXYOL-UHFFFAOYSA-N 0 3 337.379 3.727 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000523010913 1026356510 /nfs/dbraw/zinc/35/65/10/1026356510.db2.gz ZSNBQSLSJYTZNR-HNNXBMFYSA-N 0 3 344.386 3.807 20 5 EHBDHN COc1cc(C[NH2+]C[C@@]2(C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1[O-] ZINC000339445878 1026565355 /nfs/dbraw/zinc/56/53/55/1026565355.db2.gz SOUWWHOEGVXOIB-DNVCBOLYSA-N 0 3 342.395 3.592 20 5 EHBDHN O=[N+]([O-])c1cccc(CNCCOc2ccccc2C(F)(F)F)c1 ZINC000237810049 1027761790 /nfs/dbraw/zinc/76/17/90/1027761790.db2.gz LZOYNAUSMHKNCY-UHFFFAOYSA-N 0 3 340.301 3.782 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](CC(F)(F)F)C2)cc1 ZINC000420955711 1027924421 /nfs/dbraw/zinc/92/44/21/1027924421.db2.gz WZCMMJLKOBGGRV-LBPRGKRZSA-N 0 3 332.322 3.638 20 5 EHBDHN CC(=O)c1cc(N[C@@H](C)[C@H](c2ccccc2)N(C)C)ccc1[N+](=O)[O-] ZINC000572898102 1028366673 /nfs/dbraw/zinc/36/66/73/1028366673.db2.gz LFBMXHPQLLNHKW-ORAYPTAESA-N 0 3 341.411 3.901 20 5 EHBDHN CN(CCc1ccccn1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000183734320 1029320404 /nfs/dbraw/zinc/32/04/04/1029320404.db2.gz BUBQRPFOAYIHBC-UHFFFAOYSA-N 0 3 337.379 3.924 20 5 EHBDHN CN(C)c1cccc([C@H]2CCCN2Cc2ccccc2[N+](=O)[O-])c1 ZINC000524755274 1029485102 /nfs/dbraw/zinc/48/51/02/1029485102.db2.gz LKSWVULIBUDBKR-GOSISDBHSA-N 0 3 325.412 3.998 20 5 EHBDHN COc1ccc(C2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000525308818 1029787898 /nfs/dbraw/zinc/78/78/98/1029787898.db2.gz CVVYXILJKPRNGJ-UHFFFAOYSA-N 0 3 326.396 3.983 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H](C)N2[C@H](C)CC[C@@H]2C)n1 ZINC000526954269 1030503046 /nfs/dbraw/zinc/50/30/46/1030503046.db2.gz DPUKKFPPBRUGII-FRRDWIJNSA-N 0 3 330.388 3.887 20 5 EHBDHN CCOC(=O)C(C)(C)C1CCN(Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000520460086 1030552752 /nfs/dbraw/zinc/55/27/52/1030552752.db2.gz WOSZGSIOBWFUKA-UHFFFAOYSA-N 0 3 348.443 3.705 20 5 EHBDHN CC1(C)C[C@@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000160440810 1030757989 /nfs/dbraw/zinc/75/79/89/1030757989.db2.gz LGGKINBDIYWRBS-ZDUSSCGKSA-N 0 3 347.440 3.766 20 5 EHBDHN C[C@H]1CCCC[C@H]1N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623431 1030793668 /nfs/dbraw/zinc/79/36/68/1030793668.db2.gz AFUFJFGCNGIEKP-XHDPSFHLSA-N 0 3 339.823 3.697 20 5 EHBDHN CC(C)(C)[C@@H]1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000483245073 1031052063 /nfs/dbraw/zinc/05/20/63/1031052063.db2.gz GVPCKCZBQIEQLU-CQSZACIVSA-N 0 3 344.415 3.903 20 5 EHBDHN Cc1ccccc1NC(=O)C[C@H](C)N[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000903289025 1031331253 /nfs/dbraw/zinc/33/12/53/1031331253.db2.gz PWKLUFXAIDYSQG-LSDHHAIUSA-N 0 3 341.411 3.971 20 5 EHBDHN CCS[C@H]1CC[C@@H](N(C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485948 1033365738 /nfs/dbraw/zinc/36/57/38/1033365738.db2.gz TZRWEYUWGDVNRN-HIFRSBDPSA-N 0 3 334.445 3.508 20 5 EHBDHN CC(C)c1ccc(CNCc2ccc(CCO)cc2)cc1[N+](=O)[O-] ZINC000898172780 1033366646 /nfs/dbraw/zinc/36/66/46/1033366646.db2.gz ZANXHARLOOXUMI-UHFFFAOYSA-N 0 3 328.412 3.543 20 5 EHBDHN COc1cc(CN[C@@H]2CC[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000594993761 1033624113 /nfs/dbraw/zinc/62/41/13/1033624113.db2.gz GMMMOSZXNQHPNH-HZPDHXFCSA-N 0 3 342.395 3.648 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H]1CCC2(CCCC2)O1 ZINC000595046635 1033662931 /nfs/dbraw/zinc/66/29/31/1033662931.db2.gz LWBSDNQSYONQCE-UKRRQHHQSA-N 0 3 334.416 3.746 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C1CC1)[C@H]1CCCCO1 ZINC000595044489 1033663610 /nfs/dbraw/zinc/66/36/10/1033663610.db2.gz ALYJPADQFRQXRL-XZOAIXRZSA-N 0 3 334.416 3.602 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCCO2 ZINC000063994965 1033934462 /nfs/dbraw/zinc/93/44/62/1033934462.db2.gz TUEPMHCQXQWJPT-UHFFFAOYSA-N 0 3 342.395 3.777 20 5 EHBDHN CCOc1ccc([C@@H](C)N[C@H]2CCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000596649649 1034345656 /nfs/dbraw/zinc/34/56/56/1034345656.db2.gz DRMFZBROZBTYLG-PXAZEXFGSA-N 0 3 341.411 3.914 20 5 EHBDHN CCOc1ccccc1[C@@H](CC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000179742880 1034600224 /nfs/dbraw/zinc/60/02/24/1034600224.db2.gz GZICGVKRLXCMSS-QZTJIDSGSA-N 0 3 344.411 3.768 20 5 EHBDHN CC(C)(NCCC(=O)NCC1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000411761731 1035019213 /nfs/dbraw/zinc/01/92/13/1035019213.db2.gz VXKXUXGWYZTLTI-UHFFFAOYSA-N 0 3 347.459 3.506 20 5 EHBDHN C[C@@H](NCCN(C(=O)OC(C)(C)C)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000310659641 1035281567 /nfs/dbraw/zinc/28/15/67/1035281567.db2.gz XNQMZDANZAKRCX-CYBMUJFWSA-N 0 3 349.431 3.645 20 5 EHBDHN COc1cc(C[NH2+]CC2CC(c3ccccc3)C2)c([N+](=O)[O-])cc1[O-] ZINC000548981468 1035377984 /nfs/dbraw/zinc/37/79/84/1035377984.db2.gz UKKMOAWHGBSQMC-UHFFFAOYSA-N 0 3 342.395 3.592 20 5 EHBDHN CCN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCO1 ZINC000511505769 1036273342 /nfs/dbraw/zinc/27/33/42/1036273342.db2.gz FZRMAPSMYZQSHX-INIZCTEOSA-N 0 3 330.384 3.856 20 5 EHBDHN CC[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC000271769550 1037157479 /nfs/dbraw/zinc/15/74/79/1037157479.db2.gz XBMRNMHBUNKGDR-DLBZAZTESA-N 0 3 336.338 3.647 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](C)Oc1ccccc1C ZINC000462738129 1037344581 /nfs/dbraw/zinc/34/45/81/1037344581.db2.gz LBTZUGGBXRTZBA-HNNXBMFYSA-N 0 3 344.411 3.859 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCN2CCCCC2)c2ccccc2)c1 ZINC000491383429 1037437125 /nfs/dbraw/zinc/43/71/25/1037437125.db2.gz RKUXIADBPDDEFC-HXUWFJFHSA-N 0 3 339.439 3.760 20 5 EHBDHN CC(C)c1nc(CNCCc2cccc([N+](=O)[O-])c2)c2ccccn21 ZINC000573808662 1037756857 /nfs/dbraw/zinc/75/68/57/1037756857.db2.gz PKXJQIRUUVNWDR-UHFFFAOYSA-N 0 3 338.411 3.698 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCNC1(c2cccc(Cl)c2)CC1 ZINC000540414647 1037912815 /nfs/dbraw/zinc/91/28/15/1037912815.db2.gz CHMZHPNQQUNZRK-UHFFFAOYSA-N 0 3 332.787 3.906 20 5 EHBDHN C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)CCn1ccc([N+](=O)[O-])n1 ZINC000478417553 1039430814 /nfs/dbraw/zinc/43/08/14/1039430814.db2.gz NTJAGIRNARRXBM-JTQLQIEISA-N 0 3 343.214 3.791 20 5 EHBDHN COc1cc(N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991068 1039764356 /nfs/dbraw/zinc/76/43/56/1039764356.db2.gz BOYFCGANNOVSKY-KDOFPFPSSA-N 0 3 345.374 3.600 20 5 EHBDHN Cc1ccc(Sc2ccc(CN(C)[C@H](C)CO)cc2[N+](=O)[O-])cc1 ZINC000554883321 1039906185 /nfs/dbraw/zinc/90/61/85/1039906185.db2.gz CBQBIHZRHARFPP-CQSZACIVSA-N 0 3 346.452 3.867 20 5 EHBDHN COc1cc(CN2CC[C@@](C)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490042479 1040317253 /nfs/dbraw/zinc/31/72/53/1040317253.db2.gz VQNBYVJQIFRNLF-LJQANCHMSA-N 0 3 326.396 3.767 20 5 EHBDHN CC[C@@H](N[C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1)c1cccc([N+](=O)[O-])c1 ZINC000123090148 1040483528 /nfs/dbraw/zinc/48/35/28/1040483528.db2.gz GECKAYUMESDVBT-XHDPSFHLSA-N 0 3 340.383 3.566 20 5 EHBDHN Cc1ccc([C@H](C)N[C@@H](C)c2ccc(NC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000192847049 1040575304 /nfs/dbraw/zinc/57/53/04/1040575304.db2.gz LQPGOCDWAWMIPC-STQMWFEESA-N 0 3 342.399 3.806 20 5 EHBDHN Cc1cnc(C2CCN(CCOc3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000433161774 1040931217 /nfs/dbraw/zinc/93/12/17/1040931217.db2.gz KVPXLCRNCVGWCN-UHFFFAOYSA-N 0 3 347.440 3.618 20 5 EHBDHN CCC[C@@H](C)N(C)Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491182645 1040944506 /nfs/dbraw/zinc/94/45/06/1040944506.db2.gz NEFVVCIDCFUKLO-LLVKDONJSA-N 0 3 346.374 3.868 20 5 EHBDHN CC1(C)CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCC[C@@H]21 ZINC000555721023 1041043682 /nfs/dbraw/zinc/04/36/82/1041043682.db2.gz FJQLBDLEXLWSPX-LSDHHAIUSA-N 0 3 342.399 3.655 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1cccc(Cn2ccnc2)c1 ZINC000570986057 1041158009 /nfs/dbraw/zinc/15/80/09/1041158009.db2.gz ZHXFJEFEDQBOHG-LJQANCHMSA-N 0 3 348.406 3.617 20 5 EHBDHN C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000572422530 1044875120 /nfs/dbraw/zinc/87/51/20/1044875120.db2.gz BANDVKYTMFTCCD-XHDPSFHLSA-N 0 3 326.352 3.662 20 5 EHBDHN CCS[C@@H]1CC[C@H](N(C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039955 1127568893 /nfs/dbraw/zinc/56/88/93/1127568893.db2.gz USRGYCZPIAHOLJ-DZGCQCFKSA-N 0 3 348.472 3.816 20 5 EHBDHN Cc1cnc(NC[C@@H]2CCCN(C)[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000301444914 1127892067 /nfs/dbraw/zinc/89/20/67/1127892067.db2.gz NRPXYXQGNBOLEV-XJKSGUPXSA-N 0 3 346.456 3.855 20 5 EHBDHN Cc1cc([N+](=O)[O-])cnc1NC[C@H](c1cccs1)N1CCCC1 ZINC000301553670 1128496755 /nfs/dbraw/zinc/49/67/55/1128496755.db2.gz WBHHQCRTJIBFBZ-CQSZACIVSA-N 0 3 332.429 3.609 20 5 EHBDHN Cc1nc(Nc2cccc(CN3CCSCC3)c2)ccc1[N+](=O)[O-] ZINC000301627505 1128761185 /nfs/dbraw/zinc/76/11/85/1128761185.db2.gz HUNHXCBVVLPVHS-UHFFFAOYSA-N 0 3 344.440 3.591 20 5 EHBDHN O=[N+]([O-])c1cccc(Cl)c1CN[C@@H](CCO)C1CCCCC1 ZINC000494803689 1120846778 /nfs/dbraw/zinc/84/67/78/1120846778.db2.gz HQKFRJNJDNTSGJ-HNNXBMFYSA-N 0 3 326.824 3.669 20 5 EHBDHN CCC[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000193630281 1121514740 /nfs/dbraw/zinc/51/47/40/1121514740.db2.gz OFUDUTQNCVINGX-OAHLLOKOSA-N 0 3 327.384 3.664 20 5 EHBDHN CC(C)c1ccc(CN(C)C[C@@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000556894618 1123172003 /nfs/dbraw/zinc/17/20/03/1123172003.db2.gz CLXAZBCJPHOICK-SFHVURJKSA-N 0 3 342.439 3.754 20 5 EHBDHN CN1CCC[C@H]1CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000920486195 1123375046 /nfs/dbraw/zinc/37/50/46/1123375046.db2.gz SGADYMTWMPUJBV-QMMMGPOBSA-N 0 3 337.729 3.773 20 5 EHBDHN CC[C@@H](C)[C@H]1CCCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001842 1123710450 /nfs/dbraw/zinc/71/04/50/1123710450.db2.gz DSIHTARBBOQNJP-CXAGYDPISA-N 0 3 334.416 3.862 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN(C)[C@@H](C)Cc1ccc(C)cc1 ZINC000610003515 1123711692 /nfs/dbraw/zinc/71/16/92/1123711692.db2.gz GUFJCGIUAPDLOV-HNNXBMFYSA-N 0 3 328.412 3.975 20 5 EHBDHN Cc1ccc(Sc2ccc(CNC(C)(C)CO)cc2[N+](=O)[O-])cc1 ZINC000237775575 1123852090 /nfs/dbraw/zinc/85/20/90/1123852090.db2.gz KZKAUSIRVIWZNI-UHFFFAOYSA-N 0 3 346.452 3.915 20 5 EHBDHN C[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCCC1 ZINC000182937445 1125406465 /nfs/dbraw/zinc/40/64/65/1125406465.db2.gz NOAPTCRONQZXQE-GFCCVEGCSA-N 0 3 330.388 3.703 20 5 EHBDHN CO[C@H](CN(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000619808755 1125410441 /nfs/dbraw/zinc/41/04/41/1125410441.db2.gz ZIJBKBQBJGCBEK-LJQANCHMSA-N 0 3 326.396 3.947 20 5 EHBDHN CCOc1cccc(NC[C@H](c2cccs2)N(C)C)c1[N+](=O)[O-] ZINC000183135192 1125453917 /nfs/dbraw/zinc/45/39/17/1125453917.db2.gz OWEDYPDYULTHII-CYBMUJFWSA-N 0 3 335.429 3.770 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(C[C@H](O)CCc2ccccc2)C2CC2)cc1 ZINC000543439706 1129489992 /nfs/dbraw/zinc/48/99/92/1129489992.db2.gz HHOAKQILQQZDBW-HXUWFJFHSA-N 0 3 340.423 3.553 20 5 EHBDHN C[C@@H]1CCN(c2sccc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000302016334 1129763502 /nfs/dbraw/zinc/76/35/02/1129763502.db2.gz LVBGUAKCUYQTLL-CQSZACIVSA-N 0 3 331.441 3.757 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1cccc([N+](=O)[O-])c1 ZINC000173328734 1130208049 /nfs/dbraw/zinc/20/80/49/1130208049.db2.gz YVWLGZGODDJRDQ-OLZOCXBDSA-N 0 3 339.395 3.891 20 5 EHBDHN CC[C@@](C)(NCCCOc1ccc([N+](=O)[O-])cc1)c1nccs1 ZINC000173510440 1130238953 /nfs/dbraw/zinc/23/89/53/1130238953.db2.gz GHAWCBCWCCFFBK-MRXNPFEDSA-N 0 3 335.429 3.735 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@@H](NCc1c(F)cccc1F)CC2 ZINC001172896983 1131880427 /nfs/dbraw/zinc/88/04/27/1131880427.db2.gz VLVOATSQAHBVKU-AWEZNQCLSA-N 0 3 332.350 3.910 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2cnn(CN3CCC4(CCCC4)C3)c2)cc1 ZINC000743390563 1131909159 /nfs/dbraw/zinc/90/91/59/1131909159.db2.gz GAPXXCZXVIDYNE-UHFFFAOYSA-N 0 3 326.400 3.682 20 5 EHBDHN COc1c(F)ccc(CN[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1F ZINC001173217100 1132002093 /nfs/dbraw/zinc/00/20/93/1132002093.db2.gz LMVWJHNWMXQMPP-NSHDSACASA-N 0 3 336.338 3.602 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1C[C@@H](CF)[C@H](C(F)(F)F)C1 ZINC001173223967 1132005298 /nfs/dbraw/zinc/00/52/98/1132005298.db2.gz CKWYELAXGZOPQT-ZKYQVNSYSA-N 0 3 334.313 3.606 20 5 EHBDHN O=[N+]([O-])c1cc2cnn(CN(C3CC3)C3CCCC3)c2c(Cl)c1 ZINC000774634402 1133809175 /nfs/dbraw/zinc/80/91/75/1133809175.db2.gz HJQZVXWRPOSAMI-UHFFFAOYSA-N 0 3 334.807 3.962 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CCC[C@@H](N2CCCC2)C1 ZINC001184874887 1134001296 /nfs/dbraw/zinc/00/12/96/1134001296.db2.gz XCXGYCYZCFGVIP-LLVKDONJSA-N 0 3 344.242 3.966 20 5 EHBDHN CO[C@H](c1ccccc1F)[C@@H](C)N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788688722 1134157775 /nfs/dbraw/zinc/15/77/75/1134157775.db2.gz GTQQPQPTWQVQQF-IUUKEHGRSA-N 0 3 347.390 3.743 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCC[C@@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC001170329060 1134749057 /nfs/dbraw/zinc/74/90/57/1134749057.db2.gz NVNNDWBXFAZDSU-KBXCAEBGSA-N 0 3 341.411 3.767 20 5 EHBDHN COc1ccc(C[C@H](C)N2CC[C@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329028 1134749439 /nfs/dbraw/zinc/74/94/39/1134749439.db2.gz NGJAINQNLUDCDD-NHYWBVRUSA-N 0 3 346.349 3.604 20 5 EHBDHN CC[C@H](C)N[C@@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804781933 1135199658 /nfs/dbraw/zinc/19/96/58/1135199658.db2.gz LBNHQALBKBOHIH-RYUDHWBXSA-N 0 3 348.359 3.637 20 5 EHBDHN CN1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC12CCCCC2 ZINC001194476959 1135276460 /nfs/dbraw/zinc/27/64/60/1135276460.db2.gz GJINHGCPKJEPKG-UHFFFAOYSA-N 0 3 337.851 3.699 20 5 EHBDHN CC[C@H](c1ccccc1OC)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834348 1135333017 /nfs/dbraw/zinc/33/30/17/1135333017.db2.gz FXIKGSHGOYLJKN-MSOLQXFVSA-N 0 3 344.411 3.720 20 5 EHBDHN CC(C)C[C@@H]1OCCC[C@@H]1NCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775870917 1135833104 /nfs/dbraw/zinc/83/31/04/1135833104.db2.gz OWKKFTWLKSKOBC-HOCLYGCPSA-N 0 3 326.824 3.932 20 5 EHBDHN CC(C)S(=O)(=O)CCNCc1c2ccccc2cc2ccccc21 ZINC000809790915 1135893165 /nfs/dbraw/zinc/89/31/65/1135893165.db2.gz RZPHFCPHTHNHJV-UHFFFAOYSA-N 0 3 341.476 3.906 20 5 EHBDHN C[C@@H]1CCCN(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811473921 1136095591 /nfs/dbraw/zinc/09/55/91/1136095591.db2.gz QTAJEAPOBLEXLW-LLVKDONJSA-N 0 3 346.258 3.723 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H](O)C1CCCCC1 ZINC000811477923 1136096788 /nfs/dbraw/zinc/09/67/88/1136096788.db2.gz ILJNTNNUKXKCAS-AWEZNQCLSA-N 0 3 347.242 3.932 20 5 EHBDHN CCC(CC)[C@H](O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811480731 1136097657 /nfs/dbraw/zinc/09/76/57/1136097657.db2.gz DMQQJJHVHFRMJQ-CYBMUJFWSA-N 0 3 335.231 3.788 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c1 ZINC000776252648 1136101618 /nfs/dbraw/zinc/10/16/18/1136101618.db2.gz VJRKOVPMYLCWCY-FVQBIDKESA-N 0 3 336.819 3.686 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000776276945 1136130678 /nfs/dbraw/zinc/13/06/78/1136130678.db2.gz LXKCYTDSODXMBI-ZWKOTPCHSA-N 0 3 330.359 3.604 20 5 EHBDHN C[C@H](N)c1ncc(-c2ccccc2)n1-c1nc(Cl)ccc1[N+](=O)[O-] ZINC001170682815 1136231091 /nfs/dbraw/zinc/23/10/91/1136231091.db2.gz UMOOTLICXGZCAW-JTQLQIEISA-N 0 3 343.774 3.516 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H]1COc2ccccc2C1 ZINC000850429000 1136257260 /nfs/dbraw/zinc/25/72/60/1136257260.db2.gz WNHDYTVWHTWLRC-ZIAGYGMSSA-N 0 3 342.395 3.505 20 5 EHBDHN CCN(Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812851551 1136261508 /nfs/dbraw/zinc/26/15/08/1136261508.db2.gz SMMDYKIBYGWRCN-SCLBCKFNSA-N 0 3 332.375 3.678 20 5 EHBDHN CC(COC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)[N+](=O)[O-] ZINC000813107361 1136294294 /nfs/dbraw/zinc/29/42/94/1136294294.db2.gz MNXYQDPXPZOJJZ-GXMKHXEJSA-N 0 3 335.356 3.776 20 5 EHBDHN CC(=O)c1ccc(Oc2ccc(C(=O)OCC(C)[N+](=O)[O-])cc2)cc1 ZINC000813109431 1136294314 /nfs/dbraw/zinc/29/43/14/1136294314.db2.gz SBWBHRWCMLKJAS-LBPRGKRZSA-N 0 3 343.335 3.504 20 5 EHBDHN CC(C)[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000852446101 1136456604 /nfs/dbraw/zinc/45/66/04/1136456604.db2.gz DJTQCZWZZCYTOG-MSOLQXFVSA-N 0 3 332.375 3.754 20 5 EHBDHN CCOc1ccccc1[C@@H](CC)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776605468 1136473766 /nfs/dbraw/zinc/47/37/66/1136473766.db2.gz KXPJUJBOXLGKSM-QZTJIDSGSA-N 0 3 344.411 3.768 20 5 EHBDHN CSc1ccc([C@H](CNc2cc(N)ccc2[N+](=O)[O-])N(C)C)cc1 ZINC000814959664 1136531755 /nfs/dbraw/zinc/53/17/55/1136531755.db2.gz JUAASLNLRSXMQK-KRWDZBQOSA-N 0 3 346.456 3.614 20 5 EHBDHN C[C@@H](NC[C@@H]1COC2(CCCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776741650 1136617729 /nfs/dbraw/zinc/61/77/29/1136617729.db2.gz WKBSWZTXHPAWDV-RHSMWYFYSA-N 0 3 334.416 3.711 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@](O)(c2ccccc2)C1 ZINC000859585272 1137021235 /nfs/dbraw/zinc/02/12/35/1137021235.db2.gz MMZIJTMMDVNQFC-DNVCBOLYSA-N 0 3 326.396 3.639 20 5 EHBDHN CCc1nc(CN[C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])co1 ZINC000825057479 1137163688 /nfs/dbraw/zinc/16/36/88/1137163688.db2.gz PFEDLNFGUIUIQL-CJNGLKHVSA-N 0 3 329.400 3.646 20 5 EHBDHN CC([C@H](OC(=O)CCc1cccs1)c1ccccc1F)[N+](=O)[O-] ZINC000845872281 1137315949 /nfs/dbraw/zinc/31/59/49/1137315949.db2.gz FWPYYYIQNXWHLP-ZBEGNZNMSA-N 0 3 337.372 3.770 20 5 EHBDHN Cc1ccc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])s1 ZINC000845875050 1137316458 /nfs/dbraw/zinc/31/64/58/1137316458.db2.gz KVCGONARCLANMG-ZBEGNZNMSA-N 0 3 337.372 3.688 20 5 EHBDHN CC([C@H](OC(=O)C1(F)CCCCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845877759 1137316509 /nfs/dbraw/zinc/31/65/09/1137316509.db2.gz GTXUYQYAPFWLRJ-FZMZJTMJSA-N 0 3 327.327 3.748 20 5 EHBDHN Cc1nc(C2CC2)oc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881179 1137316660 /nfs/dbraw/zinc/31/66/60/1137316660.db2.gz ZCNBEJIQPHQESM-MEBBXXQBSA-N 0 3 348.330 3.563 20 5 EHBDHN Cc1sccc1CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845880019 1137316721 /nfs/dbraw/zinc/31/67/21/1137316721.db2.gz JXXVBKGLANAQSY-QFYYESIMSA-N 0 3 337.372 3.688 20 5 EHBDHN C[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)[C@](C)(O)c1ccccc1 ZINC000846040881 1137329067 /nfs/dbraw/zinc/32/90/67/1137329067.db2.gz XRFBEITZJGTOBL-PXAZEXFGSA-N 0 3 334.803 3.634 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](O)c1ccccc1 ZINC000872015993 1137564617 /nfs/dbraw/zinc/56/46/17/1137564617.db2.gz AXVJNURBWLPKFO-WBMJQRKESA-N 0 3 332.425 3.701 20 5 EHBDHN C[C@H](N[C@@H]1CCO[C@@H](c2cccnc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872075219 1137569942 /nfs/dbraw/zinc/56/99/42/1137569942.db2.gz AOQZSALRPKJKOZ-DXCKQFNASA-N 0 3 345.374 3.700 20 5 EHBDHN COCC(C)(C)CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000873153121 1137591479 /nfs/dbraw/zinc/59/14/79/1137591479.db2.gz ACGLUBKTYTYDPA-UHFFFAOYSA-N 0 3 349.456 3.871 20 5 EHBDHN CC[C@H]1CCCC[C@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447449 1137716328 /nfs/dbraw/zinc/71/63/28/1137716328.db2.gz MUGSELXQRQAVPK-GXTWGEPZSA-N 0 3 330.388 3.703 20 5 EHBDHN CCC[C@@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCC1 ZINC000878706080 1137725637 /nfs/dbraw/zinc/72/56/37/1137725637.db2.gz QAVMEWGZVBWKFN-CQSZACIVSA-N 0 3 330.388 3.703 20 5 EHBDHN C[C@@H](c1ccncc1)N1CCC(Nc2ccccc2[N+](=O)[O-])CC1 ZINC000119296261 1137940253 /nfs/dbraw/zinc/94/02/53/1137940253.db2.gz IDWYZVITYRZBIK-AWEZNQCLSA-N 0 3 326.400 3.627 20 5 EHBDHN Cc1nc(C2CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)[nH]c1C ZINC000886663003 1138110815 /nfs/dbraw/zinc/11/08/15/1138110815.db2.gz RCKKGXHFJSKQEF-UHFFFAOYSA-N 0 3 348.834 3.968 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CC[C@@H](COCc3ccccc3)C2)cc1 ZINC000075863911 1138129121 /nfs/dbraw/zinc/12/91/21/1138129121.db2.gz QTXAKXKAMYCKCZ-GOSISDBHSA-N 0 3 326.396 3.634 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000087455205 1138191381 /nfs/dbraw/zinc/19/13/81/1138191381.db2.gz JIMPAZAZIFPPCK-UHFFFAOYSA-N 0 3 341.411 3.536 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000192024832 1140498005 /nfs/dbraw/zinc/49/80/05/1140498005.db2.gz JPDQFSMCKZKDQM-NVXWUHKLSA-N 0 3 332.787 3.868 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000267441946 1140791766 /nfs/dbraw/zinc/79/17/66/1140791766.db2.gz IDZVVRPXWQOADD-HOCLYGCPSA-N 0 3 332.425 3.744 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@H]2c2ccc(F)cc2)c1 ZINC000269687389 1141135543 /nfs/dbraw/zinc/13/55/43/1141135543.db2.gz TVZMAYBXGOUAOA-ZWKOTPCHSA-N 0 3 330.359 3.604 20 5 EHBDHN Cc1nnc([C@H](C)N[C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000274240070 1141488540 /nfs/dbraw/zinc/48/85/40/1141488540.db2.gz QNIHOKAUECYERX-WHOFXGATSA-N 0 3 346.456 3.817 20 5 EHBDHN COc1cc(CN(C)[C@H]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575522 1141521072 /nfs/dbraw/zinc/52/10/72/1141521072.db2.gz VOGCUFNGAHPJMZ-PWSUYJOCSA-N 0 3 344.358 3.825 20 5 EHBDHN C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc[nH]c(=O)c1 ZINC000339450532 1014506773 /nfs/dbraw/zinc/50/67/73/1014506773.db2.gz BLVYDOOBPBZYFZ-LBPRGKRZSA-N 0 3 339.351 3.806 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@H](Cc2ccccc2)C1 ZINC000610215038 1015006672 /nfs/dbraw/zinc/00/66/72/1015006672.db2.gz YELKGCHBPYNEKH-MRXNPFEDSA-N 0 3 326.396 3.668 20 5 EHBDHN C[C@@H](NC[C@H](O)c1ccc(F)cc1Cl)c1ccccc1[N+](=O)[O-] ZINC000274824577 1015438669 /nfs/dbraw/zinc/43/86/69/1015438669.db2.gz KRUQDRPNIAYHFF-HWPZZCPQSA-N 0 3 338.766 3.772 20 5 EHBDHN Cc1ccc(CN(CCO)[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000536683108 1032147332 /nfs/dbraw/zinc/14/73/32/1032147332.db2.gz JZBNCHCRKCRQKA-IBGZPJMESA-N 0 3 340.423 3.775 20 5 EHBDHN C[C@@H](CN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1cccc(Cl)c1 ZINC000376652498 1016953545 /nfs/dbraw/zinc/95/35/45/1016953545.db2.gz QVFSSXCEHUBPOO-ZDUSSCGKSA-N 0 3 348.834 3.885 20 5 EHBDHN Cc1c([C@@H](C)N[C@@H](CN(C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368978 1032251660 /nfs/dbraw/zinc/25/16/60/1032251660.db2.gz PVQVZKDNOAOGGV-KDOFPFPSSA-N 0 3 345.418 3.996 20 5 EHBDHN COc1ccc(C2CCN([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)nc1 ZINC000593040581 1032675660 /nfs/dbraw/zinc/67/56/60/1032675660.db2.gz HPRRGILURWWBTC-CQSZACIVSA-N 0 3 341.411 3.939 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(Cc3cnc4ccccn34)C2)cc1 ZINC000449501113 1032681131 /nfs/dbraw/zinc/68/11/31/1032681131.db2.gz OWKMUKZDFSLCQP-MRXNPFEDSA-N 0 3 336.395 3.622 20 5 EHBDHN CCS[C@H]1CC[C@@H](N(C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083214641 1018547261 /nfs/dbraw/zinc/54/72/61/1018547261.db2.gz SDHQLKUHSZJTOA-YPMHNXCESA-N 0 3 335.429 3.842 20 5 EHBDHN CCS(=O)(=O)CCNCc1c2ccccc2cc2ccccc21 ZINC000069173278 1020763340 /nfs/dbraw/zinc/76/33/40/1020763340.db2.gz FYMLWXCJKYCJCZ-UHFFFAOYSA-N 0 3 327.449 3.517 20 5 EHBDHN Cc1nn(CN2CCCC[C@@H]2CCC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000760409291 1032940279 /nfs/dbraw/zinc/94/02/79/1032940279.db2.gz QNKKLZLJXPWFSX-OAHLLOKOSA-N 0 3 345.447 3.896 20 5 EHBDHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000610516021 1021175206 /nfs/dbraw/zinc/17/52/06/1021175206.db2.gz VJHPYSSOWHHLOI-ZFWWWQNUSA-N 0 3 331.441 3.979 20 5 EHBDHN CCC(CC)[C@H]1C[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)CCO1 ZINC000602590255 1032988235 /nfs/dbraw/zinc/98/82/35/1032988235.db2.gz YGCNKDOCWISTEA-SUMWQHHRSA-N 0 3 347.415 3.809 20 5 EHBDHN Cn1cc(-c2ccccc2CN[C@H]2CCc3c2cccc3[N+](=O)[O-])cn1 ZINC000516784301 1021726447 /nfs/dbraw/zinc/72/64/47/1021726447.db2.gz KOZCXDBKSCSEPO-IBGZPJMESA-N 0 3 348.406 3.772 20 5 EHBDHN COCCC1(CNCc2nc3cc([N+](=O)[O-])ccc3o2)CCCCC1 ZINC000602621054 1033017271 /nfs/dbraw/zinc/01/72/71/1033017271.db2.gz OXDSNDSITKJVAW-UHFFFAOYSA-N 0 3 347.415 3.813 20 5 EHBDHN COc1ccc2c(c1)[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])CCO2 ZINC000341562068 1022344722 /nfs/dbraw/zinc/34/47/22/1022344722.db2.gz SEEODPMZTORROK-XQDHMALISA-N 0 3 340.379 3.730 20 5 EHBDHN CC(C)[C@H]1CCN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498573 1022727480 /nfs/dbraw/zinc/72/74/80/1022727480.db2.gz YFWBLTLOKRLXGT-OCCSQVGLSA-N 0 3 330.388 3.684 20 5 EHBDHN Cc1c(CN(CCCO)[C@H]2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510686554 1022887325 /nfs/dbraw/zinc/88/73/25/1022887325.db2.gz QCWRQZGESOCVRQ-FQEVSTJZSA-N 0 3 340.423 3.775 20 5 EHBDHN Cc1c(CN[C@@H](C)c2ccc(-n3ccnc3)cc2)cccc1[N+](=O)[O-] ZINC000327712685 1023106930 /nfs/dbraw/zinc/10/69/30/1023106930.db2.gz ZUPBHXYEWCOAQH-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN CCS[C@@H]1CCCC[C@@H]1NCc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000469780082 1024008257 /nfs/dbraw/zinc/00/82/57/1024008257.db2.gz MMRFSTUITBHBJC-XJKSGUPXSA-N 0 3 342.436 3.896 20 5 EHBDHN CCCN(Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000071809503 1024441054 /nfs/dbraw/zinc/44/10/54/1024441054.db2.gz WBZKUHYBJCNKNS-QGZVFWFLSA-N 0 3 342.395 3.647 20 5 EHBDHN COc1ccc(CN(C)CCCOc2ccccc2)cc1[N+](=O)[O-] ZINC000051475903 1025472501 /nfs/dbraw/zinc/47/25/01/1025472501.db2.gz CMOLTTPGWGBLAN-UHFFFAOYSA-N 0 3 330.384 3.504 20 5 EHBDHN Cc1cnc([C@H](C)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553128 1026105644 /nfs/dbraw/zinc/10/56/44/1026105644.db2.gz XKWYEGNAIJXXGW-GOEBONIOSA-N 0 3 326.400 3.634 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC(c3ccccc3)CC2)c1 ZINC000178570643 1026144195 /nfs/dbraw/zinc/14/41/95/1026144195.db2.gz NQQMGSMVBCGTBV-LJQANCHMSA-N 0 3 326.396 3.508 20 5 EHBDHN Cc1c(CN[C@H]2CCCN(C)c3ccccc32)cccc1[N+](=O)[O-] ZINC000451866361 1026358660 /nfs/dbraw/zinc/35/86/60/1026358660.db2.gz JPVWNSGAZMEMMZ-KRWDZBQOSA-N 0 3 325.412 3.964 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2c(C)c(C)ccc2[N+](=O)[O-])c1 ZINC000897239285 1026552301 /nfs/dbraw/zinc/55/23/01/1026552301.db2.gz XWVATDILFLPKDA-UHFFFAOYSA-N 0 3 341.411 3.834 20 5 EHBDHN CN(CCOc1ccccc1[N+](=O)[O-])Cc1cc2ccccc2o1 ZINC000472272889 1028390409 /nfs/dbraw/zinc/39/04/09/1028390409.db2.gz FHWPYOGXYCIWAA-UHFFFAOYSA-N 0 3 326.352 3.852 20 5 EHBDHN CCOc1ccc([C@@H](C)NCc2cc(C)cc(N)c2)cc1[N+](=O)[O-] ZINC000423481276 1028464580 /nfs/dbraw/zinc/46/45/80/1028464580.db2.gz QCUJPLJDORDYOA-CYBMUJFWSA-N 0 3 329.400 3.735 20 5 EHBDHN C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cn[nH]c1 ZINC000533803629 1029850660 /nfs/dbraw/zinc/85/06/60/1029850660.db2.gz VHGBYLRZIVFFBQ-NSHDSACASA-N 0 3 328.397 3.897 20 5 EHBDHN C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@H]1CCCc2occc21 ZINC000152250641 1029867891 /nfs/dbraw/zinc/86/78/91/1029867891.db2.gz NKGFMOUZDSTNGN-LRDDRELGSA-N 0 3 343.383 3.572 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NC[C@@H]2CCCC[C@H]2O)c2ccccc2)c1 ZINC000453389711 1030170881 /nfs/dbraw/zinc/17/08/81/1030170881.db2.gz XMNBZJCSZPKVEB-SXLOBPIMSA-N 0 3 340.423 3.825 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc(CN(CC3CC3)CC3CCC3)n2)cc1 ZINC000483266223 1031078242 /nfs/dbraw/zinc/07/82/42/1031078242.db2.gz VGRDJUNRDIBJQB-UHFFFAOYSA-N 0 3 342.399 3.657 20 5 EHBDHN C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000594490671 1033394155 /nfs/dbraw/zinc/39/41/55/1033394155.db2.gz PFCFJCIYYQESEE-SCLBCKFNSA-N 0 3 349.394 3.514 20 5 EHBDHN COc1ccc(CN[C@H]2CCc3cc(C)cc(C)c32)cc1[N+](=O)[O-] ZINC000594493195 1033394334 /nfs/dbraw/zinc/39/43/34/1033394334.db2.gz GMUCFCXRIWWDLR-INIZCTEOSA-N 0 3 326.396 3.997 20 5 EHBDHN Cc1ncccc1CCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000898249998 1033407505 /nfs/dbraw/zinc/40/75/05/1033407505.db2.gz JLMAWCXRPMKTDS-UHFFFAOYSA-N 0 3 339.317 3.649 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCC[C@@H]3CCCOC3)cs2)c1 ZINC000598985020 1033632236 /nfs/dbraw/zinc/63/22/36/1033632236.db2.gz GMRUNOCJLUPRFK-ZDUSSCGKSA-N 0 3 347.440 3.625 20 5 EHBDHN Cc1cc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000593118292 1033967130 /nfs/dbraw/zinc/96/71/30/1033967130.db2.gz POFDSYBOCUCIPG-NWDGAFQWSA-N 0 3 346.305 3.589 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@H]2c2cccc(F)c2)c1 ZINC000603867930 1033993850 /nfs/dbraw/zinc/99/38/50/1033993850.db2.gz DGLVQZGLSXWRLT-SFHVURJKSA-N 0 3 330.359 3.950 20 5 EHBDHN C[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC000597224728 1034625022 /nfs/dbraw/zinc/62/50/22/1034625022.db2.gz IUBLXGBDIFWFKS-KGLIPLIRSA-N 0 3 330.384 3.854 20 5 EHBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3ccc(C(F)F)cc3)CC2)n1 ZINC000365504135 1035368731 /nfs/dbraw/zinc/36/87/31/1035368731.db2.gz BDCGSZFJWJANKZ-UHFFFAOYSA-N 0 3 336.342 3.566 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccccc1-n1ccnc1 ZINC000152241714 1036203649 /nfs/dbraw/zinc/20/36/49/1036203649.db2.gz LPWIBCFNBDYASN-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)c1ccc(NC(N)=O)cc1 ZINC000165433810 1036558033 /nfs/dbraw/zinc/55/80/33/1036558033.db2.gz PRTXGXBNCBKYFA-QWHCGFSZSA-N 0 3 342.399 3.806 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCOc2ccc(F)c(F)c2)cc1Cl ZINC000761520233 1037098892 /nfs/dbraw/zinc/09/88/92/1037098892.db2.gz MXIGJHRRNDEHFE-UHFFFAOYSA-N 0 3 342.729 3.695 20 5 EHBDHN CC[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC000271769557 1037166951 /nfs/dbraw/zinc/16/69/51/1037166951.db2.gz XBMRNMHBUNKGDR-IRXDYDNUSA-N 0 3 336.338 3.647 20 5 EHBDHN COc1ccc(CN[C@@H]2c3cc(F)ccc3C[C@H]2C)cc1[N+](=O)[O-] ZINC000540173949 1037641879 /nfs/dbraw/zinc/64/18/79/1037641879.db2.gz NLMBMVKLTCKRAJ-ZMZPIMSZSA-N 0 3 330.359 3.766 20 5 EHBDHN C[C@H]1CC(C)(C)CC[C@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000481117029 1038151594 /nfs/dbraw/zinc/15/15/94/1038151594.db2.gz QFPHWJQJMOTNLO-SWLSCSKDSA-N 0 3 344.415 3.949 20 5 EHBDHN CCN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCCO1 ZINC000511540507 1038362129 /nfs/dbraw/zinc/36/21/29/1038362129.db2.gz HZQZSCOMOVGRDH-AWEZNQCLSA-N 0 3 330.384 3.856 20 5 EHBDHN COc1cc(CNC2(C3CCC3)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000593081873 1038449728 /nfs/dbraw/zinc/44/97/28/1038449728.db2.gz SMHAZSFBKRUCDF-UHFFFAOYSA-N 0 3 342.342 3.627 20 5 EHBDHN CN(C/C=C/c1ccccc1[N+](=O)[O-])CCCC(=O)OC(C)(C)C ZINC000538739941 1038503803 /nfs/dbraw/zinc/50/38/03/1038503803.db2.gz VWEJRKVYZNAICE-JXMROGBWSA-N 0 3 334.416 3.662 20 5 EHBDHN CCC[C@@]1(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCOC1 ZINC000512873896 1041159203 /nfs/dbraw/zinc/15/92/03/1041159203.db2.gz HDZPNQFSGRVGRL-GOSISDBHSA-N 0 3 330.384 3.904 20 5 EHBDHN CCOC(=O)C[C@](C)(NCc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000481701961 1041268874 /nfs/dbraw/zinc/26/88/74/1041268874.db2.gz NALNOZWLKVODES-INIZCTEOSA-N 0 3 342.823 3.706 20 5 EHBDHN O=[N+]([O-])c1ccccc1CCNCc1cscc1Br ZINC000511761249 1041569746 /nfs/dbraw/zinc/56/97/46/1041569746.db2.gz ZXWSWZVVZHESQV-UHFFFAOYSA-N 0 3 341.230 3.751 20 5 EHBDHN CC(C)[C@@H](CO)N(Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000112659799 1042419227 /nfs/dbraw/zinc/41/92/27/1042419227.db2.gz PGAAIYTWYOHQAP-LJQANCHMSA-N 0 3 328.412 3.614 20 5 EHBDHN C[C@H](NC[C@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000122135432 1042864899 /nfs/dbraw/zinc/86/48/99/1042864899.db2.gz CNMRHKJZMPPCFJ-WMLDXEAASA-N 0 3 329.400 3.676 20 5 EHBDHN O=[N+]([O-])c1ccc2nc(N3CCN(C4CCCCC4)CC3)sc2c1 ZINC000765574671 1127679241 /nfs/dbraw/zinc/67/92/41/1127679241.db2.gz CIUKADWWTPPIIN-UHFFFAOYSA-N 0 3 346.456 3.659 20 5 EHBDHN COc1cc(F)c([N+](=O)[O-])c(NC[C@H](c2cccs2)N(C)C)c1 ZINC000301325879 1127737950 /nfs/dbraw/zinc/73/79/50/1127737950.db2.gz ARYJCNHEAHWYQJ-CYBMUJFWSA-N 0 3 339.392 3.519 20 5 EHBDHN CN(C)Cc1cccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000265689952 1128002641 /nfs/dbraw/zinc/00/26/41/1128002641.db2.gz FYCZSNFLAOMWQX-UHFFFAOYSA-N 0 3 341.411 3.573 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cs1 ZINC000273377224 1128515966 /nfs/dbraw/zinc/51/59/66/1128515966.db2.gz GBNQZVRYAARVNC-CABCVRRESA-N 0 3 336.388 3.805 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCSc3c(F)cccc32)cc1 ZINC000765849489 1128569992 /nfs/dbraw/zinc/56/99/92/1128569992.db2.gz QLYHEOVJSSFVTD-CVEARBPZSA-N 0 3 348.399 3.594 20 5 EHBDHN COC(=O)Nc1cccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000495744928 1121396069 /nfs/dbraw/zinc/39/60/69/1121396069.db2.gz IWGSYAVMHCGDNK-GFCCVEGCSA-N 0 3 329.356 3.624 20 5 EHBDHN C[C@@H]1CN(CCCCNc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000301737021 1129010727 /nfs/dbraw/zinc/01/07/27/1129010727.db2.gz VOPYQHSCVAQMPJ-BETUJISGSA-N 0 3 341.839 3.550 20 5 EHBDHN O=[N+]([O-])c1cc2c(cc1NCc1ccc(F)c(Cl)c1F)CNC2 ZINC001168506182 1121886830 /nfs/dbraw/zinc/88/68/30/1121886830.db2.gz VORRYMPRROUFNT-UHFFFAOYSA-N 0 3 339.729 3.742 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H](c1ccccc1)N1CCCC1 ZINC000301747294 1129023489 /nfs/dbraw/zinc/02/34/89/1129023489.db2.gz QWHBTCKDHOILBS-INIZCTEOSA-N 0 3 346.818 3.892 20 5 EHBDHN CN1CCNC[C@@H]1c1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001212224464 1122513381 /nfs/dbraw/zinc/51/33/81/1122513381.db2.gz MXMKPDQWEXKKBC-LJQANCHMSA-N 0 3 344.418 3.619 20 5 EHBDHN CN1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000301837156 1129173496 /nfs/dbraw/zinc/17/34/96/1129173496.db2.gz MKASNDFHOUXTGE-ZFWWWQNUSA-N 0 3 332.791 3.501 20 5 EHBDHN COc1ccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000080347283 1129348220 /nfs/dbraw/zinc/34/82/20/1129348220.db2.gz CWNJMOYBHNAFTA-UHFFFAOYSA-N 0 3 330.384 3.637 20 5 EHBDHN CSc1ccc([C@@H](CNc2ncc([N+](=O)[O-])cc2C)N(C)C)cc1 ZINC000338833954 1129395764 /nfs/dbraw/zinc/39/57/64/1129395764.db2.gz CHOUUHFWYJUCGL-MRXNPFEDSA-N 0 3 346.456 3.735 20 5 EHBDHN CC[C@H](O)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000124326723 1129598410 /nfs/dbraw/zinc/59/84/10/1129598410.db2.gz CMMHPEIWLMWQFB-LBPRGKRZSA-N 0 3 338.791 3.759 20 5 EHBDHN Cc1ccc(CN2CC[C@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000093684040 1129599866 /nfs/dbraw/zinc/59/98/66/1129599866.db2.gz ZIKOPFBZNSIWJH-IBGZPJMESA-N 0 3 340.423 3.942 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(CCN(C)C)C1CCCC1 ZINC000155087959 1129611206 /nfs/dbraw/zinc/61/12/06/1129611206.db2.gz VAYXLTAVEIHZDE-UHFFFAOYSA-N 0 3 348.447 3.550 20 5 EHBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(CCN(C)C)C1CCCC1 ZINC000331068910 1129652014 /nfs/dbraw/zinc/65/20/14/1129652014.db2.gz RYQCWNADVCAHOO-UHFFFAOYSA-N 0 3 348.447 3.550 20 5 EHBDHN C[C@@H]1CCC[C@H](C)N(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000125235130 1129672558 /nfs/dbraw/zinc/67/25/58/1129672558.db2.gz QCRDQFUORISOLM-OLZOCXBDSA-N 0 3 330.388 3.655 20 5 EHBDHN CC(C)Cn1ccnc1CN[C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000164757526 1129991216 /nfs/dbraw/zinc/99/12/16/1129991216.db2.gz WKAZAIHGGVTHHX-QGZVFWFLSA-N 0 3 342.443 3.558 20 5 EHBDHN C[C@H](N[C@@H]1CCCC[C@H]1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171414165 1130055107 /nfs/dbraw/zinc/05/51/07/1130055107.db2.gz QCLLMALIXMXFJB-TYNCELHUSA-N 0 3 330.388 3.874 20 5 EHBDHN C[C@@H](CN(C)C(=O)OC(C)(C)C)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000701880051 1130181370 /nfs/dbraw/zinc/18/13/70/1130181370.db2.gz UYPJRTDGDDNNFP-STQMWFEESA-N 0 3 337.420 3.501 20 5 EHBDHN C[C@H](O)CC(C)(C)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174464445 1130360503 /nfs/dbraw/zinc/36/05/03/1130360503.db2.gz AKFVXSHQKICFFV-LBPRGKRZSA-N 0 3 349.456 3.605 20 5 EHBDHN O=[N+]([O-])c1ccc(NCC2CN(Cc3ccccc3)C2)c2ccncc21 ZINC000716297685 1131496985 /nfs/dbraw/zinc/49/69/85/1131496985.db2.gz JDUATAKKQFMAOV-UHFFFAOYSA-N 0 3 348.406 3.687 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@H](NCc1c(F)cccc1F)CC2 ZINC001172896984 1131880200 /nfs/dbraw/zinc/88/02/00/1131880200.db2.gz VLVOATSQAHBVKU-CQSZACIVSA-N 0 3 332.350 3.910 20 5 EHBDHN CCC[C@H]1[C@@H](C)CCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381104 1131914401 /nfs/dbraw/zinc/91/44/01/1131914401.db2.gz VZVFOFQIPWOCED-YOEHRIQHSA-N 0 3 343.431 3.711 20 5 EHBDHN CCN(CCc1cccs1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000746070666 1132365570 /nfs/dbraw/zinc/36/55/70/1132365570.db2.gz UVNMYQONPWHGFK-UHFFFAOYSA-N 0 3 330.413 3.528 20 5 EHBDHN NCc1ccc2c(n1)N(c1ncnc3cc4ccccc4cc31)CCC2 ZINC001169591587 1132791164 /nfs/dbraw/zinc/79/11/64/1132791164.db2.gz XJNJMNQJUJZKHT-UHFFFAOYSA-N 0 3 341.418 3.721 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN(C)[C@@H](CCO)c1ccccc1 ZINC001179950537 1133305010 /nfs/dbraw/zinc/30/50/10/1133305010.db2.gz DXJNCYMNZRBBBL-IBGZPJMESA-N 0 3 328.412 3.767 20 5 EHBDHN COc1cncc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC001181878491 1133545404 /nfs/dbraw/zinc/54/54/04/1133545404.db2.gz BCJVVKRWLAEECG-MRXNPFEDSA-N 0 3 341.411 3.686 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CNC[C@H](O)c1cc(F)cc(Cl)c1 ZINC000785617297 1133732997 /nfs/dbraw/zinc/73/29/97/1133732997.db2.gz YKBGQKLCOIWYJO-INIZCTEOSA-N 0 3 338.766 3.519 20 5 EHBDHN C[C@@H]1[C@@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907255 1134116093 /nfs/dbraw/zinc/11/60/93/1134116093.db2.gz GHVBJHIXGZQUFS-DYVFJYSZSA-N 0 3 341.367 3.881 20 5 EHBDHN CN(CCSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])Cc1ccccc1 ZINC000788567401 1134146358 /nfs/dbraw/zinc/14/63/58/1134146358.db2.gz AOEQJWSDHBGEAH-UHFFFAOYSA-N 0 3 347.396 3.727 20 5 EHBDHN CC1(C)C[C@@H](NC[C@@H](O)c2ccccc2F)c2cc([N+](=O)[O-])ccc21 ZINC000788580591 1134147183 /nfs/dbraw/zinc/14/71/83/1134147183.db2.gz NRNJOBPQKMEBDJ-QZTJIDSGSA-N 0 3 344.386 3.780 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN[C@H](c2ccc(F)cc2F)C2CC2)c1 ZINC001192617517 1135041109 /nfs/dbraw/zinc/04/11/09/1135041109.db2.gz UPOSFOPNHBMSFY-ROUUACIJSA-N 0 3 348.349 3.647 20 5 EHBDHN CC[C@H](NCc1ccc(C)c(C(=O)OC)c1)c1cccc([N+](=O)[O-])c1 ZINC001192800707 1135056041 /nfs/dbraw/zinc/05/60/41/1135056041.db2.gz BRYQJURWDAARGR-SFHVURJKSA-N 0 3 342.395 3.931 20 5 EHBDHN CC[C@@H](NCCOc1ccc(OC)cc1[N+](=O)[O-])c1ccccc1F ZINC001195622182 1135443855 /nfs/dbraw/zinc/44/38/55/1135443855.db2.gz IFZSBQRMRYXVON-MRXNPFEDSA-N 0 3 348.374 3.862 20 5 EHBDHN CO[C@H]1CCCC[C@@H]1NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000810002388 1135912578 /nfs/dbraw/zinc/91/25/78/1135912578.db2.gz VPCAOZMCPHSALZ-STQMWFEESA-N 0 3 333.215 3.949 20 5 EHBDHN Cc1cccc2c1OC[C@H](NCc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000810178226 1135934591 /nfs/dbraw/zinc/93/45/91/1135934591.db2.gz LTEJPMXLVLYWDG-OAHLLOKOSA-N 0 3 332.787 3.650 20 5 EHBDHN Cc1cc(F)ccc1-c1ccc(C(=O)OCC(C)[N+](=O)[O-])cc1F ZINC000813102678 1136288093 /nfs/dbraw/zinc/28/80/93/1136288093.db2.gz ISDRLHGESFCIOL-LLVKDONJSA-N 0 3 335.306 3.762 20 5 EHBDHN CC(COC(=O)C(C)(C)c1ccc(-c2ccccc2)cc1)[N+](=O)[O-] ZINC000813104484 1136288183 /nfs/dbraw/zinc/28/81/83/1136288183.db2.gz NEGGIGXODZRVKC-CQSZACIVSA-N 0 3 327.380 3.840 20 5 EHBDHN CC(COC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)[N+](=O)[O-] ZINC000813111048 1136294135 /nfs/dbraw/zinc/29/41/35/1136294135.db2.gz BAJZACJUCKVFMQ-YAPUSRSVSA-N 0 3 337.681 3.580 20 5 EHBDHN CC(=O)N(C)c1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000858497596 1136973777 /nfs/dbraw/zinc/97/37/77/1136973777.db2.gz XHIIHVODBBTGQP-CQSZACIVSA-N 0 3 341.411 3.737 20 5 EHBDHN CO[C@H](CNCc1cc(Cl)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000824589485 1137144298 /nfs/dbraw/zinc/14/42/98/1137144298.db2.gz FIFMVMVVUPZMBU-INIZCTEOSA-N 0 3 334.803 3.596 20 5 EHBDHN CC([C@@H](OC(=O)CSC(C)(C)C)c1ccccc1F)[N+](=O)[O-] ZINC000845872290 1137315852 /nfs/dbraw/zinc/31/58/52/1137315852.db2.gz GCGZBTGKVQIYSJ-QMTHXVAHSA-N 0 3 329.393 3.607 20 5 EHBDHN CS[C@H](C)CCC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874965 1137316390 /nfs/dbraw/zinc/31/63/90/1137316390.db2.gz JCEDMSBEIHTZQS-ZETOZRRWSA-N 0 3 329.393 3.607 20 5 EHBDHN C[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)[C@@](C)(O)c1ccccc1 ZINC000846040884 1137329034 /nfs/dbraw/zinc/32/90/34/1137329034.db2.gz XRFBEITZJGTOBL-YVEFUNNKSA-N 0 3 334.803 3.634 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](O)c1ccccc1 ZINC000872015990 1137564646 /nfs/dbraw/zinc/56/46/46/1137564646.db2.gz AXVJNURBWLPKFO-BLLLJJGKSA-N 0 3 332.425 3.701 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCOCC(F)(F)F ZINC000872027120 1137566048 /nfs/dbraw/zinc/56/60/48/1137566048.db2.gz HNWCIETYYLIERA-VIFPVBQESA-N 0 3 338.351 3.546 20 5 EHBDHN CC(C)[C@@H](CN[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccnn1C ZINC000872064417 1137569222 /nfs/dbraw/zinc/56/92/22/1137569222.db2.gz GNWYGNZHBOYHNH-CHWSQXEVSA-N 0 3 334.395 3.558 20 5 EHBDHN CC(C)N(Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(C)C ZINC000878341177 1137711529 /nfs/dbraw/zinc/71/15/29/1137711529.db2.gz YVTXYRLRPWHVQD-UHFFFAOYSA-N 0 3 338.795 3.917 20 5 EHBDHN C[C@@H]1C[C@@H](C)CC[C@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000119245220 1137939571 /nfs/dbraw/zinc/93/95/71/1137939571.db2.gz GXQJTLBXQIGZSW-YWPYICTPSA-N 0 3 330.388 3.559 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](C)c1ccccc1C ZINC000120514984 1137950487 /nfs/dbraw/zinc/95/04/87/1137950487.db2.gz IFTZIQLNKZDUBO-CQSZACIVSA-N 0 3 327.384 3.501 20 5 EHBDHN CN(Cc1csc2ccccc12)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136940665 1138044302 /nfs/dbraw/zinc/04/43/02/1138044302.db2.gz DUHZAHACEOHTIE-KRWDZBQOSA-N 0 3 342.420 3.975 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCSC2(CCOCC2)C1 ZINC000186841743 1140224902 /nfs/dbraw/zinc/22/49/02/1140224902.db2.gz VCGIJHWYDLYQTO-CQSZACIVSA-N 0 3 336.457 3.562 20 5 EHBDHN COCc1cccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000192678560 1140543829 /nfs/dbraw/zinc/54/38/29/1140543829.db2.gz LXWPLRADDPXRPJ-IBGZPJMESA-N 0 3 326.396 3.908 20 5 EHBDHN CC(C)Oc1cccc([C@@H](O)CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266813207 1140725412 /nfs/dbraw/zinc/72/54/12/1140725412.db2.gz WTCNAEHHAMCVKG-KUHUBIRLSA-N 0 3 344.411 3.766 20 5 EHBDHN CCN(CCc1cccs1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000267586522 1140806678 /nfs/dbraw/zinc/80/66/78/1140806678.db2.gz HRQDUPWZYCCSHQ-UHFFFAOYSA-N 0 3 331.397 3.862 20 5 EHBDHN CCc1nc(C)c([C@@H](C)N(C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625583 1141128612 /nfs/dbraw/zinc/12/86/12/1141128612.db2.gz CJVFZWRAJVFQOA-IUODEOHRSA-N 0 3 349.456 3.649 20 5 EHBDHN CC(C)[C@@](C)(O)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180528206 1015974600 /nfs/dbraw/zinc/97/46/00/1015974600.db2.gz KDLNFJOAUYJPJO-OALUTQOASA-N 0 3 328.412 3.681 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN1CCC[C@H]1Cc1ccc(F)cc1 ZINC001167122480 1016177043 /nfs/dbraw/zinc/17/70/43/1016177043.db2.gz IPOXKASFUYCFFY-KRWDZBQOSA-N 0 3 344.386 3.950 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000340335193 1016958901 /nfs/dbraw/zinc/95/89/01/1016958901.db2.gz UWVJDYQJIQCWCM-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H](C[C@@H]2CCOC2)c2ccccc2)cc1F ZINC000278746242 1032290922 /nfs/dbraw/zinc/29/09/22/1032290922.db2.gz WTGCZHRXNOOWDM-MAUKXSAKSA-N 0 3 344.386 3.991 20 5 EHBDHN CC[C@@]1(CNCc2csc([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000573253470 1032604713 /nfs/dbraw/zinc/60/47/13/1032604713.db2.gz PAUMFAWSEIFHGA-KRWDZBQOSA-N 0 3 332.425 3.624 20 5 EHBDHN CCCn1cc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449505387 1032688677 /nfs/dbraw/zinc/68/86/77/1032688677.db2.gz XGDAWPCRAJUYET-QGZVFWFLSA-N 0 3 328.416 3.581 20 5 EHBDHN CC1(C)CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000127128314 1017446928 /nfs/dbraw/zinc/44/69/28/1017446928.db2.gz XOEIJDWEZGHSFY-UHFFFAOYSA-N 0 3 330.388 3.657 20 5 EHBDHN C[C@@H](O)C[C@@H](CNCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000893128115 1018577810 /nfs/dbraw/zinc/57/78/10/1018577810.db2.gz LHZCNMQZPLKIET-CJNGLKHVSA-N 0 3 348.830 3.893 20 5 EHBDHN COc1ccc(COCCN[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000537936260 1021008828 /nfs/dbraw/zinc/00/88/28/1021008828.db2.gz ITJIPGWBJOEXJI-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN CCCCCN(Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C(C)C ZINC000172895871 1033004332 /nfs/dbraw/zinc/00/43/32/1033004332.db2.gz PZNBFNTTYNIMHY-UHFFFAOYSA-N 0 3 331.420 3.711 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCC(C)(C)Oc1ccccc1 ZINC000561589156 1021940116 /nfs/dbraw/zinc/94/01/16/1021940116.db2.gz BFEFPPYEVSYDAB-UHFFFAOYSA-N 0 3 344.411 3.941 20 5 EHBDHN C[C@H](CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 ZINC000602707368 1033092520 /nfs/dbraw/zinc/09/25/20/1033092520.db2.gz UOAQMHQGZZTLHE-LLVKDONJSA-N 0 3 339.317 3.902 20 5 EHBDHN Cc1ncc([N+](=O)[O-])n1CCN(C)[C@H](C)c1cc2ccccc2o1 ZINC000602758775 1033130145 /nfs/dbraw/zinc/13/01/45/1033130145.db2.gz NQUTWOXSYPWKHH-GFCCVEGCSA-N 0 3 328.372 3.539 20 5 EHBDHN CCO[C@@H]1CCC[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000449759567 1033150745 /nfs/dbraw/zinc/15/07/45/1033150745.db2.gz YOIBSUJMZVDSKU-CRAIPNDOSA-N 0 3 330.384 3.902 20 5 EHBDHN Cc1ccc(CN(CCc2ccccc2)[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000535825208 1023799670 /nfs/dbraw/zinc/79/96/70/1023799670.db2.gz PIMDEYZPBQMVAU-IBGZPJMESA-N 0 3 340.423 3.737 20 5 EHBDHN CC[C@H](C)CN(C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000247728900 1023906040 /nfs/dbraw/zinc/90/60/40/1023906040.db2.gz UADYPSSSQNFBNO-WDEREUQCSA-N 0 3 327.812 3.553 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000425246236 1024503601 /nfs/dbraw/zinc/50/36/01/1024503601.db2.gz XZQZSDSYDMJXFN-HNNXBMFYSA-N 0 3 340.427 3.936 20 5 EHBDHN COc1ccc(CN2CCC[C@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000515510212 1025305429 /nfs/dbraw/zinc/30/54/29/1025305429.db2.gz HLSZEEKUGVNTGR-KRWDZBQOSA-N 0 3 344.386 3.950 20 5 EHBDHN C[C@H](NCc1ccc(N2CCCC2=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000119920038 1025423362 /nfs/dbraw/zinc/42/33/62/1025423362.db2.gz JXAUIRWWCNOUFT-AWEZNQCLSA-N 0 3 339.395 3.572 20 5 EHBDHN C[C@@H](c1ccccc1)[C@@H](O)CNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000451057564 1025480751 /nfs/dbraw/zinc/48/07/51/1025480751.db2.gz UBQJIRRJWXGPFN-KSSFIOAISA-N 0 3 328.412 3.584 20 5 EHBDHN Cc1cnc([C@@H](C)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553130 1026105194 /nfs/dbraw/zinc/10/51/94/1026105194.db2.gz XKWYEGNAIJXXGW-ZBFHGGJFSA-N 0 3 326.400 3.634 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN[C@@H]3CCSC4(CCC4)C3)nc2c1 ZINC000896951489 1026150119 /nfs/dbraw/zinc/15/01/19/1026150119.db2.gz PJNPHFFJKNAOHE-LLVKDONJSA-N 0 3 333.413 3.644 20 5 EHBDHN C[C@@H](NCc1ccc(Cn2cccn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178642386 1026998450 /nfs/dbraw/zinc/99/84/50/1026998450.db2.gz IHQRABPFXINXCM-OAHLLOKOSA-N 0 3 336.395 3.690 20 5 EHBDHN CCCn1nccc1C1CCN(Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000501550025 1027346254 /nfs/dbraw/zinc/34/62/54/1027346254.db2.gz KJISTOGUTYKBNA-UHFFFAOYSA-N 0 3 342.443 3.889 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)cnc1NC1CCN(Cc2ccccc2)CC1 ZINC000129754429 1027753283 /nfs/dbraw/zinc/75/32/83/1027753283.db2.gz JOGKGMZHKRLOCG-UHFFFAOYSA-N 0 3 346.818 3.720 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@H](CC(F)F)c2ccccc2)cc1 ZINC000421001442 1027982580 /nfs/dbraw/zinc/98/25/80/1027982580.db2.gz WUXNZTOWQRTZRH-MRXNPFEDSA-N 0 3 336.338 3.960 20 5 EHBDHN CC[C@@H]1CCCC[C@@H]1N(C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680971 1028152168 /nfs/dbraw/zinc/15/21/68/1028152168.db2.gz XWJDRIGGGIGOOL-PBHICJAKSA-N 0 3 333.432 3.742 20 5 EHBDHN CCC[C@@H](N[C@H]1CCCc2c1cnn2C)c1cccc([N+](=O)[O-])c1 ZINC000268838648 1028602371 /nfs/dbraw/zinc/60/23/71/1028602371.db2.gz SZOSBIKPZFXMPN-SJORKVTESA-N 0 3 328.416 3.837 20 5 EHBDHN CCC[C@H](N[C@H]1CCCc2c1cnn2C)c1cccc([N+](=O)[O-])c1 ZINC000268838646 1028602737 /nfs/dbraw/zinc/60/27/37/1028602737.db2.gz SZOSBIKPZFXMPN-IRXDYDNUSA-N 0 3 328.416 3.837 20 5 EHBDHN CCOc1ccc([C@H](C)NCCOc2ccccc2F)cc1[N+](=O)[O-] ZINC000504906035 1029049320 /nfs/dbraw/zinc/04/93/20/1029049320.db2.gz RRQHKZPMPPCUKC-ZDUSSCGKSA-N 0 3 348.374 3.862 20 5 EHBDHN CCCCNC(=O)C1(NCc2cccc([N+](=O)[O-])c2C)CCCCC1 ZINC000440885664 1029243560 /nfs/dbraw/zinc/24/35/60/1029243560.db2.gz JBFHHBIMXHPEGC-UHFFFAOYSA-N 0 3 347.459 3.612 20 5 EHBDHN Cc1cc(-c2noc([C@H](C)N3[C@H](C)CC[C@@H]3C)n2)cc([N+](=O)[O-])c1 ZINC000453299255 1030048439 /nfs/dbraw/zinc/04/84/39/1030048439.db2.gz WZUKBQZBRLIXAJ-XQQFMLRXSA-N 0 3 330.388 3.887 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000245515285 1030109184 /nfs/dbraw/zinc/10/91/84/1030109184.db2.gz DJQBSAGIKSFGQZ-MPGHIAIKSA-N 0 3 328.416 3.744 20 5 EHBDHN CC[C@@H](Cc1ccccc1)N(C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482683453 1030638474 /nfs/dbraw/zinc/63/84/74/1030638474.db2.gz YHPIYHGQCKDBTM-HNNXBMFYSA-N 0 3 338.411 3.924 20 5 EHBDHN Cc1nccnc1CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000550895075 1030778364 /nfs/dbraw/zinc/77/83/64/1030778364.db2.gz LLQLKZWMSDBBNK-FQEVSTJZSA-N 0 3 348.406 3.615 20 5 EHBDHN CCC(CC)Nc1ccncc1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000584200014 1031928540 /nfs/dbraw/zinc/92/85/40/1031928540.db2.gz IWKYDJWWGSJFFU-UHFFFAOYSA-N 0 3 342.399 3.573 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C1CC1)C1CCCCC1 ZINC000063497913 1033406415 /nfs/dbraw/zinc/40/64/15/1033406415.db2.gz UOYCJRSSJYTBNG-UHFFFAOYSA-N 0 3 331.416 3.639 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)n1cc(CNC2CCCCC2)nn1 ZINC000603251665 1033477103 /nfs/dbraw/zinc/47/71/03/1033477103.db2.gz IYMYCJKJLPWSJA-AWEZNQCLSA-N 0 3 343.431 3.526 20 5 EHBDHN COC[C@@H](C)Oc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000594925207 1033546693 /nfs/dbraw/zinc/54/66/93/1033546693.db2.gz MQHKISIOULAGEG-HUUCEWRRSA-N 0 3 344.411 3.859 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCSCC(F)(F)F ZINC000595027272 1033648541 /nfs/dbraw/zinc/64/85/41/1033648541.db2.gz QTGWBLPGAQCDRA-SECBINFHSA-N 0 3 338.351 3.550 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H](C)c1ncc(C)s1 ZINC000595034326 1033654882 /nfs/dbraw/zinc/65/48/82/1033654882.db2.gz VGFYUMZYGMYGBS-PWSUYJOCSA-N 0 3 335.429 3.823 20 5 EHBDHN COc1cccc([C@@H](CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)OC)c1 ZINC000599061199 1033701441 /nfs/dbraw/zinc/70/14/41/1033701441.db2.gz LDFZZNHRJRCCIY-SCLBCKFNSA-N 0 3 330.384 3.642 20 5 EHBDHN CCOC(=O)CC(C)(C)CCN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001168307607 1033836741 /nfs/dbraw/zinc/83/67/41/1033836741.db2.gz CZHAXZWQXDNEAM-UHFFFAOYSA-N 0 3 348.443 3.929 20 5 EHBDHN COc1ccc(CN(CCOc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000603838750 1033950772 /nfs/dbraw/zinc/95/07/72/1033950772.db2.gz GSXMYCWWGBNKIR-UHFFFAOYSA-N 0 3 342.395 3.647 20 5 EHBDHN CN(CCSc1c(Cl)cncc1[N+](=O)[O-])Cc1ccccc1 ZINC000596215126 1034122255 /nfs/dbraw/zinc/12/22/55/1034122255.db2.gz QEQSVOPKGDJUAX-UHFFFAOYSA-N 0 3 337.832 3.867 20 5 EHBDHN O=[N+]([O-])c1cccc(Cl)c1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 ZINC000450855933 1034899151 /nfs/dbraw/zinc/89/91/51/1034899151.db2.gz HRVJMHHUWWDRGR-LYRGGWFBSA-N 0 3 336.819 3.686 20 5 EHBDHN CC(C)[C@H](O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000236597378 1034940991 /nfs/dbraw/zinc/94/09/91/1034940991.db2.gz CVFCEURSFKNSAT-OAHLLOKOSA-N 0 3 338.791 3.615 20 5 EHBDHN CO[C@@](C)([C@H](C)NCc1cc([N+](=O)[O-])ccc1OC(C)C)C1CC1 ZINC000411948128 1035080891 /nfs/dbraw/zinc/08/08/91/1035080891.db2.gz MWOMOEYRNTZWPY-UGSOOPFHSA-N 0 3 336.432 3.675 20 5 EHBDHN Cc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000056201445 1036139196 /nfs/dbraw/zinc/13/91/96/1036139196.db2.gz YIDIYSPAUDJCND-GJZGRUSLSA-N 0 3 341.411 3.889 20 5 EHBDHN CCOc1cc(CN(C)CCc2ccccc2OC)ccc1[N+](=O)[O-] ZINC000492770134 1036269061 /nfs/dbraw/zinc/26/90/61/1036269061.db2.gz LSFDJAKAHRNAMD-UHFFFAOYSA-N 0 3 344.411 3.677 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000589200173 1036305545 /nfs/dbraw/zinc/30/55/45/1036305545.db2.gz VQUVAWFZZFZSGV-MWRSBEEJSA-N 0 3 330.428 3.747 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)N2CC[C@@H](C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000443651847 1036940189 /nfs/dbraw/zinc/94/01/89/1036940189.db2.gz JXVZIURJJKLCLL-NFAWXSAZSA-N 0 3 333.432 3.598 20 5 EHBDHN Cc1ccc(-c2noc([C@H](C)N3[C@@H](C)CC[C@@H]3C)n2)cc1[N+](=O)[O-] ZINC000443206325 1037128039 /nfs/dbraw/zinc/12/80/39/1037128039.db2.gz WFRXGZGNSDPHSO-AVGNSLFASA-N 0 3 330.388 3.887 20 5 EHBDHN CC[C@@H]1CCCC[C@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000163411041 1037380810 /nfs/dbraw/zinc/38/08/10/1037380810.db2.gz XTSAZFUQMBCSMZ-IUODEOHRSA-N 0 3 330.388 3.703 20 5 EHBDHN CCOc1cccc(NC[C@H](c2cccc(F)c2)N(C)C)c1[N+](=O)[O-] ZINC000542467870 1037399684 /nfs/dbraw/zinc/39/96/84/1037399684.db2.gz BTCINVQZLZJRJZ-MRXNPFEDSA-N 0 3 347.390 3.847 20 5 EHBDHN CN(CCc1cccc([N+](=O)[O-])c1)Cc1cnc2ccc(Cl)cn12 ZINC000549408251 1038324805 /nfs/dbraw/zinc/32/48/05/1038324805.db2.gz LVJHXGXMNLDHRB-UHFFFAOYSA-N 0 3 344.802 3.570 20 5 EHBDHN Cc1cccc(C(C)(C)NCC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000539316406 1038770276 /nfs/dbraw/zinc/77/02/76/1038770276.db2.gz VJRFCKSRYXNEPS-UHFFFAOYSA-N 0 3 341.411 3.675 20 5 EHBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1F)[C@H]1Oc2ccccc2[C@H]1C ZINC000478209357 1039291274 /nfs/dbraw/zinc/29/12/74/1039291274.db2.gz QJXRUOQAJHUSFM-SOZUMNATSA-N 0 3 330.359 3.777 20 5 EHBDHN COc1cc(CNC(C)(C)COCc2ccccc2)ccc1[N+](=O)[O-] ZINC000500816786 1039529593 /nfs/dbraw/zinc/52/95/93/1039529593.db2.gz PGVICFURJOEVRY-UHFFFAOYSA-N 0 3 344.411 3.688 20 5 EHBDHN CC(C)(C)Oc1ccc(CNC/C=C\c2ccccc2[N+](=O)[O-])cn1 ZINC000486566416 1040251992 /nfs/dbraw/zinc/25/19/92/1040251992.db2.gz NTDGWSOYQMPOFA-VURMDHGXSA-N 0 3 341.411 3.970 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](N[C@@H]2CCN(C3CC3)C2)c2ccccc2)c1 ZINC000491022889 1040869065 /nfs/dbraw/zinc/86/90/65/1040869065.db2.gz QDAMCVZUECETNM-XLIONFOSSA-N 0 3 337.423 3.511 20 5 EHBDHN CCC[C@]1(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCOC1 ZINC000512873897 1041158736 /nfs/dbraw/zinc/15/87/36/1041158736.db2.gz HDZPNQFSGRVGRL-SFHVURJKSA-N 0 3 330.384 3.904 20 5 EHBDHN Cc1ccc([C@@H](C)NC[C@H](c2ccco2)N2CCCC2)cc1[N+](=O)[O-] ZINC000120316052 1042391498 /nfs/dbraw/zinc/39/14/98/1042391498.db2.gz HXSFQSJUXLYBPP-CRAIPNDOSA-N 0 3 343.427 3.984 20 5 EHBDHN CCn1nccc1C1CCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000278901063 1042881236 /nfs/dbraw/zinc/88/12/36/1042881236.db2.gz PJLNVCIMARMSBV-CQSZACIVSA-N 0 3 328.416 3.752 20 5 EHBDHN C[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000185547072 1126932954 /nfs/dbraw/zinc/93/29/54/1126932954.db2.gz XILLVHZSWMXRDZ-ABAIWWIYSA-N 0 3 332.787 3.903 20 5 EHBDHN C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2ccnn2)cc1 ZINC000090879382 1127081969 /nfs/dbraw/zinc/08/19/69/1127081969.db2.gz MQYGOFPBLUKSJB-KBPBESRZSA-N 0 3 337.383 3.587 20 5 EHBDHN CCS[C@@H]1CC[C@@H](N(C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039957 1127568657 /nfs/dbraw/zinc/56/86/57/1127568657.db2.gz USRGYCZPIAHOLJ-UKRRQHHQSA-N 0 3 348.472 3.816 20 5 EHBDHN Cc1cnc(NC[C@@H](c2ccc(Cl)cc2)N(C)C)c([N+](=O)[O-])c1 ZINC000301457269 1128344706 /nfs/dbraw/zinc/34/47/06/1128344706.db2.gz CLBAWNVVTGCBEO-HNNXBMFYSA-N 0 3 334.807 3.666 20 5 EHBDHN CCCCN(CCCC)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000915204018 1121246823 /nfs/dbraw/zinc/24/68/23/1121246823.db2.gz CVQAPAAYMSVSKW-UHFFFAOYSA-N 0 3 331.420 3.713 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(c2cnn(C)c2)CC1 ZINC000272272237 1121509792 /nfs/dbraw/zinc/50/97/92/1121509792.db2.gz DJLQEPNXPHKXGB-AWEZNQCLSA-N 0 3 328.416 3.577 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CCCN2Cc2ccccc2)c(F)c1 ZINC000390707005 1129017561 /nfs/dbraw/zinc/01/75/61/1129017561.db2.gz RQSNQXTXBUBVME-INIZCTEOSA-N 0 3 329.375 3.810 20 5 EHBDHN CC(C)(C)c1ccc(C(=O)OCCN2CCCCC2)cc1[N+](=O)[O-] ZINC000919558341 1123081785 /nfs/dbraw/zinc/08/17/85/1123081785.db2.gz MRBOUJUVWGIFSE-UHFFFAOYSA-N 0 3 334.416 3.535 20 5 EHBDHN C[C@@H](N(C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)(C)C ZINC000920406105 1123364572 /nfs/dbraw/zinc/36/45/72/1123364572.db2.gz JHNZYJSYRPUWBC-SNVBAGLBSA-N 0 3 327.812 3.553 20 5 EHBDHN COc1ccc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000609916174 1123691696 /nfs/dbraw/zinc/69/16/96/1123691696.db2.gz DAXPKVNPBPKQIV-INIZCTEOSA-N 0 3 344.386 3.807 20 5 EHBDHN Cc1c(CN(Cc2ccccc2)CC(C)(C)O)cccc1[N+](=O)[O-] ZINC000180234284 1123967075 /nfs/dbraw/zinc/96/70/75/1123967075.db2.gz RUYZYVYPFBHLJP-UHFFFAOYSA-N 0 3 328.412 3.676 20 5 EHBDHN CCC1(CC)[C@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)[C@H](C)[C@H]1OC ZINC000617549838 1124648730 /nfs/dbraw/zinc/64/87/30/1124648730.db2.gz NKVAACKMBDSRIP-YMRXKLBXSA-N 0 3 347.415 3.665 20 5 EHBDHN CSc1ccc([C@H](CNc2cc(C)c([N+](=O)[O-])cn2)N(C)C)cc1 ZINC000338837394 1129413379 /nfs/dbraw/zinc/41/33/79/1129413379.db2.gz OAINQKPXRPZTKB-INIZCTEOSA-N 0 3 346.456 3.735 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@@H]3C3CCCC3)n2)c1 ZINC000055927422 1129790675 /nfs/dbraw/zinc/79/06/75/1129790675.db2.gz OVLWPJLRCGIEKS-MRXNPFEDSA-N 0 3 342.399 3.799 20 5 EHBDHN CCN(CC)[C@@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000173363632 1130219088 /nfs/dbraw/zinc/21/90/88/1130219088.db2.gz MYYMDQJYYMCLPG-PBHICJAKSA-N 0 3 331.416 3.922 20 5 EHBDHN CC[C@H](C)[C@@H]1CCCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059334 1131462315 /nfs/dbraw/zinc/46/23/15/1131462315.db2.gz XKSQBTZGXBOLFE-YOEHRIQHSA-N 0 3 343.431 3.711 20 5 EHBDHN CC[C@@H](C)[C@@H]1CCCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057455 1131462343 /nfs/dbraw/zinc/46/23/43/1131462343.db2.gz RJVNCKDXBOWOOH-PBHICJAKSA-N 0 3 343.431 3.711 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@H](NCc1ncccc1Cl)CC2 ZINC001172901370 1131883802 /nfs/dbraw/zinc/88/38/02/1131883802.db2.gz MLPBLDDETKZIMQ-CQSZACIVSA-N 0 3 331.803 3.680 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCOC[C@H]1C1CCCCC1 ZINC001173231069 1132009581 /nfs/dbraw/zinc/00/95/81/1132009581.db2.gz JGKGABKPWVFJSP-KXBFYZLASA-N 0 3 332.444 3.807 20 5 EHBDHN COc1ccccc1OCCN(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000509394497 1132487257 /nfs/dbraw/zinc/48/72/57/1132487257.db2.gz XZWVTWRHAXYBKN-CLFYSBASSA-N 0 3 342.395 3.627 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN2CC=C(c3ccc(Cl)nc3)CC2)cc1 ZINC000773667095 1133062205 /nfs/dbraw/zinc/06/22/05/1133062205.db2.gz SKLPJNSNFMZVFV-UHFFFAOYSA-N 0 3 343.814 3.975 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@H](O)c1c(F)cccc1F)CCC2 ZINC000774249567 1133643379 /nfs/dbraw/zinc/64/33/79/1133643379.db2.gz BUIJDVPDHDRKSJ-IRXDYDNUSA-N 0 3 348.349 3.574 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCC(OC3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170334497 1134751359 /nfs/dbraw/zinc/75/13/59/1134751359.db2.gz FPQYDHKQZDHAFM-CQSZACIVSA-N 0 3 348.443 3.568 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCC[C@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344939 1134758781 /nfs/dbraw/zinc/75/87/81/1134758781.db2.gz FSOCCLMTBDCXFX-AAEUAGOBSA-N 0 3 328.359 3.512 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCC[C@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC001170345843 1134759592 /nfs/dbraw/zinc/75/95/92/1134759592.db2.gz MXANIWHQPWSNIJ-KSSFIOAISA-N 0 3 341.411 3.767 20 5 EHBDHN CC(C)C[C@H]1OCCC[C@H]1NCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775870915 1135833458 /nfs/dbraw/zinc/83/34/58/1135833458.db2.gz OWKKFTWLKSKOBC-GDBMZVCRSA-N 0 3 326.824 3.932 20 5 EHBDHN C[C@@H](c1ccccc1)[C@H](O)CNCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000850411566 1136252727 /nfs/dbraw/zinc/25/27/27/1136252727.db2.gz FPXNOEVYJQMOJB-YVEFUNNKSA-N 0 3 334.803 3.502 20 5 EHBDHN CCN(Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812851552 1136261343 /nfs/dbraw/zinc/26/13/43/1136261343.db2.gz SMMDYKIBYGWRCN-UGSOOPFHSA-N 0 3 332.375 3.678 20 5 EHBDHN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813105336 1136287811 /nfs/dbraw/zinc/28/78/11/1136287811.db2.gz LYHIJBOLSXLOHY-LURJTMIESA-N 0 3 346.817 3.655 20 5 EHBDHN CCOc1ccccc1-c1cccc(C(=O)OCC(C)[N+](=O)[O-])c1 ZINC000813103913 1136288262 /nfs/dbraw/zinc/28/82/62/1136288262.db2.gz IBXIEMFPSKHPMW-CYBMUJFWSA-N 0 3 329.352 3.574 20 5 EHBDHN CC(COC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[N+](=O)[O-] ZINC000813105312 1136294266 /nfs/dbraw/zinc/29/42/66/1136294266.db2.gz LRFNTIYKMIVCIF-ZCFIWIBFSA-N 0 3 345.195 3.546 20 5 EHBDHN CC(COC(=O)c1ccc(CSc2ccccc2)cc1)[N+](=O)[O-] ZINC000813113585 1136294721 /nfs/dbraw/zinc/29/47/21/1136294721.db2.gz GQMNTWOMJJFNJR-CYBMUJFWSA-N 0 3 331.393 3.801 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN(Cc2ccccc2F)CC2CC2)c1 ZINC000852563281 1136466610 /nfs/dbraw/zinc/46/66/10/1136466610.db2.gz BEEPYDBKLBOSJR-LJQANCHMSA-N 0 3 344.386 3.680 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](CO)C2CCCCC2)c1 ZINC000815151296 1136557298 /nfs/dbraw/zinc/55/72/98/1136557298.db2.gz WQVVNSLHOYKRIF-CQSZACIVSA-N 0 3 326.824 3.527 20 5 EHBDHN Cc1ccc(O[C@@H]2CCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858040796 1136934406 /nfs/dbraw/zinc/93/44/06/1136934406.db2.gz QGEJQCXSUFLQPN-NVXWUHKLSA-N 0 3 341.411 3.821 20 5 EHBDHN C[C@H](c1ccncc1)N1CCC(Nc2cccc(F)c2[N+](=O)[O-])CC1 ZINC000819922837 1136966528 /nfs/dbraw/zinc/96/65/28/1136966528.db2.gz MNFLSZODOXNIOC-CYBMUJFWSA-N 0 3 344.390 3.766 20 5 EHBDHN CC(=O)N(C)c1ccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000858494773 1136973062 /nfs/dbraw/zinc/97/30/62/1136973062.db2.gz NLVSQEPOWHJLBB-AWEZNQCLSA-N 0 3 341.411 3.737 20 5 EHBDHN CC([C@H](OC(=O)c1ccc(C(F)F)o1)c1ccccc1F)[N+](=O)[O-] ZINC000860854806 1137081185 /nfs/dbraw/zinc/08/11/85/1137081185.db2.gz JQLLRYYMKPDYIM-SDBXPKJASA-N 0 3 343.257 3.920 20 5 EHBDHN CC([C@H](OC(=O)C[C@H](C)C(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000860855254 1137081307 /nfs/dbraw/zinc/08/13/07/1137081307.db2.gz VOGSOGQWHLPQGA-RWEMILLDSA-N 0 3 337.269 3.664 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@]1(C)CC1(Cl)Cl ZINC000824764598 1137150811 /nfs/dbraw/zinc/15/08/11/1137150811.db2.gz CAAMCWUASWSEFR-ZDUSSCGKSA-N 0 3 333.215 3.667 20 5 EHBDHN CC([C@H](OC(=O)CCc1cccs1)c1ccccc1F)[N+](=O)[O-] ZINC000845872279 1137315975 /nfs/dbraw/zinc/31/59/75/1137315975.db2.gz FWPYYYIQNXWHLP-BZNIZROVSA-N 0 3 337.372 3.770 20 5 EHBDHN CC([C@H](OC(=O)CC1CCSCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845873583 1137316124 /nfs/dbraw/zinc/31/61/24/1137316124.db2.gz DDBPFMGZLVEMCC-BZNIZROVSA-N 0 3 341.404 3.609 20 5 EHBDHN Cc1cccc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845873087 1137316154 /nfs/dbraw/zinc/31/61/54/1137316154.db2.gz BAUBRCMJSQPIKV-UGSOOPFHSA-N 0 3 331.343 3.626 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H]1Cc2ccc(F)cc21)c1ccccc1F)[N+](=O)[O-] ZINC000845875602 1137316260 /nfs/dbraw/zinc/31/62/60/1137316260.db2.gz AEMXYMISTRLIKL-IGGJQXEISA-N 0 3 347.317 3.554 20 5 EHBDHN CC([C@H](OC(=O)C=C1CCSCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878775 1137316435 /nfs/dbraw/zinc/31/64/35/1137316435.db2.gz SRLHYSXXHNQDQO-BZNIZROVSA-N 0 3 339.388 3.529 20 5 EHBDHN CCO[C@H](CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-])C(C)C ZINC000845876759 1137316605 /nfs/dbraw/zinc/31/66/05/1137316605.db2.gz OMFDNKPORGDDRH-MJEQTWJJSA-N 0 3 341.379 3.526 20 5 EHBDHN Cc1nc(C2CC2)oc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881177 1137316800 /nfs/dbraw/zinc/31/68/00/1137316800.db2.gz ZCNBEJIQPHQESM-BMIGLBTASA-N 0 3 348.330 3.563 20 5 EHBDHN CC([C@@H](OC(=O)C[C@H]1CCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845882189 1137317049 /nfs/dbraw/zinc/31/70/49/1137317049.db2.gz NWGRLZFAAXCCQI-UEKVPHQBSA-N 0 3 345.317 3.901 20 5 EHBDHN CC([C@@H](OC(=O)[C@H]1C[C@@H]1c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882201 1137317221 /nfs/dbraw/zinc/31/72/21/1137317221.db2.gz NWJZSXCVXTXKJA-GMLZMKKNSA-N 0 3 343.354 3.879 20 5 EHBDHN CC(C)[C@H](CN[C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccnn1C ZINC000872064419 1137569209 /nfs/dbraw/zinc/56/92/09/1137569209.db2.gz GNWYGNZHBOYHNH-OLZOCXBDSA-N 0 3 334.395 3.558 20 5 EHBDHN CC(C)C[C@H]1CCCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878020299 1137699789 /nfs/dbraw/zinc/69/97/89/1137699789.db2.gz NDCPKSFNIAWJOI-CYBMUJFWSA-N 0 3 330.388 3.655 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(CN[C@H]2CCC[C@@H]3C[C@@H]32)o1 ZINC000878705295 1137725645 /nfs/dbraw/zinc/72/56/45/1137725645.db2.gz UEQVTYOAUNOPCU-ICCXJUOJSA-N 0 3 348.790 3.576 20 5 EHBDHN CCCN(Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(C)C ZINC000878843943 1137729811 /nfs/dbraw/zinc/72/98/11/1137729811.db2.gz NJGJERVIKKBUKV-UHFFFAOYSA-N 0 3 338.795 3.919 20 5 EHBDHN COCC1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000119299782 1137940176 /nfs/dbraw/zinc/94/01/76/1137940176.db2.gz CUBVQENWIVATIZ-UHFFFAOYSA-N 0 3 330.384 3.713 20 5 EHBDHN C[C@H](c1ccccc1F)N(C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000336980789 1138440965 /nfs/dbraw/zinc/44/09/65/1138440965.db2.gz FEGGKQSZIGRLIE-CYBMUJFWSA-N 0 3 345.374 3.756 20 5 EHBDHN CCCC(=O)NC[C@@H]1CCCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182736942 1139989250 /nfs/dbraw/zinc/98/92/50/1139989250.db2.gz ZFPVKUUNPBDOFW-HOTGVXAUSA-N 0 3 347.459 3.593 20 5 EHBDHN C[C@@H](NCCCCc1ccc([N+](=O)[O-])cc1)c1cn2ccccc2n1 ZINC000568304508 370704795 /nfs/dbraw/zinc/70/47/95/370704795.db2.gz RXGYUNJTMCFDQT-OAHLLOKOSA-N 0 3 338.411 3.916 20 5 EHBDHN COc1ccccc1C[C@H](C)N(C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430218739 1015074177 /nfs/dbraw/zinc/07/41/77/1015074177.db2.gz KXHVCLKCXYLBML-AWEZNQCLSA-N 0 3 344.411 3.675 20 5 EHBDHN COc1ccccc1[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430223788 1015099418 /nfs/dbraw/zinc/09/94/18/1015099418.db2.gz VTTHHIFAUUVUNQ-CQSZACIVSA-N 0 3 342.395 3.602 20 5 EHBDHN CC[C@H](NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000538160756 1032181529 /nfs/dbraw/zinc/18/15/29/1032181529.db2.gz POQNLLVTQWPWCN-INIZCTEOSA-N 0 3 341.411 3.891 20 5 EHBDHN C[C@@H]1CCCC[C@]1(C)NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000459609978 1032325973 /nfs/dbraw/zinc/32/59/73/1032325973.db2.gz KAEMWYLJRDKTIT-PXAZEXFGSA-N 0 3 330.388 3.703 20 5 EHBDHN C[C@@H]1CCCC[C@]1(C)NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000459615510 1032352358 /nfs/dbraw/zinc/35/23/58/1032352358.db2.gz PEABAZIOVPVEOP-PXAZEXFGSA-N 0 3 330.388 3.703 20 5 EHBDHN CCC[C@@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCC1 ZINC000459807928 1032484371 /nfs/dbraw/zinc/48/43/71/1032484371.db2.gz RPQVSKZHRHIDIE-OAHLLOKOSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1nccc([C@H]2CCCN([C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368002 1018535909 /nfs/dbraw/zinc/53/59/09/1018535909.db2.gz AQKGNPWQJAHLQC-HIFRSBDPSA-N 0 3 326.400 3.634 20 5 EHBDHN COc1cccc([N+](=O)[O-])c1NC[C@H](c1cccs1)N1CCCC1 ZINC000580242726 1018845886 /nfs/dbraw/zinc/84/58/86/1018845886.db2.gz OFDIAYQIXQXMHN-CQSZACIVSA-N 0 3 347.440 3.914 20 5 EHBDHN COc1ccc(C2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000610410633 1018932775 /nfs/dbraw/zinc/93/27/75/1018932775.db2.gz RDSBFUBNSSDQDZ-UHFFFAOYSA-N 0 3 326.396 3.983 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H]2[C@H]3Cc4ccccc4[C@@H]23)c1 ZINC000580676925 1019830221 /nfs/dbraw/zinc/83/02/21/1019830221.db2.gz FWWBKDXYKUMXIE-USXIJHARSA-N 0 3 346.333 3.624 20 5 EHBDHN CCCN(Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000610476501 1020415150 /nfs/dbraw/zinc/41/51/50/1020415150.db2.gz WIKVCDAYICLDAS-UAGQMJEPSA-N 0 3 336.407 3.759 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nnc(CN(CC3CC3)CC3CCC3)o2)cc1 ZINC000280750141 1020633217 /nfs/dbraw/zinc/63/32/17/1020633217.db2.gz NGNUEOZCBPDBSD-UHFFFAOYSA-N 0 3 342.399 3.657 20 5 EHBDHN CC[C@@](C)(O)CN(Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000439261149 1021286545 /nfs/dbraw/zinc/28/65/45/1021286545.db2.gz QKVDIVRMHFPURT-LJQANCHMSA-N 0 3 328.412 3.758 20 5 EHBDHN O=[N+]([O-])c1cccc(Cl)c1CN1CCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000322943100 1021475512 /nfs/dbraw/zinc/47/55/12/1021475512.db2.gz MUOVGBZQCTTXOG-XGWLTEMNSA-N 0 3 338.835 3.764 20 5 EHBDHN CCOc1ccc(CN(C)CCc2ccccc2[N+](=O)[O-])cc1F ZINC000519675035 1021602263 /nfs/dbraw/zinc/60/22/63/1021602263.db2.gz YYKITUYSZRJLDA-UHFFFAOYSA-N 0 3 332.375 3.807 20 5 EHBDHN CC(C)(F)CCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602712024 1033100718 /nfs/dbraw/zinc/10/07/18/1033100718.db2.gz VBKZOUNRXJYOQI-UHFFFAOYSA-N 0 3 325.203 3.647 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](C)N(C)c1ccccc1 ZINC000509573967 1023072407 /nfs/dbraw/zinc/07/24/07/1023072407.db2.gz WNUIIDVDAKTBIK-HNNXBMFYSA-N 0 3 343.427 3.608 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000610818800 1023782661 /nfs/dbraw/zinc/78/26/61/1023782661.db2.gz SJTBIYJDLPQPAP-VXGBXAGGSA-N 0 3 340.383 3.897 20 5 EHBDHN Cc1c([C@H](C)N[C@@H](C)c2ccc3[nH]c(=O)[nH]c3c2)cccc1[N+](=O)[O-] ZINC000610818771 1023782931 /nfs/dbraw/zinc/78/29/31/1023782931.db2.gz ANXJIQKRIDBXGR-RYUDHWBXSA-N 0 3 340.383 3.897 20 5 EHBDHN COc1ccccc1C(C)(C)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000507787836 1024263058 /nfs/dbraw/zinc/26/30/58/1024263058.db2.gz VCYJICMNHZBNFE-UHFFFAOYSA-N 0 3 330.384 3.507 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CCC[C@@H]1Cc1cccc(F)c1 ZINC000520785198 1024792039 /nfs/dbraw/zinc/79/20/39/1024792039.db2.gz BJMXUPVBGVEIJB-QGZVFWFLSA-N 0 3 344.386 3.820 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1 ZINC000281896180 1025649956 /nfs/dbraw/zinc/64/99/56/1025649956.db2.gz BEHOEPNUEIXAFU-MRXNPFEDSA-N 0 3 340.427 3.507 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@@H]1[C@H]2CCCO[C@H]2C1(C)C ZINC000451480216 1025997414 /nfs/dbraw/zinc/99/74/14/1025997414.db2.gz PQUIVNNTUQBODP-KBAYOESNSA-N 0 3 348.443 3.675 20 5 EHBDHN Cc1c(CN[C@@H](C)CC(=O)Nc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000478491407 1026126812 /nfs/dbraw/zinc/12/68/12/1026126812.db2.gz ONPSPNYDIXLSGO-LBPRGKRZSA-N 0 3 345.374 3.549 20 5 EHBDHN Cc1c(CN[C@@H]2CCCN(C)c3ccccc32)cccc1[N+](=O)[O-] ZINC000451866365 1026358716 /nfs/dbraw/zinc/35/87/16/1026358716.db2.gz JPVWNSGAZMEMMZ-QGZVFWFLSA-N 0 3 325.412 3.964 20 5 EHBDHN C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc[nH]c(=O)c1 ZINC000339450531 1026565161 /nfs/dbraw/zinc/56/51/61/1026565161.db2.gz BLVYDOOBPBZYFZ-GFCCVEGCSA-N 0 3 339.351 3.806 20 5 EHBDHN O=[N+]([O-])c1ccc(NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000366853178 1028232204 /nfs/dbraw/zinc/23/22/04/1028232204.db2.gz BAGMJQZHYCSPEH-UHFFFAOYSA-N 0 3 343.349 3.812 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000532918391 1029070399 /nfs/dbraw/zinc/07/03/99/1029070399.db2.gz TVWJNQJALFDRQG-XCRHUMRWSA-N 0 3 345.443 3.742 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@H](OC)C(C)C)o2)c([N+](=O)[O-])c1 ZINC000525289941 1029782084 /nfs/dbraw/zinc/78/20/84/1029782084.db2.gz DVZDSHSEZPQLSY-SFHVURJKSA-N 0 3 348.399 3.624 20 5 EHBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCc2ccccc2Cl)n1 ZINC000447522967 1030244031 /nfs/dbraw/zinc/24/40/31/1030244031.db2.gz ROJVTWQVKILMPV-HUUCEWRRSA-N 0 3 334.807 3.718 20 5 EHBDHN CN(C)Cc1ccc(-c2noc(-c3ccc(F)cc3[N+](=O)[O-])n2)cc1 ZINC000532065992 1030327815 /nfs/dbraw/zinc/32/78/15/1030327815.db2.gz OYLHBHGNGCZHCN-UHFFFAOYSA-N 0 3 342.330 3.513 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNC(C)(C)c1ccccc1C ZINC000583800663 1030797215 /nfs/dbraw/zinc/79/72/15/1030797215.db2.gz XMMKGEOUSFFHRU-UHFFFAOYSA-N 0 3 341.411 3.675 20 5 EHBDHN CC(C)(C)[C@H]1CCCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000483251362 1031064720 /nfs/dbraw/zinc/06/47/20/1031064720.db2.gz CZBJTNZDQRDWAD-AWEZNQCLSA-N 0 3 344.415 3.903 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)Cc1cccc(F)c1 ZINC000026223904 1031385836 /nfs/dbraw/zinc/38/58/36/1031385836.db2.gz HGDFNQZXLJLJQS-UHFFFAOYSA-N 0 3 345.374 3.503 20 5 EHBDHN C[C@H](NC[C@H](O)C(F)F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000484468944 1031587593 /nfs/dbraw/zinc/58/75/93/1031587593.db2.gz BWONYPJNWXYMHT-CABZTGNLSA-N 0 3 342.367 3.600 20 5 EHBDHN CC(C)(C)OC(=O)CCCN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000343601580 1031594083 /nfs/dbraw/zinc/59/40/83/1031594083.db2.gz GZDWDZWKUIHESX-UHFFFAOYSA-N 0 3 334.416 3.681 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H](CCCO)c1ccccc1 ZINC000594495261 1033397765 /nfs/dbraw/zinc/39/77/65/1033397765.db2.gz PGAZEJVJZSRJQS-MSOLQXFVSA-N 0 3 326.396 3.686 20 5 EHBDHN O=[N+]([O-])c1ccc(CNc2ccc([C@H]3CNCCO3)cc2)c(Cl)c1 ZINC000594740330 1033510384 /nfs/dbraw/zinc/51/03/84/1033510384.db2.gz VTNSADYPWNMNKJ-QGZVFWFLSA-N 0 3 347.802 3.521 20 5 EHBDHN COC[C@@H](C)Oc1ccc(CNCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000594939259 1033589518 /nfs/dbraw/zinc/58/95/18/1033589518.db2.gz UDEUNZKXHKIRDB-CQSZACIVSA-N 0 3 344.411 3.607 20 5 EHBDHN CC1(C)OCC[C@@H]1CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000594994079 1033624079 /nfs/dbraw/zinc/62/40/79/1033624079.db2.gz DWWAMJDYEGISJW-CYBMUJFWSA-N 0 3 347.440 3.623 20 5 EHBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000595467666 1033821079 /nfs/dbraw/zinc/82/10/79/1033821079.db2.gz SPTZADJTEBLXAR-NUJGCVRESA-N 0 3 336.407 3.640 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(Cc3cnc4ccccc4n3)C2)cc1 ZINC000595520808 1033837935 /nfs/dbraw/zinc/83/79/35/1033837935.db2.gz FEWPTOIXMKXSEP-INIZCTEOSA-N 0 3 348.406 3.918 20 5 EHBDHN Cc1ccccc1CN1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000603840155 1033985192 /nfs/dbraw/zinc/98/51/92/1033985192.db2.gz KVPQUEDEIDXNBL-UHFFFAOYSA-N 0 3 325.412 3.534 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCCC2(CC2)CC1 ZINC000599672176 1034080964 /nfs/dbraw/zinc/08/09/64/1034080964.db2.gz BXCKGCQLPWALNM-ZDUSSCGKSA-N 0 3 342.399 3.972 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCC[C@H]2CCc3ccccc3N2)c(F)c1 ZINC000593318902 1034655281 /nfs/dbraw/zinc/65/52/81/1034655281.db2.gz SADJYTVSSXSSTR-OAHLLOKOSA-N 0 3 329.375 3.641 20 5 EHBDHN CCc1nnc(CN[C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000290146947 1034819976 /nfs/dbraw/zinc/81/99/76/1034819976.db2.gz LAWHCQLDBXUCMU-JSGCOSHPSA-N 0 3 346.456 3.510 20 5 EHBDHN COc1cncc(/C=C/CCN(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000563061170 1035025347 /nfs/dbraw/zinc/02/53/47/1035025347.db2.gz ZKCWNQNTTDOJJZ-FNORWQNLSA-N 0 3 327.384 3.534 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nc(CN3C[C@@H]4CCCC[C@H]4C3)co2)cc1 ZINC000089908695 1036934487 /nfs/dbraw/zinc/93/44/87/1036934487.db2.gz TUXGHSBGBSZVLJ-GJZGRUSLSA-N 0 3 327.384 3.872 20 5 EHBDHN CCC[C@@H](NCc1ccc([S@@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000090220740 1036951115 /nfs/dbraw/zinc/95/11/15/1036951115.db2.gz QUERRIOMIHKXKL-KOSHJBKYSA-N 0 3 346.452 3.963 20 5 EHBDHN C[C@](CO)(NCc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000542000359 1036963832 /nfs/dbraw/zinc/96/38/32/1036963832.db2.gz QQAAPLLRVDZNHW-MRXNPFEDSA-N 0 3 326.824 3.669 20 5 EHBDHN CC(C)C[C@H]1CCCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000130238815 1037037215 /nfs/dbraw/zinc/03/72/15/1037037215.db2.gz PPBILQSUFGLROC-OAHLLOKOSA-N 0 3 330.388 3.655 20 5 EHBDHN O=[N+]([O-])c1ccn(CCN2CCCCC[C@H]2/C=C/c2cccs2)n1 ZINC000542131640 1037108272 /nfs/dbraw/zinc/10/82/72/1037108272.db2.gz NKZDUSHJMZKCTR-KIUWMYQTSA-N 0 3 346.456 3.811 20 5 EHBDHN CC[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC000271769554 1037169985 /nfs/dbraw/zinc/16/99/85/1037169985.db2.gz XBMRNMHBUNKGDR-IAGOWNOFSA-N 0 3 336.338 3.647 20 5 EHBDHN CC(C)C[C@@H]1CCCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000130247094 1037189659 /nfs/dbraw/zinc/18/96/59/1037189659.db2.gz HSUGGOVKZYAFTP-AWEZNQCLSA-N 0 3 330.388 3.655 20 5 EHBDHN CC(=O)c1cc(NCCCN(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000341367004 1038024886 /nfs/dbraw/zinc/02/48/86/1038024886.db2.gz JVAVVNCMMVJVSO-UHFFFAOYSA-N 0 3 341.411 3.731 20 5 EHBDHN C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCc2occc21 ZINC000341439290 1038265636 /nfs/dbraw/zinc/26/56/36/1038265636.db2.gz HPNQJNXOZOUWKA-WBMJQRKESA-N 0 3 343.383 3.572 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC(n2cc(Cl)cn2)CC1 ZINC000363891678 1038796342 /nfs/dbraw/zinc/79/63/42/1038796342.db2.gz UKRYNZMLDXJNEC-UHFFFAOYSA-N 0 3 334.807 3.590 20 5 EHBDHN CC[C@@]1(CNCc2ccccc2[N+](=O)[O-])OCCc2ccccc21 ZINC000584498733 1040286832 /nfs/dbraw/zinc/28/68/32/1040286832.db2.gz CTXWLLOZSAYRQE-IBGZPJMESA-N 0 3 326.396 3.563 20 5 EHBDHN COc1cc(CN(C)CC2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000512667968 1040465337 /nfs/dbraw/zinc/46/53/37/1040465337.db2.gz HVVIIIORUIMZEK-UHFFFAOYSA-N 0 3 344.358 3.827 20 5 EHBDHN Cc1cnc(C2CCN(CCOc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000433148773 1040909752 /nfs/dbraw/zinc/90/97/52/1040909752.db2.gz RUKQRBLINMUOEN-UHFFFAOYSA-N 0 3 347.440 3.618 20 5 EHBDHN Cc1ccc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])c(CN(C)C)c1 ZINC000072840903 1042603930 /nfs/dbraw/zinc/60/39/30/1042603930.db2.gz VANZXQXZSRHDCF-PKNBQFBNSA-N 0 3 339.395 3.617 20 5 EHBDHN Cc1c([C@H](C)N[C@H](C)c2ccc(NC(N)=O)cc2)cccc1[N+](=O)[O-] ZINC000165435251 1042814434 /nfs/dbraw/zinc/81/44/34/1042814434.db2.gz SEUBGSDNDNVAGX-OLZOCXBDSA-N 0 3 342.399 3.806 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@@H]1CC=CCC1 ZINC000344030523 1043124331 /nfs/dbraw/zinc/12/43/31/1043124331.db2.gz BUJRFLLTAWBUPM-UONOGXRCSA-N 0 3 342.399 3.994 20 5 EHBDHN C[C@@H](N[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCC1 ZINC000172171396 1127798863 /nfs/dbraw/zinc/79/88/63/1127798863.db2.gz UHIUAKVAROPBOS-NEPJUHHUSA-N 0 3 330.388 3.874 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000254964514 1128971535 /nfs/dbraw/zinc/97/15/35/1128971535.db2.gz ZIEXWGQQUGEBKB-FLIBITNWSA-N 0 3 339.395 3.617 20 5 EHBDHN C[C@@H](C[C@@H]1CCCO1)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113333103 1129002320 /nfs/dbraw/zinc/00/23/20/1129002320.db2.gz WGRUHMROZABVMO-LRDDRELGSA-N 0 3 347.440 3.766 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)cnc1N[C@H](CN1CCCC1)c1ccccc1 ZINC000301737762 1129013888 /nfs/dbraw/zinc/01/38/88/1129013888.db2.gz IPRLWUZLOQZDCD-OAHLLOKOSA-N 0 3 346.818 3.892 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCC3(C4CC4)CC3)cs2)c1 ZINC000130667334 1122384533 /nfs/dbraw/zinc/38/45/33/1122384533.db2.gz QIEVREGEYRGFPI-UHFFFAOYSA-N 0 3 329.425 3.998 20 5 EHBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC[C@@H](c2cc[nH]n2)C1 ZINC000615836027 1123884330 /nfs/dbraw/zinc/88/43/30/1123884330.db2.gz HCDDJXOIXIMFDU-SCOADAFUSA-N 0 3 326.400 3.601 20 5 EHBDHN C[C@H](CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000735077183 1131307822 /nfs/dbraw/zinc/30/78/22/1131307822.db2.gz GZNGZIZNYXLWQS-MRXNPFEDSA-N 0 3 325.412 3.521 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CN3CC(C4CCOCC4)C3)o2)c1 ZINC000619726629 1125389803 /nfs/dbraw/zinc/38/98/03/1125389803.db2.gz VWGAEHUQCLCQGJ-UHFFFAOYSA-N 0 3 342.395 3.713 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)/C=C\c1cccc([N+](=O)[O-])c1 ZINC000255710186 1129184739 /nfs/dbraw/zinc/18/47/39/1129184739.db2.gz KOOPBSYVKSBUEZ-KTKRTIGZSA-N 0 3 339.395 3.617 20 5 EHBDHN C[C@]1(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO[C@@H]1C1CC1 ZINC000543242304 1129365890 /nfs/dbraw/zinc/36/58/90/1129365890.db2.gz JYRCIKWWZPTKFE-MOPGFXCFSA-N 0 3 342.395 3.902 20 5 EHBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000154464339 1129560945 /nfs/dbraw/zinc/56/09/45/1129560945.db2.gz DGVNCGPBGWZBOE-UHFFFAOYSA-N 0 3 336.395 3.627 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CN3C[C@@H]4CCC[C@H]4C3)cs2)c1 ZINC000093442937 1129588353 /nfs/dbraw/zinc/58/83/53/1129588353.db2.gz XLQLIOQXVGIDJG-KBPBESRZSA-N 0 3 329.425 3.950 20 5 EHBDHN CC[C@@H]1CCCC[C@H]1N(C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304729 1129660247 /nfs/dbraw/zinc/66/02/47/1129660247.db2.gz UJLAKCPTEFGDAT-HUUCEWRRSA-N 0 3 333.432 3.742 20 5 EHBDHN O=[N+]([O-])c1cnc2c(c1)CN(CCCSCc1ccccc1)CC2 ZINC000347801495 1129824577 /nfs/dbraw/zinc/82/45/77/1129824577.db2.gz UOPKFDUZFKAJQA-UHFFFAOYSA-N 0 3 343.452 3.671 20 5 EHBDHN CCCCNC(=O)[C@@H]1CCCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245521615 1130230832 /nfs/dbraw/zinc/23/08/32/1130230832.db2.gz LAWUPBSGLNPYMT-HZPDHXFCSA-N 0 3 347.459 3.593 20 5 EHBDHN CCc1ccc(C(=O)Nc2ccc(C)cc2CN(C)C)cc1[N+](=O)[O-] ZINC000174238282 1130342668 /nfs/dbraw/zinc/34/26/68/1130342668.db2.gz RXWRDFLDAAEYDR-UHFFFAOYSA-N 0 3 341.411 3.780 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N[C@H](C)c2cccc(C)n2)c1F ZINC001173188034 1131993583 /nfs/dbraw/zinc/99/35/83/1131993583.db2.gz HYLOYPCRNVIIBO-CHWSQXEVSA-N 0 3 347.390 3.728 20 5 EHBDHN CCN(Cc1ccccn1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173196590 1131996503 /nfs/dbraw/zinc/99/65/03/1131996503.db2.gz NXYQHKPFNQDJGI-CYBMUJFWSA-N 0 3 347.390 3.591 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)NCC(=O)c1ccc(Cl)cc1 ZINC001173215786 1132002027 /nfs/dbraw/zinc/00/20/27/1132002027.db2.gz ZSRRVXZMLBSQOP-GFCCVEGCSA-N 0 3 332.787 3.652 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(Br)o1 ZINC001173219328 1132003127 /nfs/dbraw/zinc/00/31/27/1132003127.db2.gz AXOVZLBDAVIZLS-JTQLQIEISA-N 0 3 339.189 3.671 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@@](CF)(C(F)(F)F)C1 ZINC001173221259 1132004355 /nfs/dbraw/zinc/00/43/55/1132004355.db2.gz GSEJDXUPRPRGAE-RISCZKNCSA-N 0 3 334.313 3.750 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@H]1COCc1ccccc1 ZINC001173225940 1132006650 /nfs/dbraw/zinc/00/66/50/1132006650.db2.gz GTJQWEGJIAHDJY-UZLBHIALSA-N 0 3 340.423 3.817 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(C[C@H](O)c2ccc(Cl)cc2)C2CC2)cc1 ZINC000772278754 1133672610 /nfs/dbraw/zinc/67/26/10/1133672610.db2.gz QRRHGUPQDGZRFM-SFHVURJKSA-N 0 3 346.814 3.946 20 5 EHBDHN O=C(OCc1cccc([N+](=O)[O-])c1)c1cccc(CN2CCCC2)c1 ZINC000785714933 1133747050 /nfs/dbraw/zinc/74/70/50/1133747050.db2.gz PVFIWJIAGMCUNI-UHFFFAOYSA-N 0 3 340.379 3.548 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@@H]1CCCc2nc(C)ncc21 ZINC000786810888 1133909517 /nfs/dbraw/zinc/90/95/17/1133909517.db2.gz BPVIFJGZFDXWCO-FHLIRTJZSA-N 0 3 338.411 3.764 20 5 EHBDHN CC(C)[C@@H](NCc1ccc([N+](=O)[O-])cc1F)[C@@H](O)c1ccccc1 ZINC000788537322 1134138944 /nfs/dbraw/zinc/13/89/44/1134138944.db2.gz JHXSKLJVBLQITR-MSOLQXFVSA-N 0 3 332.375 3.582 20 5 EHBDHN CC(C)O[C@@H]1C[C@H](NCc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001170386077 1134762116 /nfs/dbraw/zinc/76/21/16/1134762116.db2.gz MJQXZTJMKUYTKS-LSDHHAIUSA-N 0 3 326.824 3.930 20 5 EHBDHN CC(C)O[C@H]1C[C@@H](NCc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001170386072 1134762640 /nfs/dbraw/zinc/76/26/40/1134762640.db2.gz MJQXZTJMKUYTKS-CABCVRRESA-N 0 3 326.824 3.930 20 5 EHBDHN CCS[C@H]1CCCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879229 1134810929 /nfs/dbraw/zinc/81/09/29/1134810929.db2.gz GPKSEPOWJBUJNU-ZFWWWQNUSA-N 0 3 339.417 3.657 20 5 EHBDHN CN1CC[C@H](NCc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000810006295 1135913075 /nfs/dbraw/zinc/91/30/75/1135913075.db2.gz IONOOZLGSUXEGB-WMZOPIPTSA-N 0 3 345.830 3.783 20 5 EHBDHN C[NH+]1CCC(c2ccc(Nc3cc([O-])cc([N+](=O)[O-])c3)cc2)CC1 ZINC001201221426 1136000019 /nfs/dbraw/zinc/00/00/19/1136000019.db2.gz BJPYNEZDRKHHDY-UHFFFAOYSA-N 0 3 327.384 3.853 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776279698 1136134629 /nfs/dbraw/zinc/13/46/29/1136134629.db2.gz XENNFJNEXIYUNE-QZTJIDSGSA-N 0 3 330.359 3.604 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776279694 1136134815 /nfs/dbraw/zinc/13/48/15/1136134815.db2.gz XENNFJNEXIYUNE-MSOLQXFVSA-N 0 3 330.359 3.604 20 5 EHBDHN C[C@H](N)c1ncc(-c2ccccc2)n1-c1c(Cl)nccc1[N+](=O)[O-] ZINC001170679976 1136219366 /nfs/dbraw/zinc/21/93/66/1136219366.db2.gz OHMINGUBWQBBRY-JTQLQIEISA-N 0 3 343.774 3.516 20 5 EHBDHN CO[C@@](C)(CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000812772945 1136244734 /nfs/dbraw/zinc/24/47/34/1136244734.db2.gz SXDZGPROOBCXOI-AWEZNQCLSA-N 0 3 333.215 3.806 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C)[C@@H](O)c1ccc(F)cc1 ZINC000850437084 1136258774 /nfs/dbraw/zinc/25/87/74/1136258774.db2.gz ZCJWUWGRTRDVRM-OAVHHTNSSA-N 0 3 348.374 3.515 20 5 EHBDHN O=[N+]([O-])c1cc(F)ccc1CN[C@H](c1ccccc1)C1CCOCC1 ZINC000851901008 1136417924 /nfs/dbraw/zinc/41/79/24/1136417924.db2.gz BZCHTGNNYROCQO-LJQANCHMSA-N 0 3 344.386 3.991 20 5 EHBDHN CC(C)CN(Cc1ccccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776577955 1136443501 /nfs/dbraw/zinc/44/35/01/1136443501.db2.gz BMDQIEUFZVFHDT-LJQANCHMSA-N 0 3 346.402 3.926 20 5 EHBDHN COc1ccccc1[C@H](O)CNCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000853092877 1136507898 /nfs/dbraw/zinc/50/78/98/1136507898.db2.gz RLEXKCPTRDKSIL-GOSISDBHSA-N 0 3 344.411 3.550 20 5 EHBDHN CCOc1ccc([C@@H](C)N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556081 1136610145 /nfs/dbraw/zinc/61/01/45/1136610145.db2.gz NPIVZIJAADQLTF-OLZOCXBDSA-N 0 3 329.400 3.988 20 5 EHBDHN Cc1c(CNC[C@H](O)c2ccc(F)cc2Cl)cccc1[N+](=O)[O-] ZINC000819261320 1136929682 /nfs/dbraw/zinc/92/96/82/1136929682.db2.gz JIIQRLNMUITVNP-INIZCTEOSA-N 0 3 338.766 3.519 20 5 EHBDHN CC(C)CN1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])CC1 ZINC001649164287 1137110435 /nfs/dbraw/zinc/11/04/35/1137110435.db2.gz SEMSQBRCPRQVHU-UHFFFAOYSA-N 0 3 348.834 3.574 20 5 EHBDHN CC([C@@H](OC(=O)C[C@@H](C)n1cccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845877413 1137316462 /nfs/dbraw/zinc/31/64/62/1137316462.db2.gz PPOQHDBYIGLQMX-IIYDPXPESA-N 0 3 334.347 3.528 20 5 EHBDHN CC([C@H](OC(=O)[C@@H](C)c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881185 1137316789 /nfs/dbraw/zinc/31/67/89/1137316789.db2.gz ZENLTFVNDZVPQR-AHIWAGSCSA-N 0 3 331.343 3.879 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](O)c1c(F)cccc1F ZINC000773016430 1137459665 /nfs/dbraw/zinc/45/96/65/1137459665.db2.gz YKEBDFVJJNEROT-BZNIZROVSA-N 0 3 336.338 3.566 20 5 EHBDHN C[C@@H](N[C@@H](C)CC(=O)Nc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000872130749 1137573162 /nfs/dbraw/zinc/57/31/62/1137573162.db2.gz QLOMZECIFYVOHZ-UONOGXRCSA-N 0 3 327.384 3.663 20 5 EHBDHN O=[N+]([O-])c1cc(CNC[C@@H]2CC2(Cl)Cl)cc(C(F)(F)F)c1 ZINC000877482586 1137677884 /nfs/dbraw/zinc/67/78/84/1137677884.db2.gz DAOZGKFCOHUVHF-VIFPVBQESA-N 0 3 343.132 3.897 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1nnc(CN2CCC[C@@H]3CCCC[C@@H]32)o1 ZINC000879008773 1137735235 /nfs/dbraw/zinc/73/52/35/1137735235.db2.gz JTKZNOYLLHCKCH-ZFWWWQNUSA-N 0 3 342.399 3.799 20 5 EHBDHN Cc1ccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c(CN(C)C)c1 ZINC000113911437 1137915411 /nfs/dbraw/zinc/91/54/11/1137915411.db2.gz KMBOMQQZDGDKSM-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN C[C@H](O)CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000078410253 1138149181 /nfs/dbraw/zinc/14/91/81/1138149181.db2.gz NSGRTNJVWWUZJD-NSHDSACASA-N 0 3 336.775 3.511 20 5 EHBDHN CCC[C@H](CCO)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000080524355 1138163034 /nfs/dbraw/zinc/16/30/34/1138163034.db2.gz UADUISCVNFAMLS-CYBMUJFWSA-N 0 3 349.456 3.607 20 5 EHBDHN Cc1ccc(C)n1C1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000337678783 1138641624 /nfs/dbraw/zinc/64/16/24/1138641624.db2.gz MNOXFYSFASNNPV-UHFFFAOYSA-N 0 3 343.427 3.729 20 5 EHBDHN Cc1ccccc1NC(=O)CCN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180399667 1139831972 /nfs/dbraw/zinc/83/19/72/1139831972.db2.gz LPJCEUUHWPFWAF-CQSZACIVSA-N 0 3 327.384 3.583 20 5 EHBDHN C[C@@H]1CCC[C@@H](C)C1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000182946553 1140003372 /nfs/dbraw/zinc/00/33/72/1140003372.db2.gz QBFLQGLEWRYDBW-VXGBXAGGSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@@H](NC[C@H](O)c1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000187419773 1140255026 /nfs/dbraw/zinc/25/50/26/1140255026.db2.gz VKNPKYQIIMLSQJ-HWPZZCPQSA-N 0 3 338.766 3.772 20 5 EHBDHN CCC[C@@H](NCc1ccc(N(C)C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000268766367 1140986860 /nfs/dbraw/zinc/98/68/60/1140986860.db2.gz NVMBYBQDVVTINK-QGZVFWFLSA-N 0 3 328.416 3.687 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc([N+](=O)[O-])cc2C)c1 ZINC000270365187 1141212627 /nfs/dbraw/zinc/21/26/27/1141212627.db2.gz HUQDWTHDFGYOKB-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN C[C@H](NC[C@H](O)c1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000271518376 1141386247 /nfs/dbraw/zinc/38/62/47/1141386247.db2.gz PWECTCXBUYORTC-BONVTDFDSA-N 0 3 338.766 3.772 20 5 EHBDHN C[C@H]1CN(c2ccc3ccc4ccc(Cl)nc4c3n2)[C@@H](C)CN1C ZINC001164643638 719205456 /nfs/dbraw/zinc/20/54/56/719205456.db2.gz ZVADVIGMJFPKTK-STQMWFEESA-N 0 3 340.858 3.965 20 5 EHBDHN C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cc[nH]c(=O)c1 ZINC000339453253 1014511743 /nfs/dbraw/zinc/51/17/43/1014511743.db2.gz FQSIINXQYQJVII-GFCCVEGCSA-N 0 3 339.351 3.806 20 5 EHBDHN C[C@@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cc[nH]c(=O)c1 ZINC000339457975 1014521609 /nfs/dbraw/zinc/52/16/09/1014521609.db2.gz JTJGRLKUUKYZNW-GFCCVEGCSA-N 0 3 339.351 3.806 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](N[C@@H]2CCc3c[nH]nc3C2)c2ccccc2)c1 ZINC000359895406 1015909213 /nfs/dbraw/zinc/90/92/13/1015909213.db2.gz GWIYINRSQQWNND-XLIONFOSSA-N 0 3 348.406 3.554 20 5 EHBDHN C[C@@H]1C[C@H](CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)O1 ZINC000414517058 1016948288 /nfs/dbraw/zinc/94/82/88/1016948288.db2.gz QCTAZMJFNZNBMN-YRGRVCCFSA-N 0 3 347.440 3.621 20 5 EHBDHN Cn1cc(CN2CC(C3CCCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000459617533 1032329044 /nfs/dbraw/zinc/32/90/44/1032329044.db2.gz QXWDZZRLRZPKJY-UHFFFAOYSA-N 0 3 340.427 3.617 20 5 EHBDHN COc1ccc(C)cc1[C@@H](C)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000536855684 1032352619 /nfs/dbraw/zinc/35/26/19/1032352619.db2.gz AVKDSFNBQKCLLU-CQSZACIVSA-N 0 3 330.384 3.641 20 5 EHBDHN Cn1cc([C@H](NC/C=C\c2ccccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000538430305 1032359022 /nfs/dbraw/zinc/35/90/22/1032359022.db2.gz VALJVPTZZLATLY-KMDWOBIYSA-N 0 3 328.416 3.719 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(Cc3cccc4nccn43)C2)cc1 ZINC000449497631 1032668656 /nfs/dbraw/zinc/66/86/56/1032668656.db2.gz ISNPWGZRWUEOGL-INIZCTEOSA-N 0 3 336.395 3.622 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCCN3C3CCCC3)n2)cc1 ZINC000275643003 1017874479 /nfs/dbraw/zinc/87/44/79/1017874479.db2.gz ORTIKRVOXRALMZ-HNNXBMFYSA-N 0 3 328.372 3.724 20 5 EHBDHN COc1ccc(COCCN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000091741007 1018555198 /nfs/dbraw/zinc/55/51/98/1018555198.db2.gz MUJOEPCSLYGEIR-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(OC[C@@H]2CCCO2)CC1 ZINC000182836711 1019764855 /nfs/dbraw/zinc/76/48/55/1019764855.db2.gz KXJFCBPAKCLCPR-QAPCUYQASA-N 0 3 348.443 3.624 20 5 EHBDHN C[C@@H](c1ccncc1)N1CCC(Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000119263724 1019822982 /nfs/dbraw/zinc/82/29/82/1019822982.db2.gz TXQCNFDPAYHBMP-ZDUSSCGKSA-N 0 3 344.390 3.766 20 5 EHBDHN COCc1cc([C@H](C)NCc2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000126054633 1020213901 /nfs/dbraw/zinc/21/39/01/1020213901.db2.gz GTPIXTQKTBFPFP-ZDUSSCGKSA-N 0 3 330.384 3.601 20 5 EHBDHN Cc1ccc(CN2CC[C@@]3(C2)CCc2ccccc2O3)cc1[N+](=O)[O-] ZINC000581103330 1020432741 /nfs/dbraw/zinc/43/27/41/1020432741.db2.gz OJSMVNKARAUKBC-HXUWFJFHSA-N 0 3 338.407 3.873 20 5 EHBDHN CCC(CC)[C@H]1C[C@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)CCO1 ZINC000602590243 1032988088 /nfs/dbraw/zinc/98/80/88/1032988088.db2.gz YGCNKDOCWISTEA-CXAGYDPISA-N 0 3 347.415 3.809 20 5 EHBDHN CCC1(O)CCC(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602580805 1033001017 /nfs/dbraw/zinc/00/10/17/1033001017.db2.gz HKGRWAHIHCWOAR-UHFFFAOYSA-N 0 3 346.349 3.787 20 5 EHBDHN O=[N+]([O-])c1sc(CNCC2(C(F)F)CC2)cc1Br ZINC000602645632 1033036297 /nfs/dbraw/zinc/03/62/97/1033036297.db2.gz XBXXJLBTPGKGDF-UHFFFAOYSA-N 0 3 341.177 3.554 20 5 EHBDHN C[C@H](C[C@H]1CCOC1)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610740639 1023404027 /nfs/dbraw/zinc/40/40/27/1023404027.db2.gz XERKNQOIYCNJKG-CHWSQXEVSA-N 0 3 347.440 3.623 20 5 EHBDHN Cc1c([C@H](C)N[C@H](C)c2ccc3[nH]c(=O)[nH]c3c2)cccc1[N+](=O)[O-] ZINC000610818769 1023782669 /nfs/dbraw/zinc/78/26/69/1023782669.db2.gz ANXJIQKRIDBXGR-NEPJUHHUSA-N 0 3 340.383 3.897 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCC1(c2ccc(F)cc2)CC1 ZINC000509615222 1023972232 /nfs/dbraw/zinc/97/22/32/1023972232.db2.gz DOTWMVOZJCNKAM-UHFFFAOYSA-N 0 3 344.386 3.954 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCc1ccns1 ZINC000895529654 1024585757 /nfs/dbraw/zinc/58/57/57/1024585757.db2.gz UZRQGTMNXCDMBV-UHFFFAOYSA-N 0 3 332.212 3.690 20 5 EHBDHN Cc1cc(NC[C@@H](C)N2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000520748267 1024610540 /nfs/dbraw/zinc/61/05/40/1024610540.db2.gz GSGFYDULYOGLPX-OAHLLOKOSA-N 0 3 325.412 3.762 20 5 EHBDHN Cc1ncc([N+](=O)[O-])n1CCN(Cc1ccc(C(C)C)cc1)C1CC1 ZINC000611566617 1024681923 /nfs/dbraw/zinc/68/19/23/1024681923.db2.gz LYEPDTPBKUJNQZ-UHFFFAOYSA-N 0 3 342.443 3.888 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCc1ccccc1Cl ZINC000507933711 1024781341 /nfs/dbraw/zinc/78/13/41/1024781341.db2.gz SUKGZGKCQRGLNO-UHFFFAOYSA-N 0 3 334.803 3.979 20 5 EHBDHN COC(=O)[C@@H](CCN[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000425461758 1025367011 /nfs/dbraw/zinc/36/70/11/1025367011.db2.gz SJOQELMWSYLMHX-YOEHRIQHSA-N 0 3 342.395 3.592 20 5 EHBDHN COc1ccc([C@H](C)NC/C=C/c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000237247213 1025987867 /nfs/dbraw/zinc/98/78/67/1025987867.db2.gz CZFMHHMKXVQWHX-OWNNVSBGSA-N 0 3 342.395 3.976 20 5 EHBDHN C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cncn2)cc1 ZINC000152782370 1026713988 /nfs/dbraw/zinc/71/39/88/1026713988.db2.gz GLRDWIAFUSYIBO-KBPBESRZSA-N 0 3 337.383 3.587 20 5 EHBDHN COc1cc(CN(CC2CC2)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000533495708 1027958940 /nfs/dbraw/zinc/95/89/40/1027958940.db2.gz YDWPHBIDPFHQOO-UHFFFAOYSA-N 0 3 344.358 3.825 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCOc2ccc(C(F)(F)F)cc2)cc1 ZINC000237844809 1029459005 /nfs/dbraw/zinc/45/90/05/1029459005.db2.gz MYMQJKYCWOERIY-UHFFFAOYSA-N 0 3 340.301 3.782 20 5 EHBDHN Cc1c(-c2noc([C@@H](C)N3[C@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000453246162 1029973352 /nfs/dbraw/zinc/97/33/52/1029973352.db2.gz CRVLYZWHKXJQBY-NTZNESFSSA-N 0 3 330.388 3.887 20 5 EHBDHN CCOc1ccc([C@@H](C)N2CCC[C@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000453365343 1030180657 /nfs/dbraw/zinc/18/06/57/1030180657.db2.gz LVARIAAIFKWXAN-KDOFPFPSSA-N 0 3 334.416 3.557 20 5 EHBDHN CC[C@H](C)CN(CC)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000482881640 1030787080 /nfs/dbraw/zinc/78/70/80/1030787080.db2.gz DQYMNIKSRBDWAP-NSHDSACASA-N 0 3 327.812 3.555 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@H](c2ccc(F)cc2)C1 ZINC000483104655 1030959942 /nfs/dbraw/zinc/95/99/42/1030959942.db2.gz WFNIHZOTBLRRRZ-AWEZNQCLSA-N 0 3 330.359 3.732 20 5 EHBDHN C[C@@H]1CCC[C@@H](NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]1C ZINC000248552672 1031939660 /nfs/dbraw/zinc/93/96/60/1031939660.db2.gz JDODQEOSTWJJNY-TYNCELHUSA-N 0 3 330.388 3.559 20 5 EHBDHN CC(C)(C)OC(=O)CCCN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000343707088 1032030002 /nfs/dbraw/zinc/03/00/02/1032030002.db2.gz BDAVEUUHCMOLAM-UHFFFAOYSA-N 0 3 334.416 3.681 20 5 EHBDHN CCOc1ccccc1[C@@H](C)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000537966561 1032052199 /nfs/dbraw/zinc/05/21/99/1032052199.db2.gz ROOGKMMOOOFYCS-CQSZACIVSA-N 0 3 330.384 3.723 20 5 EHBDHN COc1cccc([C@H](CN[C@H](C)c2ccc([N+](=O)[O-])cc2)OC)c1 ZINC000599061197 1033701567 /nfs/dbraw/zinc/70/15/67/1033701567.db2.gz LDFZZNHRJRCCIY-ACJLOTCBSA-N 0 3 330.384 3.642 20 5 EHBDHN C[C@@H](COCC1CC1)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000593682502 1033752249 /nfs/dbraw/zinc/75/22/49/1033752249.db2.gz QSSMKXCVBZNDSI-ZDUSSCGKSA-N 0 3 330.384 3.760 20 5 EHBDHN Cc1ccccc1CN1CCCN(c2ccc([N+](=O)[O-])s2)CC1 ZINC000064029487 1033943691 /nfs/dbraw/zinc/94/36/91/1033943691.db2.gz YBTZWUBHBJVQQC-UHFFFAOYSA-N 0 3 331.441 3.677 20 5 EHBDHN Cc1cc(N2CCCN(Cc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000603844875 1033969480 /nfs/dbraw/zinc/96/94/80/1033969480.db2.gz BQIBMXLQQAHNOA-UHFFFAOYSA-N 0 3 343.402 3.755 20 5 EHBDHN COc1ccc(CN(C)CCCOc2ccccc2C)cc1[N+](=O)[O-] ZINC000603869881 1033997402 /nfs/dbraw/zinc/99/74/02/1033997402.db2.gz VOPNQOPVHDFRQG-UHFFFAOYSA-N 0 3 344.411 3.813 20 5 EHBDHN C[C@H]1CCCC[N@@H+]1Cc1ccc(Nc2cc[n-]c(=O)c2[N+](=O)[O-])cc1 ZINC000596080910 1034074151 /nfs/dbraw/zinc/07/41/51/1034074151.db2.gz PMGOPXZSZYGHPK-ZDUSSCGKSA-N 0 3 342.399 3.813 20 5 EHBDHN C[C@H]1CCCC[N@H+]1Cc1ccc(Nc2cc[n-]c(=O)c2[N+](=O)[O-])cc1 ZINC000596080910 1034074164 /nfs/dbraw/zinc/07/41/64/1034074164.db2.gz PMGOPXZSZYGHPK-ZDUSSCGKSA-N 0 3 342.399 3.813 20 5 EHBDHN CC(C)c1cc(CN[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)on1 ZINC000169212489 1034150985 /nfs/dbraw/zinc/15/09/85/1034150985.db2.gz UREIRAXHOQAOSX-KRWDZBQOSA-N 0 3 329.400 3.817 20 5 EHBDHN CC(C)(C)OC(=O)CCCCNCc1ccc([N+](=O)[O-])cc1Cl ZINC000612188648 1034438587 /nfs/dbraw/zinc/43/85/87/1034438587.db2.gz FSOJVRLDUUMJQM-UHFFFAOYSA-N 0 3 342.823 3.850 20 5 EHBDHN CC[C@@H](NCCn1ccc(C(F)(F)F)n1)c1cccc([N+](=O)[O-])c1 ZINC000601964776 1034850986 /nfs/dbraw/zinc/85/09/86/1034850986.db2.gz UJELKCDOCCFBFG-CYBMUJFWSA-N 0 3 342.321 3.551 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCc2ccccn2)c2ccccc2)c1 ZINC000179966977 1035095050 /nfs/dbraw/zinc/09/50/50/1035095050.db2.gz DTSPELOIYVHPOY-HXUWFJFHSA-N 0 3 333.391 3.912 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000548991601 1035405514 /nfs/dbraw/zinc/40/55/14/1035405514.db2.gz KFOLMEAFDBFBQY-GOSISDBHSA-N 0 3 347.846 3.949 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(Nc2ccccn2)CC1 ZINC000540911791 1035789844 /nfs/dbraw/zinc/78/98/44/1035789844.db2.gz NLYBIIVDAIHLSH-OAHLLOKOSA-N 0 3 340.427 3.936 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@H]2/C=C/c2ccccc2)c1 ZINC000780396958 1035994827 /nfs/dbraw/zinc/99/48/27/1035994827.db2.gz GRGGMFHENBNMTN-WIMDODNTSA-N 0 3 338.407 3.806 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCSCC(F)(F)F)c(Cl)c1 ZINC000541555581 1036449170 /nfs/dbraw/zinc/44/91/70/1036449170.db2.gz GYTHCAVZYPYSAC-UHFFFAOYSA-N 0 3 328.743 3.633 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN([C@@H](C)CO)C1CCCC1 ZINC000472619544 1037543597 /nfs/dbraw/zinc/54/35/97/1037543597.db2.gz RAQJWKFKECLYKC-AWEZNQCLSA-N 0 3 336.432 3.507 20 5 EHBDHN CC[C@@H](NCCOc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000540446160 1037946367 /nfs/dbraw/zinc/94/63/67/1037946367.db2.gz PBJNYYHDIRJOME-OAHLLOKOSA-N 0 3 336.338 3.993 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H](c1ccccc1)C1CC1 ZINC000540589774 1038117255 /nfs/dbraw/zinc/11/72/55/1038117255.db2.gz KHZTWIRIZCOFCT-LJQANCHMSA-N 0 3 339.395 3.583 20 5 EHBDHN C[C@H]1CC(C)(C)CC[C@@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000481111349 1038129388 /nfs/dbraw/zinc/12/93/88/1038129388.db2.gz OUIJSUANTCOZSD-WFASDCNBSA-N 0 3 344.415 3.949 20 5 EHBDHN CC(C)(C)C1CCC(O)(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000236817454 1038135153 /nfs/dbraw/zinc/13/51/53/1038135153.db2.gz YGMYNWCIIVEQRG-UHFFFAOYSA-N 0 3 326.462 3.713 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000552034826 1038755178 /nfs/dbraw/zinc/75/51/78/1038755178.db2.gz BXLLHLFXMMBMCA-QGZVFWFLSA-N 0 3 344.415 3.608 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC(c3ccsc3)CC2)cc1 ZINC000485990993 1039762788 /nfs/dbraw/zinc/76/27/88/1039762788.db2.gz PARPAJGQEUUMJX-UHFFFAOYSA-N 0 3 332.425 3.915 20 5 EHBDHN Cc1ccc(NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000433117771 1040795176 /nfs/dbraw/zinc/79/51/76/1040795176.db2.gz VHERSKVWRWYSJO-INIZCTEOSA-N 0 3 331.416 3.639 20 5 EHBDHN CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCCO1 ZINC000511662217 1041372290 /nfs/dbraw/zinc/37/22/90/1041372290.db2.gz ANWYRJLWUGDZLD-INIZCTEOSA-N 0 3 330.384 3.856 20 5 EHBDHN CC(=O)c1ccc(N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000511710998 1041473858 /nfs/dbraw/zinc/47/38/58/1041473858.db2.gz CHYNDCFCJONRGN-MELADBBJSA-N 0 3 333.432 3.576 20 5 EHBDHN CC[C@H]1c2ccsc2CCN1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136930164 1044512750 /nfs/dbraw/zinc/51/27/50/1044512750.db2.gz RYHYJPWCHHMWNE-HOTGVXAUSA-N 0 3 332.425 3.699 20 5 EHBDHN O=C(CNC1(c2ccccc2)CCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000183538118 1125591659 /nfs/dbraw/zinc/59/16/59/1125591659.db2.gz HYLWLKJKSOQKDV-UHFFFAOYSA-N 0 3 339.395 3.592 20 5 EHBDHN Cc1cnc([C@@H](NCCCOc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000185302925 1126856405 /nfs/dbraw/zinc/85/64/05/1126856405.db2.gz QEYOSIKAKMOLOP-INIZCTEOSA-N 0 3 347.440 3.870 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@@H](c2ccc(F)cc2F)C2CC2)cc1 ZINC001168541067 1127615556 /nfs/dbraw/zinc/61/55/56/1127615556.db2.gz FVSWUSMJWJACQR-GOSISDBHSA-N 0 3 348.349 3.993 20 5 EHBDHN CS(=O)(=O)[C@H]1CCN(Cc2c3ccccc3cc3ccccc32)C1 ZINC000282256052 1128132816 /nfs/dbraw/zinc/13/28/16/1128132816.db2.gz BMRGFSQXPPQGAM-KRWDZBQOSA-N 0 3 339.460 3.612 20 5 EHBDHN C[C@H]1C[C@H](c2ccccc2)CN1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478250 1131242266 /nfs/dbraw/zinc/24/22/66/1131242266.db2.gz XXRKYODHZIPQDE-YOEHRIQHSA-N 0 3 336.395 3.780 20 5 EHBDHN CC[C@@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000765846230 1128550151 /nfs/dbraw/zinc/55/01/51/1128550151.db2.gz WKNYNNZKOFQCNA-IAGOWNOFSA-N 0 3 336.338 3.647 20 5 EHBDHN COC[C@@H](CC(C)C)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494516369 1120576892 /nfs/dbraw/zinc/57/68/92/1120576892.db2.gz TYOMGBYIUUWDRB-CYBMUJFWSA-N 0 3 334.338 3.764 20 5 EHBDHN CC(C)CN(Cn1cc(Br)c([N+](=O)[O-])n1)CC(C)(C)C ZINC000761831761 1120975856 /nfs/dbraw/zinc/97/58/56/1120975856.db2.gz OIWBQUZXZLZIMY-UHFFFAOYSA-N 0 3 347.257 3.515 20 5 EHBDHN CN1CC[C@@H](NCc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000554957921 1128959528 /nfs/dbraw/zinc/95/95/28/1128959528.db2.gz GEXGWCMCZKGRGG-SJLPKXTDSA-N 0 3 345.830 3.783 20 5 EHBDHN CC[C@H](C)[C@@H](C)N(Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000064808224 1128964902 /nfs/dbraw/zinc/96/49/02/1128964902.db2.gz FHEJZPQPHJFNCB-QWHCGFSZSA-N 0 3 334.416 3.860 20 5 EHBDHN COC(=O)Nc1cccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000495690201 1121358729 /nfs/dbraw/zinc/35/87/29/1121358729.db2.gz LHVNGPVBXDOFKJ-ZDUSSCGKSA-N 0 3 343.383 3.932 20 5 EHBDHN CCC[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000193630270 1121514289 /nfs/dbraw/zinc/51/42/89/1121514289.db2.gz OFUDUTQNCVINGX-HNNXBMFYSA-N 0 3 327.384 3.664 20 5 EHBDHN CC(C)CCOC1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000193862108 1121722004 /nfs/dbraw/zinc/72/20/04/1121722004.db2.gz VPMWZEGDUDDPPR-UHFFFAOYSA-N 0 3 336.432 3.501 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN[C@H](c2ccccc2)c2ccccn2)cc1 ZINC000326435871 1121942190 /nfs/dbraw/zinc/94/21/90/1121942190.db2.gz XSBDVODAGNDQSK-HXUWFJFHSA-N 0 3 333.391 3.912 20 5 EHBDHN O=[N+]([O-])c1c(F)cccc1NCC1(N2CCSCC2)CCCC1 ZINC000301115383 1121950085 /nfs/dbraw/zinc/95/00/85/1121950085.db2.gz VFCHZMYGKBEMMM-UHFFFAOYSA-N 0 3 339.436 3.507 20 5 EHBDHN CCCCN(CCCC)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917431217 1122607132 /nfs/dbraw/zinc/60/71/32/1122607132.db2.gz NSYJODMLVHAUSE-UHFFFAOYSA-N 0 3 331.420 3.713 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@@H](C)CSC)o2)c([N+](=O)[O-])c1 ZINC000130702673 1123255075 /nfs/dbraw/zinc/25/50/75/1123255075.db2.gz AEFPCGQUVHZHKG-NSHDSACASA-N 0 3 336.413 3.705 20 5 EHBDHN CCC[C@@]1(COC)CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000618550628 1125106542 /nfs/dbraw/zinc/10/65/42/1125106542.db2.gz LPNFHXVSOTUMAN-KRWDZBQOSA-N 0 3 333.388 3.517 20 5 EHBDHN C[C@]1(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO[C@H]1C1CC1 ZINC000543242305 1129365831 /nfs/dbraw/zinc/36/58/31/1129365831.db2.gz JYRCIKWWZPTKFE-OALUTQOASA-N 0 3 342.395 3.902 20 5 EHBDHN C[C@H](N[C@@H](c1ccccc1)C1CC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000012674604 1129451363 /nfs/dbraw/zinc/45/13/63/1129451363.db2.gz PCHGDBFDYKENHJ-UGSOOPFHSA-N 0 3 339.395 3.663 20 5 EHBDHN C[C@@H](N[C@@H](c1ccccc1)C1CC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000012674613 1129451400 /nfs/dbraw/zinc/45/14/00/1129451400.db2.gz PCHGDBFDYKENHJ-ACJLOTCBSA-N 0 3 339.395 3.663 20 5 EHBDHN O=[N+]([O-])c1ccc(Nc2cccc(CN3CCSCC3)c2)cc1 ZINC000301998142 1129505572 /nfs/dbraw/zinc/50/55/72/1129505572.db2.gz UMWXUNSMBSUTJS-UHFFFAOYSA-N 0 3 329.425 3.887 20 5 EHBDHN C[C@@H]1CCC[C@H](C)CN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000125235815 1129672617 /nfs/dbraw/zinc/67/26/17/1129672617.db2.gz QCRDQFUORISOLM-QWHCGFSZSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H]1CCC[C@H](C)N(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000125433875 1129691756 /nfs/dbraw/zinc/69/17/56/1129691756.db2.gz FOXKSGOKCFWXCY-STQMWFEESA-N 0 3 330.388 3.655 20 5 EHBDHN Cc1c(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)cnn1C ZINC000156537536 1129722977 /nfs/dbraw/zinc/72/29/77/1129722977.db2.gz UFZOGBUVCYGFMK-UHFFFAOYSA-N 0 3 342.424 3.655 20 5 EHBDHN CO[C@@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000509148174 1129854289 /nfs/dbraw/zinc/85/42/89/1129854289.db2.gz AQAATKKWPNKYRV-CYBMUJFWSA-N 0 3 332.425 3.934 20 5 EHBDHN CCCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC(C)C ZINC000604492914 1129931324 /nfs/dbraw/zinc/93/13/24/1129931324.db2.gz VCSWSPYUDYYVKP-UHFFFAOYSA-N 0 3 327.812 3.555 20 5 EHBDHN C[C@H](CN(C)C(=O)OC(C)(C)C)N[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000701880040 1130177953 /nfs/dbraw/zinc/17/79/53/1130177953.db2.gz UYPJRTDGDDNNFP-CHWSQXEVSA-N 0 3 337.420 3.501 20 5 EHBDHN CCN(CC)Cc1ccc(C(=O)O[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000728167594 1130642473 /nfs/dbraw/zinc/64/24/73/1130642473.db2.gz PQFNBZCHYMCJCP-ZDUSSCGKSA-N 0 3 346.383 3.948 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@@H](NCc1ncc(Cl)s1)CC2 ZINC001172903747 1131886377 /nfs/dbraw/zinc/88/63/77/1131886377.db2.gz SXRXAKZGHBCERM-LBPRGKRZSA-N 0 3 337.832 3.742 20 5 EHBDHN O=C1CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@@H]2CCCC[C@H]12 ZINC001172908403 1131887982 /nfs/dbraw/zinc/88/79/82/1131887982.db2.gz MDOITLZGSHBJDY-NZSAHSFTSA-N 0 3 342.439 3.676 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N(C)Cc2ccc(C)nc2)c1F ZINC001173191200 1131995061 /nfs/dbraw/zinc/99/50/61/1131995061.db2.gz BACCWDNJIGCXIZ-CYBMUJFWSA-N 0 3 347.390 3.509 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N(C)Cc1nc2ccccc2o1 ZINC001173231720 1132009504 /nfs/dbraw/zinc/00/95/04/1132009504.db2.gz CMKYGZACFCBLNC-CYBMUJFWSA-N 0 3 325.368 3.799 20 5 EHBDHN Cc1ccc(F)cc1NC(=O)CCN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC001176036947 1132825625 /nfs/dbraw/zinc/82/56/25/1132825625.db2.gz QMHFEMLXULYDLN-ZDUSSCGKSA-N 0 3 345.374 3.722 20 5 EHBDHN C[C@@H](c1ccccc1)[C@@H](CO)NCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000766967249 1132924433 /nfs/dbraw/zinc/92/44/33/1132924433.db2.gz IGQNOMCBQIYNBI-BLLLJJGKSA-N 0 3 334.803 3.502 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCCOCC(F)(F)F)o2)c1 ZINC001177170856 1133032888 /nfs/dbraw/zinc/03/28/88/1133032888.db2.gz OKDCPISWDWTWII-UHFFFAOYSA-N 0 3 344.289 3.523 20 5 EHBDHN CCC[C@@H](C)[C@@H]1CCCN1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765173 1133050623 /nfs/dbraw/zinc/05/06/23/1133050623.db2.gz KHOHLPBIUORPEB-ZBFHGGJFSA-N 0 3 343.431 3.711 20 5 EHBDHN COCC[C@@H]1CCCCN(Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000767940065 1133073781 /nfs/dbraw/zinc/07/37/81/1133073781.db2.gz DHCLZEZKMKUSKX-ZDUSSCGKSA-N 0 3 326.824 3.887 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1n[nH]c(-c3ccccc3)n1)CCC2 ZINC000774313759 1133659048 /nfs/dbraw/zinc/65/90/48/1133659048.db2.gz KILHLOUMYMMOEF-QGZVFWFLSA-N 0 3 349.394 3.547 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1nc(-c3ccccc3)n[nH]1)CCC2 ZINC000774313759 1133659050 /nfs/dbraw/zinc/65/90/50/1133659050.db2.gz KILHLOUMYMMOEF-QGZVFWFLSA-N 0 3 349.394 3.547 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@H]1CCCc2nc(C)ncc21 ZINC000786810892 1133909255 /nfs/dbraw/zinc/90/92/55/1133909255.db2.gz BPVIFJGZFDXWCO-GWCFYCIZSA-N 0 3 338.411 3.764 20 5 EHBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CNCc1nnc(-c2ccccc2)[nH]1 ZINC000786813687 1133910144 /nfs/dbraw/zinc/91/01/44/1133910144.db2.gz MBHQGGXUALONLZ-GXDHUFHOSA-N 0 3 349.394 3.573 20 5 EHBDHN Cc1cc(N2CCN(C3CCC(C(C)C)CC3)CC2)ncc1[N+](=O)[O-] ZINC001185611793 1134113820 /nfs/dbraw/zinc/11/38/20/1134113820.db2.gz NPVGALWKDACOTD-UHFFFAOYSA-N 0 3 346.475 3.635 20 5 EHBDHN C[C@@H]1CN(CCCCNc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000791412127 1134547765 /nfs/dbraw/zinc/54/77/65/1134547765.db2.gz BRMQVSUTVWYIKW-CHWSQXEVSA-N 0 3 341.839 3.550 20 5 EHBDHN CC[C@@](C)(NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000775389520 1134705105 /nfs/dbraw/zinc/70/51/05/1134705105.db2.gz GNOPUDKIGQKCPN-LJQANCHMSA-N 0 3 341.411 3.757 20 5 EHBDHN COc1ccc(C[C@H](C)N(C)Cc2ccc(Cl)nc2)c([N+](=O)[O-])c1 ZINC001170352938 1134754249 /nfs/dbraw/zinc/75/42/49/1134754249.db2.gz UXLQYHAPMPFGMH-LBPRGKRZSA-N 0 3 349.818 3.715 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H]1CCC[C@H](O)C1 ZINC000811481534 1136091391 /nfs/dbraw/zinc/09/13/91/1136091391.db2.gz FDWSICKOMNCOQE-SKDRFNHKSA-N 0 3 333.215 3.542 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](O)c1cc(C)cc(C)c1 ZINC000850467731 1136265354 /nfs/dbraw/zinc/26/53/54/1136265354.db2.gz SDVRDHLYEJMZIW-KDOFPFPSSA-N 0 3 344.411 3.604 20 5 EHBDHN CC(COC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)[N+](=O)[O-] ZINC000813105345 1136288386 /nfs/dbraw/zinc/28/83/86/1136288386.db2.gz XRIQUZKIDPAXCD-SNVBAGLBSA-N 0 3 337.278 3.579 20 5 EHBDHN CCOc1ccc([C@@H](C)N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556080 1136610225 /nfs/dbraw/zinc/61/02/25/1136610225.db2.gz NPIVZIJAADQLTF-CHWSQXEVSA-N 0 3 329.400 3.988 20 5 EHBDHN CCOc1ccc([C@H](C)N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556082 1136610349 /nfs/dbraw/zinc/61/03/49/1136610349.db2.gz NPIVZIJAADQLTF-QWHCGFSZSA-N 0 3 329.400 3.988 20 5 EHBDHN CC([C@H](OC(=O)C[C@@H](C)C(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000860855253 1137081388 /nfs/dbraw/zinc/08/13/88/1137081388.db2.gz VOGSOGQWHLPQGA-KKFJDGPESA-N 0 3 337.269 3.664 20 5 EHBDHN CC(C)c1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845873289 1137316119 /nfs/dbraw/zinc/31/61/19/1137316119.db2.gz CFSOPPDSJDQGHU-YVEFUNNKSA-N 0 3 346.358 3.907 20 5 EHBDHN CC([C@@H](OC(=O)CCCOC(C)(C)C)c1ccccc1F)[N+](=O)[O-] ZINC000845883824 1137317241 /nfs/dbraw/zinc/31/72/41/1137317241.db2.gz WFPMMFVMXQEKEK-MLGOLLRUSA-N 0 3 341.379 3.671 20 5 EHBDHN CC(=O)Nc1ccc([C@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000866541078 1137363276 /nfs/dbraw/zinc/36/32/76/1137363276.db2.gz VVOXQYOJJOEOFA-ZDUSSCGKSA-N 0 3 327.384 3.712 20 5 EHBDHN CC(C)n1ncc2c1C[C@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])CC2 ZINC000872067615 1137569523 /nfs/dbraw/zinc/56/95/23/1137569523.db2.gz ZSUOUTRZRMOIPS-GXTWGEPZSA-N 0 3 346.406 3.719 20 5 EHBDHN C[C@H](N[C@H]1CCO[C@@H](c2ccncc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872075573 1137569981 /nfs/dbraw/zinc/56/99/81/1137569981.db2.gz DUPCUFBTPUFACD-RVSPLBMKSA-N 0 3 345.374 3.700 20 5 EHBDHN CC[C@H](C)[C@@H](C)NCc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878365898 1137712959 /nfs/dbraw/zinc/71/29/59/1137712959.db2.gz GBDINKNRDGSTPV-VHSXEESVSA-N 0 3 338.795 3.822 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)N[C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000107070306 1137885390 /nfs/dbraw/zinc/88/53/90/1137885390.db2.gz WIEMDAXVWDXFQZ-KBPBESRZSA-N 0 3 327.384 3.581 20 5 EHBDHN O=[N+]([O-])c1cccc(Br)c1CNC[C@@H]1CCCSC1 ZINC001202618674 1137887430 /nfs/dbraw/zinc/88/74/30/1137887430.db2.gz KYDDRIBJTCJNKP-JTQLQIEISA-N 0 3 345.262 3.590 20 5 EHBDHN Cc1ccc([C@H](C)NCc2ccc(F)c(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000120890232 1137953292 /nfs/dbraw/zinc/95/32/92/1137953292.db2.gz AGIBQCTVKUHHJY-AWEZNQCLSA-N 0 3 345.418 3.955 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000091957889 1138223434 /nfs/dbraw/zinc/22/34/34/1138223434.db2.gz VRBOJDGOILLOBB-BMTPJICMSA-N 0 3 342.395 3.789 20 5 EHBDHN CC(C)(C)[C@H]1CCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000264300683 1138467797 /nfs/dbraw/zinc/46/77/97/1138467797.db2.gz VLPWEPZQMFZOPV-CQSZACIVSA-N 0 3 330.388 3.655 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000153256385 1139128546 /nfs/dbraw/zinc/12/85/46/1139128546.db2.gz FOXYEKUQOTVUPI-PXAZEXFGSA-N 0 3 348.374 3.517 20 5 EHBDHN Cc1ccccc1NC(=O)CCN[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181810948 1139932589 /nfs/dbraw/zinc/93/25/89/1139932589.db2.gz KCWCRHZLQRZONC-OAHLLOKOSA-N 0 3 341.411 3.891 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CNC1(c2ccc(F)cc2)CCOCC1 ZINC000183476897 1140041040 /nfs/dbraw/zinc/04/10/40/1140041040.db2.gz WGSSIIQTDCPKIW-UHFFFAOYSA-N 0 3 344.386 3.838 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](CNC(=O)OC(C)(C)C)C1 ZINC000266552518 1140701578 /nfs/dbraw/zinc/70/15/78/1140701578.db2.gz UYUQMSWONFHLRB-KBPBESRZSA-N 0 3 349.431 3.502 20 5 EHBDHN Cc1ccc([C@@H](C)NCCC(=O)N(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000268789376 1140992340 /nfs/dbraw/zinc/99/23/40/1140992340.db2.gz FLVRRTGMFBRZCF-OAHLLOKOSA-N 0 3 341.411 3.607 20 5 EHBDHN CC(C)[C@@H]1N(C/C=C/c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414527940 1016953868 /nfs/dbraw/zinc/95/38/68/1016953868.db2.gz NJYBVTZHILJHEM-FZMUQLTDSA-N 0 3 330.428 3.745 20 5 EHBDHN CC[C@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H](O)C(C)C ZINC000414536823 1016963687 /nfs/dbraw/zinc/96/36/87/1016963687.db2.gz YHLZVAIECMNOHV-HOTGVXAUSA-N 0 3 349.456 3.603 20 5 EHBDHN C[C@H]1CCCC[C@@]1(C)NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000459622521 1032335248 /nfs/dbraw/zinc/33/52/48/1032335248.db2.gz YKHNGMOLPDLXTB-YVEFUNNKSA-N 0 3 330.388 3.703 20 5 EHBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1cccc(C(F)(F)F)n1 ZINC000449402005 1032525130 /nfs/dbraw/zinc/52/51/30/1032525130.db2.gz OZVJWNKRITYFAH-LLVKDONJSA-N 0 3 339.317 3.729 20 5 EHBDHN O=[N+]([O-])c1cc(CNCC[C@H]2CSc3ccccc3O2)cs1 ZINC000592372659 1032672953 /nfs/dbraw/zinc/67/29/53/1032672953.db2.gz IGLQXLFWTSOMDW-LBPRGKRZSA-N 0 3 336.438 3.689 20 5 EHBDHN O=[N+]([O-])c1cnn(CCN2CCCCC[C@H]2/C=C\c2cccs2)c1 ZINC000543990652 1017119272 /nfs/dbraw/zinc/11/92/72/1017119272.db2.gz PLWRAYHAXWYARI-LZNQSLFOSA-N 0 3 346.456 3.811 20 5 EHBDHN C[C@H](O)C[C@H]1CCCCCN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000388351918 1017971399 /nfs/dbraw/zinc/97/13/99/1017971399.db2.gz ADDQDXSPZZGJQF-GXTWGEPZSA-N 0 3 326.824 3.764 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCCN(C)c1ccccc1 ZINC000509603133 1021548210 /nfs/dbraw/zinc/54/82/10/1021548210.db2.gz QPBYTWAFOOLYKN-UHFFFAOYSA-N 0 3 343.427 3.610 20 5 EHBDHN COc1ccc(OCCN(C)C/C=C\c2ccccc2[N+](=O)[O-])cc1 ZINC000506054773 1021872394 /nfs/dbraw/zinc/87/23/94/1021872394.db2.gz BMVNAQKSVJJBAJ-ALCCZGGFSA-N 0 3 342.395 3.627 20 5 EHBDHN CC(C)(C)OC1CC(CCNCc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602634990 1033046630 /nfs/dbraw/zinc/04/66/30/1033046630.db2.gz VPGDEZGJZIULMH-UHFFFAOYSA-N 0 3 347.415 3.809 20 5 EHBDHN Cc1ccccc1NC(=O)C[C@H](C)NCc1cccc([N+](=O)[O-])c1C ZINC000477727131 1022717898 /nfs/dbraw/zinc/71/78/98/1022717898.db2.gz WSAQRPMUIXZKJY-AWEZNQCLSA-N 0 3 341.411 3.719 20 5 EHBDHN O=C(CN[C@@H](CC1CC1)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000610831070 1023781269 /nfs/dbraw/zinc/78/12/69/1023781269.db2.gz LZACGELWXJJKGE-KRWDZBQOSA-N 0 3 339.395 3.664 20 5 EHBDHN COc1c([O-])ccc(C[NH2+][C@@H](C)C2CCC(F)(F)CC2)c1[N+](=O)[O-] ZINC000895226023 1024010550 /nfs/dbraw/zinc/01/05/50/1024010550.db2.gz QYDDDBYVVXUNOM-JTQLQIEISA-N 0 3 344.358 3.613 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](OCc2ccncc2)C1 ZINC000280899668 1024410907 /nfs/dbraw/zinc/41/09/07/1024410907.db2.gz DSUPKIIDKRLVOC-MAUKXSAKSA-N 0 3 341.411 3.650 20 5 EHBDHN CCOc1ccccc1[C@H](CC(C)C)NCCn1ccc([N+](=O)[O-])n1 ZINC000342245291 1024536771 /nfs/dbraw/zinc/53/67/71/1024536771.db2.gz QQFJUNNBPXHFOO-INIZCTEOSA-N 0 3 346.431 3.567 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCCOCC3CCC3)o2)c1 ZINC000514765805 1024726395 /nfs/dbraw/zinc/72/63/95/1024726395.db2.gz TZLTYQDBSWLMGD-UHFFFAOYSA-N 0 3 330.384 3.761 20 5 EHBDHN C[C@]1(CNCc2nc3cc([N+](=O)[O-])ccc3o2)CCOC2(CCC2)C1 ZINC000895823908 1024879149 /nfs/dbraw/zinc/87/91/49/1024879149.db2.gz UWLPNLVPJGESDQ-KRWDZBQOSA-N 0 3 345.399 3.565 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H](c2ccn(C)n2)C1 ZINC000896493846 1025496063 /nfs/dbraw/zinc/49/60/63/1025496063.db2.gz WOBMZGKROULLQA-GSPCDJLXSA-N 0 3 340.427 3.611 20 5 EHBDHN CCc1noc(C)c1CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550428 1026101844 /nfs/dbraw/zinc/10/18/44/1026101844.db2.gz RQWHVYXUCHHVBT-OAHLLOKOSA-N 0 3 329.400 3.833 20 5 EHBDHN CCN(CCCN[C@@H](C)c1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000475132458 1026236474 /nfs/dbraw/zinc/23/64/74/1026236474.db2.gz XRXCLZVTDICZMW-LBPRGKRZSA-N 0 3 333.354 3.520 20 5 EHBDHN C[C@H]1CCCC[C@H]1OCCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783597565 1027591670 /nfs/dbraw/zinc/59/16/70/1027591670.db2.gz TWHRJGOLANLOIW-BLLLJJGKSA-N 0 3 326.824 3.933 20 5 EHBDHN COc1ccc(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000130738194 1027699788 /nfs/dbraw/zinc/69/97/88/1027699788.db2.gz CSHNXPHWPMATJL-UHFFFAOYSA-N 0 3 342.395 3.647 20 5 EHBDHN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)CC1CCCC1 ZINC000533398449 1027770148 /nfs/dbraw/zinc/77/01/48/1027770148.db2.gz QIVBLYKMLMNCBN-NSHDSACASA-N 0 3 339.823 3.697 20 5 EHBDHN C[C@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCCOC1 ZINC000503932545 1028236569 /nfs/dbraw/zinc/23/65/69/1028236569.db2.gz VIBZBMYCWJQVKL-JSGCOSHPSA-N 0 3 347.440 3.623 20 5 EHBDHN CCCCN1CCCC[C@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000502903859 1028831793 /nfs/dbraw/zinc/83/17/93/1028831793.db2.gz TWJLSMGOTFYMHD-INIZCTEOSA-N 0 3 333.432 3.864 20 5 EHBDHN CC[C@@H](C)[C@@H](C)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285233 1029574057 /nfs/dbraw/zinc/57/40/57/1029574057.db2.gz XUAKTXAIKNBLPT-TZMCWYRMSA-N 0 3 333.432 3.741 20 5 EHBDHN CCN(CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000441189705 1029896983 /nfs/dbraw/zinc/89/69/83/1029896983.db2.gz PRTCXMUPKCZAAI-UHFFFAOYSA-N 0 3 348.374 3.643 20 5 EHBDHN CC[C@H]1CCCC[C@@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000163239834 1030218920 /nfs/dbraw/zinc/21/89/20/1030218920.db2.gz GKSFSNBNEKGUKY-WFASDCNBSA-N 0 3 330.388 3.703 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H](c2ccccc2)C2(CO)CCCC2)cc1 ZINC000453609604 1030399575 /nfs/dbraw/zinc/39/95/75/1030399575.db2.gz GIYMBUOBPMZENW-LJQANCHMSA-N 0 3 340.423 3.978 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCC[C@H]3O)o2)c(Cl)c1 ZINC000453615138 1030405499 /nfs/dbraw/zinc/40/54/99/1030405499.db2.gz OEEISDSDWAKXML-HUUCEWRRSA-N 0 3 336.775 3.511 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1cccc(-n2ccnc2)c1 ZINC000532224216 1030489928 /nfs/dbraw/zinc/48/99/28/1030489928.db2.gz VGXRXGNTCGFVHP-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441295807 1030534475 /nfs/dbraw/zinc/53/44/75/1030534475.db2.gz UATQVSYPTUBEPB-HZPDHXFCSA-N 0 3 348.443 3.631 20 5 EHBDHN CN(C(=O)CN(CC1CCCCC1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000059409402 1033611402 /nfs/dbraw/zinc/61/14/02/1033611402.db2.gz ITHYYFMXJXPWKX-UHFFFAOYSA-N 0 3 345.443 3.602 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCC(C)(C)c1ccc(C)cn1 ZINC000598991548 1033617292 /nfs/dbraw/zinc/61/72/92/1033617292.db2.gz OKURHEDAECTQDA-UHFFFAOYSA-N 0 3 343.427 3.764 20 5 EHBDHN C[C@@H](COc1c(F)cccc1F)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000595072776 1033645903 /nfs/dbraw/zinc/64/59/03/1033645903.db2.gz QOPVEJWVYZVXLI-RYUDHWBXSA-N 0 3 336.338 3.991 20 5 EHBDHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc([N+](=O)[O-])cc2OC)C12CCC2 ZINC000595027128 1033650736 /nfs/dbraw/zinc/65/07/36/1033650736.db2.gz PZEJMXUMYVIQNR-OAUYIBNBSA-N 0 3 334.416 3.602 20 5 EHBDHN COCCC1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000597183582 1034587223 /nfs/dbraw/zinc/58/72/23/1034587223.db2.gz MEPQFIYLSFSXQZ-UHFFFAOYSA-N 0 3 332.425 3.792 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NC2CCC(O)CC2)c2ccccc2)c1 ZINC000179966327 1035094968 /nfs/dbraw/zinc/09/49/68/1035094968.db2.gz AGISXRQMLBWLBP-NKELODKYSA-N 0 3 326.396 3.577 20 5 EHBDHN CC[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000164554128 1035666433 /nfs/dbraw/zinc/66/64/33/1035666433.db2.gz CQQVUZMRQVZUCV-GDBMZVCRSA-N 0 3 349.431 3.645 20 5 EHBDHN COC1(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000180199241 1036172161 /nfs/dbraw/zinc/17/21/61/1036172161.db2.gz VVFMXEZUOULVHW-GOSISDBHSA-N 0 3 326.396 3.843 20 5 EHBDHN CN1CC[C@@H](NCc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(Cl)cc1 ZINC000589284648 1036340028 /nfs/dbraw/zinc/34/00/28/1036340028.db2.gz NZQLJZIQCOKGDL-AEFFLSMTSA-N 0 3 345.830 3.783 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@H]1C1CCCCC1 ZINC000165264835 1036352262 /nfs/dbraw/zinc/35/22/62/1036352262.db2.gz YMWYAQLXUIJUPY-INIZCTEOSA-N 0 3 345.443 3.886 20 5 EHBDHN Cc1cc(NCCSCC(F)(F)F)c2cc([N+](=O)[O-])ccc2n1 ZINC000572675882 1036453820 /nfs/dbraw/zinc/45/38/20/1036453820.db2.gz BYQOWZJTDCOHOI-UHFFFAOYSA-N 0 3 345.346 3.581 20 5 EHBDHN C[C@@]1(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCO1 ZINC000180740691 1037134095 /nfs/dbraw/zinc/13/40/95/1037134095.db2.gz CCZXNUSHEVDOAS-OALUTQOASA-N 0 3 326.396 3.843 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1C[C@@H](OCC)C12CCCC2 ZINC000462756710 1037372719 /nfs/dbraw/zinc/37/27/19/1037372719.db2.gz OXUOOZRISIISOS-ZWKOTPCHSA-N 0 3 348.443 3.821 20 5 EHBDHN COc1cccc(COCCN[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000540139592 1037612799 /nfs/dbraw/zinc/61/27/99/1037612799.db2.gz CEAATRKWEDJQJO-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCC2(CCO)CCC2)c2ccccc2)c1 ZINC000494030009 1037786732 /nfs/dbraw/zinc/78/67/32/1037786732.db2.gz SKRICZFRBVMTJG-LJQANCHMSA-N 0 3 340.423 3.827 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@@]3(C)CCCO3)o2)c([N+](=O)[O-])c1 ZINC000152936846 1037863873 /nfs/dbraw/zinc/86/38/73/1037863873.db2.gz OMJXIYYRNOIAGB-GOSISDBHSA-N 0 3 346.383 3.522 20 5 EHBDHN Cc1cc(C)cc([C@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000540410484 1037908054 /nfs/dbraw/zinc/90/80/54/1037908054.db2.gz ZNLCJWYWDFNHES-LSDHHAIUSA-N 0 3 341.411 3.889 20 5 EHBDHN CCOc1ccc(CN(C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000058563587 1038123995 /nfs/dbraw/zinc/12/39/95/1038123995.db2.gz DSXAIBRWYADHOH-UHFFFAOYSA-N 0 3 330.384 3.504 20 5 EHBDHN COc1ccc(CN2CCC[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000552274209 1039144054 /nfs/dbraw/zinc/14/40/54/1039144054.db2.gz HBRJOOGAUSKDQN-KRWDZBQOSA-N 0 3 326.396 3.983 20 5 EHBDHN COC(=O)C(C)(C)CCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000512547789 1040076585 /nfs/dbraw/zinc/07/65/85/1040076585.db2.gz SHBFJTDKBMZIOX-UHFFFAOYSA-N 0 3 346.383 3.534 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](Nc3ccccc3)C2)cc1 ZINC000490029781 1040298990 /nfs/dbraw/zinc/29/89/90/1040298990.db2.gz YABIYBTYDKJJQW-QGZVFWFLSA-N 0 3 341.411 3.550 20 5 EHBDHN O=[N+]([O-])c1ccc(CCNCc2c(F)cccc2N2CCCC2)cc1 ZINC000105448316 1040317669 /nfs/dbraw/zinc/31/76/69/1040317669.db2.gz WSTLXQPPTNXDHY-UHFFFAOYSA-N 0 3 343.402 3.666 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC(CO)(c2ccccc2)CC1 ZINC000433065627 1040618728 /nfs/dbraw/zinc/61/87/28/1040618728.db2.gz FSPFFQDGCQLSAL-MRXNPFEDSA-N 0 3 340.423 3.682 20 5 EHBDHN CC1(C)CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCC[C@@H]21 ZINC000555721021 1041043765 /nfs/dbraw/zinc/04/37/65/1041043765.db2.gz FJQLBDLEXLWSPX-GJZGRUSLSA-N 0 3 342.399 3.655 20 5 EHBDHN CC1(C)CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCC[C@@H]21 ZINC000555721466 1041059641 /nfs/dbraw/zinc/05/96/41/1041059641.db2.gz REJPPJATMIELLI-LSDHHAIUSA-N 0 3 342.399 3.655 20 5 EHBDHN C[C@@H]1CCC[C@H](NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000249370355 1041130422 /nfs/dbraw/zinc/13/04/22/1041130422.db2.gz AOTOWFIEKIJMBT-XUJVJEKNSA-N 0 3 330.388 3.559 20 5 EHBDHN CC[C@H]1CCCCCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000150744388 1041256400 /nfs/dbraw/zinc/25/64/00/1041256400.db2.gz CGVCBAUCRFLLRF-AWEZNQCLSA-N 0 3 330.388 3.799 20 5 EHBDHN C[C@@H](O)CC(C)(C)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290779982 1041341462 /nfs/dbraw/zinc/34/14/62/1041341462.db2.gz CEWPQDMTNAYBNT-SECBINFHSA-N 0 3 335.231 3.788 20 5 EHBDHN CC(C)[C@H](CO)N(Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000112659802 1042416481 /nfs/dbraw/zinc/41/64/81/1042416481.db2.gz PGAAIYTWYOHQAP-IBGZPJMESA-N 0 3 328.412 3.614 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCCC[C@H](C)C1 ZINC000248557224 1042527003 /nfs/dbraw/zinc/52/70/03/1042527003.db2.gz LJGJAQVSCLQIHB-QWHCGFSZSA-N 0 3 330.388 3.828 20 5 EHBDHN C[C@@H](NC[C@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000122135644 1042864382 /nfs/dbraw/zinc/86/43/82/1042864382.db2.gz CNMRHKJZMPPCFJ-RHSMWYFYSA-N 0 3 329.400 3.676 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)c(F)c1 ZINC000326792085 1043461307 /nfs/dbraw/zinc/46/13/07/1043461307.db2.gz XTQLEUGSPOEJPM-CGTJXYLNSA-N 0 3 336.407 3.640 20 5 EHBDHN CCN(CCc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000051924188 1044600880 /nfs/dbraw/zinc/60/08/80/1044600880.db2.gz GEBBAWQUVJRFRP-UHFFFAOYSA-N 0 3 342.395 3.526 20 5 EHBDHN C[C@H](CN(C)Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000083170489 1127221468 /nfs/dbraw/zinc/22/14/68/1127221468.db2.gz CAKPTOIUDWLGCA-CYBMUJFWSA-N 0 3 325.368 3.972 20 5 EHBDHN CCN(CC)[C@H](CNc1cc(OC)ccc1[N+](=O)[O-])c1ccco1 ZINC000338654305 1127998471 /nfs/dbraw/zinc/99/84/71/1127998471.db2.gz IPDWVTCYCHVPRM-MRXNPFEDSA-N 0 3 333.388 3.691 20 5 EHBDHN Cc1cnc(NC[C@@H](c2ccccc2)N2CCCC2)c([N+](=O)[O-])c1 ZINC000301458494 1128367479 /nfs/dbraw/zinc/36/74/79/1128367479.db2.gz SWDNJQQDXFLCME-KRWDZBQOSA-N 0 3 326.400 3.547 20 5 EHBDHN CC(C)(C)[C@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000273063155 1128438718 /nfs/dbraw/zinc/43/87/18/1128438718.db2.gz MVAURWNQFASBPI-SWLSCSKDSA-N 0 3 326.824 3.932 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cs1 ZINC000273377237 1128516596 /nfs/dbraw/zinc/51/65/96/1128516596.db2.gz GBNQZVRYAARVNC-LSDHHAIUSA-N 0 3 336.388 3.805 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H](c1ccccc1)C(C)(C)CO ZINC000554867368 1128738288 /nfs/dbraw/zinc/73/82/88/1128738288.db2.gz OCHLLROXDHDDEN-GOSISDBHSA-N 0 3 328.412 3.753 20 5 EHBDHN CN1CC[C@@H](NCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000554957919 1128947930 /nfs/dbraw/zinc/94/79/30/1128947930.db2.gz GEXGWCMCZKGRGG-AEFFLSMTSA-N 0 3 345.830 3.783 20 5 EHBDHN COc1nc(C)cc(C)c1CNC/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000615720661 1123863634 /nfs/dbraw/zinc/86/36/34/1123863634.db2.gz HTPPVWNAEIPWBT-MDWZMJQESA-N 0 3 341.411 3.808 20 5 EHBDHN C[C@@H]1CCC[C@@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000078539663 1129160297 /nfs/dbraw/zinc/16/02/97/1129160297.db2.gz DNJUPBFKECSJOH-IUODEOHRSA-N 0 3 330.388 3.655 20 5 EHBDHN CCOc1cc(CN2CCC[C@@H](C[C@@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216827 1124100369 /nfs/dbraw/zinc/10/03/69/1124100369.db2.gz ZQJWZVYOHHMWIH-RDJZCZTQSA-N 0 3 348.443 3.632 20 5 EHBDHN C[C@@H](O)CN(Cc1cc([N+](=O)[O-])ccc1Cl)C1CCCCC1 ZINC000735491939 1131352809 /nfs/dbraw/zinc/35/28/09/1131352809.db2.gz LZLIJMWUGCMYAB-GFCCVEGCSA-N 0 3 326.824 3.764 20 5 EHBDHN Cc1cccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000115602937 1129278217 /nfs/dbraw/zinc/27/82/17/1129278217.db2.gz OOZBPHORPQZRLD-CABCVRRESA-N 0 3 341.411 3.889 20 5 EHBDHN CC1CCC(N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000302600449 1129783078 /nfs/dbraw/zinc/78/30/78/1129783078.db2.gz YTXNUHFYZPJAEE-UHFFFAOYSA-N 0 3 339.823 3.697 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@@H]3C3CCCC3)n2)cc1 ZINC000055927279 1129790612 /nfs/dbraw/zinc/79/06/12/1129790612.db2.gz ZTKOZVOKWGNXQT-MRXNPFEDSA-N 0 3 342.399 3.799 20 5 EHBDHN O=[N+]([O-])c1ccc2nc(NCCN3CCc4ccccc4C3)ccc2c1 ZINC000302958405 1129802131 /nfs/dbraw/zinc/80/21/31/1129802131.db2.gz PRWJUZOVGCNQJH-UHFFFAOYSA-N 0 3 348.406 3.613 20 5 EHBDHN CC(C)N(CCOC1CCSCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000929337181 1129991998 /nfs/dbraw/zinc/99/19/98/1129991998.db2.gz CAQXDJHWRITOPR-UHFFFAOYSA-N 0 3 338.473 3.717 20 5 EHBDHN C[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000700734074 1130066739 /nfs/dbraw/zinc/06/67/39/1130066739.db2.gz ITOVCXDBKCVAQP-DVOMOZLQSA-N 0 3 349.431 3.643 20 5 EHBDHN CCC[C@@H]1[C@@H](C)CCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381103 1131914949 /nfs/dbraw/zinc/91/49/49/1131914949.db2.gz VZVFOFQIPWOCED-WMLDXEAASA-N 0 3 343.431 3.711 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N(C)Cc2cccc(O)c2)c1F ZINC001173180346 1131992511 /nfs/dbraw/zinc/99/25/11/1131992511.db2.gz JXYDBENJVRAVTD-GFCCVEGCSA-N 0 3 348.374 3.511 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(C)C[C@H]1c1ccccc1 ZINC001173223488 1132005596 /nfs/dbraw/zinc/00/55/96/1132005596.db2.gz ANFJYUGABFRLNS-UZLBHIALSA-N 0 3 339.439 3.515 20 5 EHBDHN CC(C)CC[C@@H]1CCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767766833 1133050543 /nfs/dbraw/zinc/05/05/43/1133050543.db2.gz XWISEZADOXSUPF-INIZCTEOSA-N 0 3 343.431 3.711 20 5 EHBDHN Cc1ccc(CNCc2ccc(-c3cnn(C)c3)s2)cc1[N+](=O)[O-] ZINC001179386876 1133249444 /nfs/dbraw/zinc/24/94/44/1133249444.db2.gz VVOGSNJJXMMBNM-UHFFFAOYSA-N 0 3 342.424 3.655 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(C[C@H](O)c2ccc(Cl)cc2)C2CC2)c1 ZINC000772198406 1133659256 /nfs/dbraw/zinc/65/92/56/1133659256.db2.gz CXRWSTPDSCPAIL-SFHVURJKSA-N 0 3 346.814 3.946 20 5 EHBDHN C[C@@H](CNCc1ccc([N+](=O)[O-])cc1F)c1ccccc1[N+](=O)[O-] ZINC001184046085 1133891135 /nfs/dbraw/zinc/89/11/35/1133891135.db2.gz TZPXPMJRFIUNDS-NSHDSACASA-N 0 3 333.319 3.535 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN[C@@H]2COCc3cccc(Cl)c32)cc1 ZINC000788590161 1134148734 /nfs/dbraw/zinc/14/87/34/1134148734.db2.gz UTAFRRSNYUFLSB-MRXNPFEDSA-N 0 3 332.787 3.652 20 5 EHBDHN Cc1cc(N[C@@H]2CCN(Cc3cccc(C)c3)C2)c([N+](=O)[O-])s1 ZINC001187190978 1134307826 /nfs/dbraw/zinc/30/78/26/1134307826.db2.gz WWCKNDGWGXYITH-OAHLLOKOSA-N 0 3 331.441 3.960 20 5 EHBDHN CCOC(=O)C[C@](C)(NCc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000775376253 1134686371 /nfs/dbraw/zinc/68/63/71/1134686371.db2.gz ZMMKTBVURIZBDA-INIZCTEOSA-N 0 3 342.823 3.706 20 5 EHBDHN COc1ccc(C[C@H](C)N2CC[C@@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329029 1134748932 /nfs/dbraw/zinc/74/89/32/1134748932.db2.gz NGJAINQNLUDCDD-XHDPSFHLSA-N 0 3 346.349 3.604 20 5 EHBDHN C[C@]12CCN(CCc3ccc([N+](=O)[O-])cc3)C[C@H]1C2(Cl)Cl ZINC000792916272 1134824442 /nfs/dbraw/zinc/82/44/42/1134824442.db2.gz XDQOEUWFYRKOPG-KGLIPLIRSA-N 0 3 329.227 3.653 20 5 EHBDHN CC[C@@H](C)N[C@@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccco1 ZINC000804784283 1135199683 /nfs/dbraw/zinc/19/96/83/1135199683.db2.gz ZMCVOHGOQVPRDR-RISCZKNCSA-N 0 3 348.359 3.637 20 5 EHBDHN C[C@H](O)C[C@@H]1CCCCCN1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700319 1135869044 /nfs/dbraw/zinc/86/90/44/1135869044.db2.gz CPTYFTGQFHIUPE-JSGCOSHPSA-N 0 3 326.824 3.764 20 5 EHBDHN C[C@@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CN1C1CC1 ZINC000811484367 1136091950 /nfs/dbraw/zinc/09/19/50/1136091950.db2.gz VJUBXPBZFORUOO-SKDRFNHKSA-N 0 3 344.242 3.616 20 5 EHBDHN CC1CCN(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000811473736 1136095817 /nfs/dbraw/zinc/09/58/17/1136095817.db2.gz KHOPOLQIYYMAOA-UHFFFAOYSA-N 0 3 346.258 3.723 20 5 EHBDHN CCN(Cc1ccc(Cl)s1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776273946 1136128522 /nfs/dbraw/zinc/12/85/22/1136128522.db2.gz FNCPWWMGZXSYGZ-AWEZNQCLSA-N 0 3 340.832 3.865 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2COC3(CCC3)C2)o1 ZINC000850367456 1136241807 /nfs/dbraw/zinc/24/18/07/1136241807.db2.gz JUCGPFOXTPKUGG-CYBMUJFWSA-N 0 3 328.368 3.656 20 5 EHBDHN CC(COC(=O)c1ccc(-c2ccc(Cl)cc2)cc1F)[N+](=O)[O-] ZINC000813102915 1136288152 /nfs/dbraw/zinc/28/81/52/1136288152.db2.gz LOJIDKQIDNTART-JTQLQIEISA-N 0 3 337.734 3.968 20 5 EHBDHN CC(COC(=O)C[C@@H](Cc1ccccc1)c1ccccc1)[N+](=O)[O-] ZINC000813106930 1136294068 /nfs/dbraw/zinc/29/40/68/1136294068.db2.gz ICWWVSUIAKLHDR-MAUKXSAKSA-N 0 3 327.380 3.611 20 5 EHBDHN CC(COC(=O)CCCc1cc(Cl)sc1Cl)[N+](=O)[O-] ZINC000813111151 1136294644 /nfs/dbraw/zinc/29/46/44/1136294644.db2.gz PAMPIIBUNSLDHQ-SSDOTTSWSA-N 0 3 326.201 3.586 20 5 EHBDHN CC(COC(=O)c1ccccc1OCc1ccccc1Cl)[N+](=O)[O-] ZINC000813111649 1136294717 /nfs/dbraw/zinc/29/47/17/1136294717.db2.gz JUUNJQOEHMXBTQ-LBPRGKRZSA-N 0 3 349.770 3.741 20 5 EHBDHN CCOc1cc(-c2ccccc2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813111220 1136294743 /nfs/dbraw/zinc/29/47/43/1136294743.db2.gz DBICJZMNRLHYDS-LLVKDONJSA-N 0 3 335.381 3.636 20 5 EHBDHN CC(COC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)[N+](=O)[O-] ZINC000813112198 1136294888 /nfs/dbraw/zinc/29/48/88/1136294888.db2.gz NPPCEMCANUDJJE-GFCCVEGCSA-N 0 3 349.770 3.741 20 5 EHBDHN CC(C)[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)C1(CO)CCC1 ZINC000814169703 1136414973 /nfs/dbraw/zinc/41/49/73/1136414973.db2.gz MEGJEUVESOMRNS-OAHLLOKOSA-N 0 3 326.824 3.525 20 5 EHBDHN CC(C)CN(Cc1ccccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776577953 1136443647 /nfs/dbraw/zinc/44/36/47/1136443647.db2.gz BMDQIEUFZVFHDT-IBGZPJMESA-N 0 3 346.402 3.926 20 5 EHBDHN CCc1nc(C)c([C@H](C)N(C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585598 1136448575 /nfs/dbraw/zinc/44/85/75/1136448575.db2.gz XLQDYMPCSRELSD-SWLSCSKDSA-N 0 3 349.456 3.649 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CC[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000814667694 1136492308 /nfs/dbraw/zinc/49/23/08/1136492308.db2.gz VDVXLLXOYROSNY-QAPCUYQASA-N 0 3 346.814 3.771 20 5 EHBDHN CC(C)(CO)[C@H](NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000815247651 1136573039 /nfs/dbraw/zinc/57/30/39/1136573039.db2.gz FASYSCSIQFTMDR-CQSZACIVSA-N 0 3 347.242 3.788 20 5 EHBDHN C[C@H](NC[C@@H]1COC2(CCC(C)CC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776740096 1136620205 /nfs/dbraw/zinc/62/02/05/1136620205.db2.gz IEXHTURWYJIJHP-VLNFIEOWSA-N 0 3 334.416 3.567 20 5 EHBDHN Cc1ccc(O[C@H]2CCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858041001 1136934153 /nfs/dbraw/zinc/93/41/53/1136934153.db2.gz QGEJQCXSUFLQPN-WBVHZDCISA-N 0 3 341.411 3.821 20 5 EHBDHN CC(=O)c1ccc([C@H](C)Nc2cc3c(cc2[N+](=O)[O-])CNC3)cc1 ZINC001171056224 1137138345 /nfs/dbraw/zinc/13/83/45/1137138345.db2.gz LOBQRORQAIRBCL-NSHDSACASA-N 0 3 325.368 3.574 20 5 EHBDHN Cc1ccc(CNCc2ccc(OCC(F)F)cc2)cc1[N+](=O)[O-] ZINC000865787078 1137311994 /nfs/dbraw/zinc/31/19/94/1137311994.db2.gz GPQWDAZESYVHFM-UHFFFAOYSA-N 0 3 336.338 3.837 20 5 EHBDHN CC([C@H](OC(=O)c1ccnc(C2CC2)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845874747 1137316073 /nfs/dbraw/zinc/31/60/73/1137316073.db2.gz IMMFXFQWSDUGPW-DIFFPNOSSA-N 0 3 344.342 3.661 20 5 EHBDHN CC([C@H](OC(=O)C[C@@H](C)c1ccncc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881164 1137316858 /nfs/dbraw/zinc/31/68/58/1137316858.db2.gz YPPPTEJNMJUCAX-VFVRVIDISA-N 0 3 346.358 3.664 20 5 EHBDHN CC([C@H](OC(=O)[C@H]1CCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845881958 1137317209 /nfs/dbraw/zinc/31/72/09/1137317209.db2.gz MZNJYYGGHGYVHR-NRUUGDAUSA-N 0 3 331.290 3.511 20 5 EHBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)[C@@](C)(O)c1ccccc1 ZINC000846035344 1137328330 /nfs/dbraw/zinc/32/83/30/1137328330.db2.gz GSQXXGWVKYLMJJ-YVEFUNNKSA-N 0 3 334.803 3.634 20 5 EHBDHN C[C@@H](NCc1ccc(C2(C)OCCO2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000866421158 1137353411 /nfs/dbraw/zinc/35/34/11/1137353411.db2.gz MQEKZGPAYWBGGE-CQSZACIVSA-N 0 3 342.395 3.665 20 5 EHBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCc1cccc(F)n1 ZINC000773083991 1137463959 /nfs/dbraw/zinc/46/39/59/1137463959.db2.gz AFYYZBHGYAPUHY-GFCCVEGCSA-N 0 3 335.404 3.789 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CC[C@]2(C1)OCc1ccccc12 ZINC000877399190 1137675302 /nfs/dbraw/zinc/67/53/02/1137675302.db2.gz LSGHKIAYAUQZBO-HXUWFJFHSA-N 0 3 338.407 3.843 20 5 EHBDHN C[C@@]1(CCNCc2nc3cc([N+](=O)[O-])ccc3o2)CC1(Cl)Cl ZINC000877568692 1137681337 /nfs/dbraw/zinc/68/13/37/1137681337.db2.gz APGITBSHTGZRPK-CYBMUJFWSA-N 0 3 344.198 3.800 20 5 EHBDHN C[C@]1(CCNCc2nc3cc([N+](=O)[O-])ccc3o2)CC1(Cl)Cl ZINC000877568694 1137681497 /nfs/dbraw/zinc/68/14/97/1137681497.db2.gz APGITBSHTGZRPK-ZDUSSCGKSA-N 0 3 344.198 3.800 20 5 EHBDHN CC(C)(O)C1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000877754041 1137687871 /nfs/dbraw/zinc/68/78/71/1137687871.db2.gz SGMAPHJIFYPVAF-UHFFFAOYSA-N 0 3 344.411 3.838 20 5 EHBDHN CCCN(CCC)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877961439 1137697296 /nfs/dbraw/zinc/69/72/96/1137697296.db2.gz PFOUBCHHTSYWHO-UHFFFAOYSA-N 0 3 338.795 3.920 20 5 EHBDHN CC[C@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCCOC1 ZINC000880469366 1137779563 /nfs/dbraw/zinc/77/95/63/1137779563.db2.gz KEDDAQTURDFCBJ-YOEHRIQHSA-N 0 3 345.399 3.545 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CC[C@@H](COCc2ccccc2)C1 ZINC000075866241 1138129164 /nfs/dbraw/zinc/12/91/64/1138129164.db2.gz QUJKZRWZOPFAAZ-QGZVFWFLSA-N 0 3 326.396 3.634 20 5 EHBDHN CC[C@H](NC[C@H](O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000124765528 1138294322 /nfs/dbraw/zinc/29/43/22/1138294322.db2.gz MJVFNPVQPBLENV-IRXDYDNUSA-N 0 3 336.338 3.647 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@H](O)c2ccccc2C)cc1[N+](=O)[O-] ZINC000153750007 1139151076 /nfs/dbraw/zinc/15/10/76/1139151076.db2.gz GQFIYOVMVJDOFD-KSSFIOAISA-N 0 3 344.411 3.686 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000177304706 1139611568 /nfs/dbraw/zinc/61/15/68/1139611568.db2.gz AEVXOMCQNWVKQX-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN CC(=O)Nc1ccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000182004552 1139945070 /nfs/dbraw/zinc/94/50/70/1139945070.db2.gz LVMMPFBQSBWWDZ-STQMWFEESA-N 0 3 327.384 3.965 20 5 EHBDHN C[C@@H]1C[C@@H](N(C)c2ncc([N+](=O)[O-])s2)CCN1Cc1ccccc1 ZINC000192460158 1140534346 /nfs/dbraw/zinc/53/43/46/1140534346.db2.gz BFEMBQSIUVIRLB-HIFRSBDPSA-N 0 3 346.456 3.541 20 5 EHBDHN CC(C)Oc1cccc([C@@H](O)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266813210 1140725835 /nfs/dbraw/zinc/72/58/35/1140725835.db2.gz WTCNAEHHAMCVKG-LIRRHRJNSA-N 0 3 344.411 3.766 20 5 EHBDHN C[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000339503482 1014600798 /nfs/dbraw/zinc/60/07/98/1014600798.db2.gz BRMDSBXTLIXBTL-JNLAVLDNSA-N 0 3 344.436 3.696 20 5 EHBDHN C[C@H]1CCCC[C@@]1(C)NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000459609981 1032326858 /nfs/dbraw/zinc/32/68/58/1032326858.db2.gz KAEMWYLJRDKTIT-YVEFUNNKSA-N 0 3 330.388 3.703 20 5 EHBDHN Cn1cc([C@@H](NC/C=C/c2ccccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000538430308 1032359532 /nfs/dbraw/zinc/35/95/32/1032359532.db2.gz VALJVPTZZLATLY-UGAXZCSASA-N 0 3 328.416 3.719 20 5 EHBDHN CN(C)[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1ccsc1 ZINC000026719935 1032395735 /nfs/dbraw/zinc/39/57/35/1032395735.db2.gz GDYWCKPMMAWQAH-INIZCTEOSA-N 0 3 342.424 3.919 20 5 EHBDHN Cc1cc(C)cc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000537115607 1032526799 /nfs/dbraw/zinc/52/67/99/1032526799.db2.gz JJLYBMYQDDQGJM-CABCVRRESA-N 0 3 341.411 3.889 20 5 EHBDHN Cc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000593013616 1032640276 /nfs/dbraw/zinc/64/02/76/1032640276.db2.gz KDSGNDBVCPNCHH-VXGBXAGGSA-N 0 3 346.305 3.589 20 5 EHBDHN Cc1nc(CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cs1 ZINC000602510717 1032947793 /nfs/dbraw/zinc/94/77/93/1032947793.db2.gz MGYYWJIHVAQVCS-UHFFFAOYSA-N 0 3 345.346 3.711 20 5 EHBDHN O=[N+]([O-])c1ccc(C(F)(F)F)c(CNC2([C@@H]3CCCCO3)CC2)c1 ZINC000933375682 1021561459 /nfs/dbraw/zinc/56/14/59/1021561459.db2.gz MFSLYEWPJOWNCD-AWEZNQCLSA-N 0 3 344.333 3.805 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c(Cl)c1 ZINC000519673839 1021601945 /nfs/dbraw/zinc/60/19/45/1021601945.db2.gz WWWYECZGVHFEKA-BMFZPTHFSA-N 0 3 336.819 3.686 20 5 EHBDHN COc1cc(CN2CCC[C@H]2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000140487316 1021799386 /nfs/dbraw/zinc/79/93/86/1021799386.db2.gz DXPFMKTYUFRFKS-LBPRGKRZSA-N 0 3 344.358 3.825 20 5 EHBDHN CCCN(CCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000506772757 1021973563 /nfs/dbraw/zinc/97/35/63/1021973563.db2.gz PMTBVMIWGJOXMR-UHFFFAOYSA-N 0 3 348.374 3.731 20 5 EHBDHN CCC[C@@]1(NCc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCOC1 ZINC000550095653 1022427660 /nfs/dbraw/zinc/42/76/60/1022427660.db2.gz ACDVMZOGDONQIX-CQSZACIVSA-N 0 3 332.322 3.662 20 5 EHBDHN CN(CCc1ccccn1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000120809030 1022644442 /nfs/dbraw/zinc/64/44/42/1022644442.db2.gz UDOPKGZCQWKBBI-UHFFFAOYSA-N 0 3 337.379 3.924 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@@H]2c2ccccn2)cc1 ZINC000610582240 1022795016 /nfs/dbraw/zinc/79/50/16/1022795016.db2.gz PQYHFEPPXLQIFY-GOSISDBHSA-N 0 3 327.384 3.596 20 5 EHBDHN Cc1ncc([N+](=O)[O-])n1CCN(C)Cc1ccc(C(C)(C)C)cc1 ZINC000610782541 1023506904 /nfs/dbraw/zinc/50/69/04/1023506904.db2.gz QOKZOISHPRZXTC-UHFFFAOYSA-N 0 3 330.432 3.529 20 5 EHBDHN CCC[C@H](C)NC(=O)[C@H]1CCCN([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000441529663 1024039369 /nfs/dbraw/zinc/03/93/69/1024039369.db2.gz AHCIWVCVONQCCL-XHSDSOJGSA-N 0 3 347.459 3.673 20 5 EHBDHN CO[C@H](c1ccccc1F)[C@H](C)NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000538488091 1024398518 /nfs/dbraw/zinc/39/85/18/1024398518.db2.gz OGJSXJXIYMCCTE-UGSOOPFHSA-N 0 3 332.375 3.908 20 5 EHBDHN O=[N+]([O-])c1cnccc1S[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000425281078 1024623673 /nfs/dbraw/zinc/62/36/73/1024623673.db2.gz LGDSEZZBYMTZSW-OAHLLOKOSA-N 0 3 329.425 3.747 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)c(F)c1 ZINC000326792087 1024654441 /nfs/dbraw/zinc/65/44/41/1024654441.db2.gz XTQLEUGSPOEJPM-KBAYOESNSA-N 0 3 336.407 3.640 20 5 EHBDHN CC(C)CCOCCN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000441813133 1024733847 /nfs/dbraw/zinc/73/38/47/1024733847.db2.gz LMRJOZMMJVULIQ-UHFFFAOYSA-N 0 3 336.432 3.501 20 5 EHBDHN Cc1ccc(C(=O)CCN(C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511058290 1025090314 /nfs/dbraw/zinc/09/03/14/1025090314.db2.gz FKDOBTWSMPWHGH-UHFFFAOYSA-N 0 3 326.396 3.651 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCCOc1ccccc1C ZINC000520959622 1025133618 /nfs/dbraw/zinc/13/36/18/1025133618.db2.gz XKCIHXNUDJXSCC-UHFFFAOYSA-N 0 3 344.411 3.861 20 5 EHBDHN COC(=O)[C@@H](CCN[C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000425461755 1025367415 /nfs/dbraw/zinc/36/74/15/1025367415.db2.gz SJOQELMWSYLMHX-PBHICJAKSA-N 0 3 342.395 3.592 20 5 EHBDHN COc1cccc([C@@H]2CCCN2CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000521479313 1025403390 /nfs/dbraw/zinc/40/33/90/1025403390.db2.gz QCWVQGOVDWEYIO-IBGZPJMESA-N 0 3 342.395 3.819 20 5 EHBDHN CC[C@H](C)[C@@H](C)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240797 1025489356 /nfs/dbraw/zinc/48/93/56/1025489356.db2.gz RFGPMOAFHOPEDG-GXTWGEPZSA-N 0 3 333.432 3.741 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNCC[C@@H]3CCC(F)(F)C3)nc2c1 ZINC000898013714 1033289606 /nfs/dbraw/zinc/28/96/06/1033289606.db2.gz GQLFJHIMHGRHNK-JTQLQIEISA-N 0 3 325.315 3.651 20 5 EHBDHN C[C@H]1CCC[C@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478234 1025658864 /nfs/dbraw/zinc/65/88/64/1025658864.db2.gz HEEKVOKEPUDIPW-JSGCOSHPSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H](c1ccc(Cl)c(Cl)c1)N(C)CCn1ccc([N+](=O)[O-])n1 ZINC000478417554 1026097013 /nfs/dbraw/zinc/09/70/13/1026097013.db2.gz NTJAGIRNARRXBM-SNVBAGLBSA-N 0 3 343.214 3.791 20 5 EHBDHN Cc1ccn(-c2ccccc2CN[C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000127638309 1026201896 /nfs/dbraw/zinc/20/18/96/1026201896.db2.gz YNJAHFARLFFVIC-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[C@H](C)C1 ZINC000452066903 1026461424 /nfs/dbraw/zinc/46/14/24/1026461424.db2.gz LTMLYUNZGAWWTE-YDHLFZDLSA-N 0 3 344.415 3.949 20 5 EHBDHN CC[C@@H](c1ccc(F)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496898 1028088282 /nfs/dbraw/zinc/08/82/82/1028088282.db2.gz TUFRHUSGOXDCPR-WBVHZDCISA-N 0 3 344.390 3.766 20 5 EHBDHN C[C@@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCCOC1 ZINC000503932546 1028237530 /nfs/dbraw/zinc/23/75/30/1028237530.db2.gz VIBZBMYCWJQVKL-OCCSQVGLSA-N 0 3 347.440 3.623 20 5 EHBDHN Cc1cnn([C@@H]2CCCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000245514986 1030110381 /nfs/dbraw/zinc/11/03/81/1030110381.db2.gz CXSDBPBANURGEM-DOTOQJQBSA-N 0 3 328.416 3.806 20 5 EHBDHN C[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)c1cc(F)c(F)c(F)c1 ZINC000537975695 1032053142 /nfs/dbraw/zinc/05/31/42/1032053142.db2.gz YPVSBIHWODHNHC-SNVBAGLBSA-N 0 3 340.301 3.742 20 5 EHBDHN CC(C)[C@H]1CCCC[C@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000460350127 1033530086 /nfs/dbraw/zinc/53/00/86/1033530086.db2.gz UWKZVLKNBSREBN-HZPDHXFCSA-N 0 3 344.415 3.949 20 5 EHBDHN C[C@@H](NCc1ccc(O[C@H]2CCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000594923937 1033546550 /nfs/dbraw/zinc/54/65/50/1033546550.db2.gz HADRBSBWYULAQS-KUHUBIRLSA-N 0 3 342.395 3.613 20 5 EHBDHN CC1(C)OC[C@@H]2C[C@@]21NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000598987836 1033613394 /nfs/dbraw/zinc/61/33/94/1033613394.db2.gz MFZPPOJMDURAGN-KPZWWZAWSA-N 0 3 328.368 3.512 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC(C)(C)C1(O)CCCC1 ZINC000595051808 1033667181 /nfs/dbraw/zinc/66/71/81/1033667181.db2.gz OGYGBWMJQSRXMX-ZDUSSCGKSA-N 0 3 336.432 3.585 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@H]3CCC=CO3)o2)c([N+](=O)[O-])c1 ZINC000780569755 1034135627 /nfs/dbraw/zinc/13/56/27/1034135627.db2.gz IQMCQQBATOEFGP-CQSZACIVSA-N 0 3 344.367 3.646 20 5 EHBDHN C[C@@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC000597225651 1034626078 /nfs/dbraw/zinc/62/60/78/1034626078.db2.gz RYHFNJUPGURRBV-KGLIPLIRSA-N 0 3 330.384 3.854 20 5 EHBDHN CO[C@@](C)([C@@H](C)NCc1cc([N+](=O)[O-])ccc1OC(C)C)C1CC1 ZINC000411948119 1035078855 /nfs/dbraw/zinc/07/88/55/1035078855.db2.gz MWOMOEYRNTZWPY-ACJLOTCBSA-N 0 3 336.432 3.675 20 5 EHBDHN Cn1cc(CN2CC(C)(C)[C@H]2C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000580655303 1035446789 /nfs/dbraw/zinc/44/67/89/1035446789.db2.gz FFNWWEVGUCISAO-GOSISDBHSA-N 0 3 340.427 3.616 20 5 EHBDHN CC(C)[C@H]1CCCC[C@@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000460361949 1036023131 /nfs/dbraw/zinc/02/31/31/1036023131.db2.gz JCMTYGUMJAHMCV-CVEARBPZSA-N 0 3 344.415 3.949 20 5 EHBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1=CCCOC1 ZINC000597206839 1036859688 /nfs/dbraw/zinc/85/96/88/1036859688.db2.gz UHXIFZNMGBGWJF-UHFFFAOYSA-N 0 3 328.368 3.633 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CCN([C@H](C)c3ccccc3)C2)n1 ZINC000541935858 1036861497 /nfs/dbraw/zinc/86/14/97/1036861497.db2.gz NAETWWQEKLWUHA-WBVHZDCISA-N 0 3 340.427 3.854 20 5 EHBDHN COc1cc(NC[C@H](c2cccs2)N(C)C)c([N+](=O)[O-])cc1C ZINC000590568264 1036951340 /nfs/dbraw/zinc/95/13/40/1036951340.db2.gz AULRBXOTLANFRE-CQSZACIVSA-N 0 3 335.429 3.688 20 5 EHBDHN O=[N+]([O-])c1ccn(CCN2CCCCC[C@H]2/C=C\c2cccs2)n1 ZINC000542131641 1037108584 /nfs/dbraw/zinc/10/85/84/1037108584.db2.gz NKZDUSHJMZKCTR-LZNQSLFOSA-N 0 3 346.456 3.811 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H](C2CCC2)C1 ZINC000591061788 1037223658 /nfs/dbraw/zinc/22/36/58/1037223658.db2.gz IJRZIFUAFMCBLT-IUODEOHRSA-N 0 3 342.399 3.828 20 5 EHBDHN CC[C@@H](O)CN(Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539850255 1037281134 /nfs/dbraw/zinc/28/11/34/1037281134.db2.gz LBHMWFDPMLXVSP-GOSISDBHSA-N 0 3 328.412 3.676 20 5 EHBDHN CC1(C)C[C@H](NCc2ccc(CO)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000592392993 1037933756 /nfs/dbraw/zinc/93/37/56/1037933756.db2.gz NVUALNBZLNFSMQ-SFHVURJKSA-N 0 3 326.396 3.599 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN(Cc2ccc(F)cc2)C2CC2)c1 ZINC000058562842 1038124195 /nfs/dbraw/zinc/12/41/95/1038124195.db2.gz VZXVOSNHFANPDN-UHFFFAOYSA-N 0 3 330.359 3.777 20 5 EHBDHN Cc1cccc([C@@H](O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC001167735184 1038444571 /nfs/dbraw/zinc/44/45/71/1038444571.db2.gz UTQFLTWBBXGVSJ-IBGZPJMESA-N 0 3 326.396 3.601 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H](C)c1c(C)cccc1C ZINC000555059630 1040102119 /nfs/dbraw/zinc/10/21/19/1040102119.db2.gz RJYZJGGPUBGQON-HNNXBMFYSA-N 0 3 341.411 3.809 20 5 EHBDHN COc1cc(CN2CCC[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000433074284 1040641121 /nfs/dbraw/zinc/64/11/21/1040641121.db2.gz HYOVZUYDEAEDIM-KRWDZBQOSA-N 0 3 326.396 3.983 20 5 EHBDHN COC(=O)c1cc([C@H](C)N(C)CCc2cccc([N+](=O)[O-])c2)oc1C ZINC000433202497 1041057796 /nfs/dbraw/zinc/05/77/96/1041057796.db2.gz RBTQPBKBJYBRJY-LBPRGKRZSA-N 0 3 346.383 3.518 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H](C)c1ccccc1C ZINC000120513989 1041391747 /nfs/dbraw/zinc/39/17/47/1041391747.db2.gz GEYPVDQPQIKWLE-CQSZACIVSA-N 0 3 327.384 3.501 20 5 EHBDHN CN(C)[C@@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1cccs1 ZINC000432320360 1042854005 /nfs/dbraw/zinc/85/40/05/1042854005.db2.gz OAFIBMCAXIMKPF-HNNXBMFYSA-N 0 3 342.424 3.919 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CNC[C@H](c1ccco1)N1CCCCC1 ZINC000183422399 1125556417 /nfs/dbraw/zinc/55/64/17/1125556417.db2.gz LEBHYGKXXSRZLY-GOSISDBHSA-N 0 3 343.427 3.813 20 5 EHBDHN CCN(CC)[C@@H](CNCc1ccc([N+](=O)[O-])cc1C)c1ccco1 ZINC000183455590 1125567625 /nfs/dbraw/zinc/56/76/25/1125567625.db2.gz NKNPWHNLNBRXOU-KRWDZBQOSA-N 0 3 331.416 3.669 20 5 EHBDHN Cc1c(CN[C@H](C)c2cccc(-n3cccn3)c2)cccc1[N+](=O)[O-] ZINC000183592729 1125608415 /nfs/dbraw/zinc/60/84/15/1125608415.db2.gz MWNGFIGFWKGOOZ-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNC3CCSCC3)cs2)c1 ZINC000172119465 1127769208 /nfs/dbraw/zinc/76/92/08/1127769208.db2.gz WVHYJGBXKAGPOO-UHFFFAOYSA-N 0 3 335.454 3.704 20 5 EHBDHN Cc1cnc(NC[C@H](c2ccc(Cl)cc2)N(C)C)c([N+](=O)[O-])c1 ZINC000301457270 1128344309 /nfs/dbraw/zinc/34/43/09/1128344309.db2.gz CLBAWNVVTGCBEO-OAHLLOKOSA-N 0 3 334.807 3.666 20 5 EHBDHN C[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CN1C1CC1 ZINC000301554963 1128496291 /nfs/dbraw/zinc/49/62/91/1128496291.db2.gz ICXPBAWNVXSAHO-GXSJLCMTSA-N 0 3 329.322 3.651 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCSc3c(F)cccc32)cc1 ZINC000765849492 1128569936 /nfs/dbraw/zinc/56/99/36/1128569936.db2.gz QLYHEOVJSSFVTD-JKSUJKDBSA-N 0 3 348.399 3.594 20 5 EHBDHN CC1(C)CC[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)O1 ZINC000495183563 1120981139 /nfs/dbraw/zinc/98/11/39/1120981139.db2.gz YDAUCDOQEMGMCE-AWEZNQCLSA-N 0 3 330.384 3.902 20 5 EHBDHN CCN1CCN(c2ccc(Nc3ccc(F)cc3[N+](=O)[O-])cc2)CC1 ZINC000920960287 1123443339 /nfs/dbraw/zinc/44/33/39/1123443339.db2.gz QIXYMXCAERESGD-UHFFFAOYSA-N 0 3 344.390 3.619 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN(C)[C@H](C)Cc1ccc(C)cc1 ZINC000610003516 1123711646 /nfs/dbraw/zinc/71/16/46/1123711646.db2.gz GUFJCGIUAPDLOV-OAHLLOKOSA-N 0 3 328.412 3.975 20 5 EHBDHN Cc1csc(C2(NCCOc3ccc([N+](=O)[O-])cc3)CCCC2)n1 ZINC000083215836 1124101651 /nfs/dbraw/zinc/10/16/51/1124101651.db2.gz FURGKARLYYREEE-UHFFFAOYSA-N 0 3 347.440 3.798 20 5 EHBDHN Cc1ccc([C@H](C)NCCC(=O)Nc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000181815306 1125047998 /nfs/dbraw/zinc/04/79/98/1125047998.db2.gz ORJFHJBKNJGWIL-ZDUSSCGKSA-N 0 3 345.374 3.722 20 5 EHBDHN COc1cc(NC[C@H](c2cccs2)N(C)C)c(F)cc1[N+](=O)[O-] ZINC000301870694 1129252026 /nfs/dbraw/zinc/25/20/26/1129252026.db2.gz PEFDJGXKFYZDLQ-CYBMUJFWSA-N 0 3 339.392 3.519 20 5 EHBDHN Cc1c(NC(=O)[C@@H](C)N(C)C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181737 1129316435 /nfs/dbraw/zinc/31/64/35/1129316435.db2.gz IYXZSELUSQFTLB-CABCVRRESA-N 0 3 331.416 3.518 20 5 EHBDHN CSc1ccc([C@H](CNc2nc(C)ccc2[N+](=O)[O-])N(C)C)cc1 ZINC000338833959 1129395736 /nfs/dbraw/zinc/39/57/36/1129395736.db2.gz CKFZCHOMLOOADW-INIZCTEOSA-N 0 3 346.456 3.735 20 5 EHBDHN CC[C@H]1CCCCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000157327654 1129757923 /nfs/dbraw/zinc/75/79/23/1129757923.db2.gz PLUVQNUSPDYSNX-AWEZNQCLSA-N 0 3 330.388 3.799 20 5 EHBDHN C[C@@H]1CCC[C@H](NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1C ZINC000163016039 1129915876 /nfs/dbraw/zinc/91/58/76/1129915876.db2.gz JDODQEOSTWJJNY-JMSVASOKSA-N 0 3 330.388 3.559 20 5 EHBDHN Cc1cccc(F)c1CN[C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000766215173 1131411795 /nfs/dbraw/zinc/41/17/95/1131411795.db2.gz FPRGEVNZFJSVFC-CYBMUJFWSA-N 0 3 345.374 3.549 20 5 EHBDHN C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CCC(=O)N2 ZINC000173328747 1130207686 /nfs/dbraw/zinc/20/76/86/1130207686.db2.gz YVWLGZGODDJRDQ-QWHCGFSZSA-N 0 3 339.395 3.891 20 5 EHBDHN Cc1nc(C[C@@H]2CCCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000245514441 1130228614 /nfs/dbraw/zinc/22/86/14/1130228614.db2.gz BWLNLPPWYBNUAD-ZFWWWQNUSA-N 0 3 344.415 3.610 20 5 EHBDHN CCN(CCn1cc([N+](=O)[O-])cn1)[C@H](C)c1cc2ccccc2o1 ZINC000174832765 1130387423 /nfs/dbraw/zinc/38/74/23/1130387423.db2.gz MGOWVQHNRDITBK-CYBMUJFWSA-N 0 3 328.372 3.621 20 5 EHBDHN O=c1oc2ccc([N+](=O)[O-])cc2n1CN(CC1CC1)C1CCCCC1 ZINC000727823336 1130600278 /nfs/dbraw/zinc/60/02/78/1130600278.db2.gz IUKKZWDSVIZYMG-UHFFFAOYSA-N 0 3 345.399 3.505 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N(C)Cc2cccc(O)c2)c1F ZINC001173180347 1131992565 /nfs/dbraw/zinc/99/25/65/1131992565.db2.gz JXYDBENJVRAVTD-LBPRGKRZSA-N 0 3 348.374 3.511 20 5 EHBDHN CC1(C)CO[C@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001179516013 1133255056 /nfs/dbraw/zinc/25/50/56/1133255056.db2.gz OVBYFGAHKXKOMS-INIZCTEOSA-N 0 3 330.384 3.760 20 5 EHBDHN O=C1OC[C@H]2CN(Cc3c4ccccc4cc4ccccc43)CCN12 ZINC000769482566 1133287773 /nfs/dbraw/zinc/28/77/73/1133287773.db2.gz ATOHCYHMBISZTI-QGZVFWFLSA-N 0 3 332.403 3.629 20 5 EHBDHN C[C@H]1COCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000769455709 1133294452 /nfs/dbraw/zinc/29/44/52/1133294452.db2.gz JLWATHFTVWMJCA-CYBMUJFWSA-N 0 3 332.425 3.792 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN[C@@H]2CCc3cc(F)c(F)c(F)c32)cc1 ZINC001181807816 1133530567 /nfs/dbraw/zinc/53/05/67/1133530567.db2.gz JHGNLJJVBUEQFA-CQSZACIVSA-N 0 3 336.313 3.832 20 5 EHBDHN C[C@H](CNCc1ccc([N+](=O)[O-])cc1F)c1ccccc1[N+](=O)[O-] ZINC001184046084 1133891412 /nfs/dbraw/zinc/89/14/12/1133891412.db2.gz TZPXPMJRFIUNDS-LLVKDONJSA-N 0 3 333.319 3.535 20 5 EHBDHN CC1CCN(CCNc2cccc(C(F)(F)F)c2[N+](=O)[O-])CC1 ZINC001184839205 1133996195 /nfs/dbraw/zinc/99/61/95/1133996195.db2.gz DOZUXUPCOUECTL-UHFFFAOYSA-N 0 3 331.338 3.757 20 5 EHBDHN C[C@@H]1[C@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907253 1134115650 /nfs/dbraw/zinc/11/56/50/1134115650.db2.gz GHVBJHIXGZQUFS-CXAGYDPISA-N 0 3 341.367 3.881 20 5 EHBDHN O=[N+]([O-])c1cc2ccccc2nc1NC[C@@H]1CCN1C1CCCC1 ZINC001187243208 1134312916 /nfs/dbraw/zinc/31/29/16/1134312916.db2.gz SYDBUOMRSHOJPN-HNNXBMFYSA-N 0 3 326.400 3.572 20 5 EHBDHN Cc1ccc(CN2CC[C@H](Nc3ncc(Cl)cc3[N+](=O)[O-])C2)cc1 ZINC001187390242 1134334629 /nfs/dbraw/zinc/33/46/29/1134334629.db2.gz FMGLOCPSZNTMRQ-HNNXBMFYSA-N 0 3 346.818 3.638 20 5 EHBDHN Cc1c(CNC/C=C\c2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000790995672 1134490048 /nfs/dbraw/zinc/49/00/48/1134490048.db2.gz AEKDDVJRFYQQLP-YVMONPNESA-N 0 3 327.340 3.614 20 5 EHBDHN Cc1c(CNC/C=C/c2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000790995671 1134490250 /nfs/dbraw/zinc/49/02/50/1134490250.db2.gz AEKDDVJRFYQQLP-VMPITWQZSA-N 0 3 327.340 3.614 20 5 EHBDHN CC[C@H](c1ccccc1OC)N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834349 1135332567 /nfs/dbraw/zinc/33/25/67/1135332567.db2.gz FXIKGSHGOYLJKN-QZTJIDSGSA-N 0 3 344.411 3.720 20 5 EHBDHN Cc1ccc(-c2cc(C(=O)OCC(C)[N+](=O)[O-])c3ccccc3n2)o1 ZINC000813104658 1136288195 /nfs/dbraw/zinc/28/81/95/1136288195.db2.gz FRFQOLMNUYDKKC-NSHDSACASA-N 0 3 340.335 3.625 20 5 EHBDHN CC(COC(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)[N+](=O)[O-] ZINC000813110815 1136293894 /nfs/dbraw/zinc/29/38/94/1136293894.db2.gz JZJZCSBAYCIVCE-SECBINFHSA-N 0 3 343.257 3.787 20 5 EHBDHN Cc1cc(/C=C/C(=O)OCC(C)[N+](=O)[O-])c(C)n1C1CCCCC1 ZINC000813110321 1136294527 /nfs/dbraw/zinc/29/45/27/1136294527.db2.gz XQLXUXBDQFFDSE-ATWMFIQVSA-N 0 3 334.416 3.832 20 5 EHBDHN CCc1nc(C)c([C@@H](C)N(C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585596 1136448524 /nfs/dbraw/zinc/44/85/24/1136448524.db2.gz XLQDYMPCSRELSD-DOMZBBRYSA-N 0 3 349.456 3.649 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC(c3ccc(F)cc3)CC2)cc1 ZINC000776591950 1136453042 /nfs/dbraw/zinc/45/30/42/1136453042.db2.gz MEJSCVDMXLZVSK-LJQANCHMSA-N 0 3 344.386 3.647 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CC[C@H](c3cccc(Cl)c3)C2)c1 ZINC000814667692 1136492129 /nfs/dbraw/zinc/49/21/29/1136492129.db2.gz VDVXLLXOYROSNY-MAUKXSAKSA-N 0 3 346.814 3.771 20 5 EHBDHN Cc1nc2c(s1)[C@@H](N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815614991 1136618869 /nfs/dbraw/zinc/61/88/69/1136618869.db2.gz FZLIGKXWBWCEJI-RNCFNFMXSA-N 0 3 332.429 3.670 20 5 EHBDHN COCc1cc([N+](=O)[O-])ccc1NC[C@@H](c1cccs1)N(C)C ZINC000266017725 1136997981 /nfs/dbraw/zinc/99/79/81/1136997981.db2.gz PAFOWMDYAMEWEG-HNNXBMFYSA-N 0 3 335.429 3.518 20 5 EHBDHN CCc1nc(CN[C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])co1 ZINC000825057481 1137163699 /nfs/dbraw/zinc/16/36/99/1137163699.db2.gz PFEDLNFGUIUIQL-XJKSGUPXSA-N 0 3 329.400 3.646 20 5 EHBDHN CCCCSCC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845873231 1137316165 /nfs/dbraw/zinc/31/61/65/1137316165.db2.gz CBJCNWNINJMKEJ-NHYWBVRUSA-N 0 3 329.393 3.609 20 5 EHBDHN CC([C@@H](OC(=O)c1ccnc(C2CC2)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845874743 1137316239 /nfs/dbraw/zinc/31/62/39/1137316239.db2.gz IMMFXFQWSDUGPW-APPDUMDISA-N 0 3 344.342 3.661 20 5 EHBDHN COCc1cccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845873772 1137316335 /nfs/dbraw/zinc/31/63/35/1137316335.db2.gz VWOGENYVKHXHNM-PXAZEXFGSA-N 0 3 347.342 3.535 20 5 EHBDHN CC([C@H](OC(=O)[C@@H](C)c1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000845876600 1137316378 /nfs/dbraw/zinc/31/63/78/1137316378.db2.gz NCRPQBMIQBVBQM-RWSFTLGLSA-N 0 3 337.372 3.940 20 5 EHBDHN CSc1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845878172 1137316402 /nfs/dbraw/zinc/31/64/02/1137316402.db2.gz UWVGZNWONADBQD-OTYXRUKQSA-N 0 3 339.344 3.704 20 5 EHBDHN CC([C@@H](OC(=O)CC1CC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845878656 1137316588 /nfs/dbraw/zinc/31/65/88/1137316588.db2.gz IASKAGDJRAWQBB-YMTOWFKASA-N 0 3 331.290 3.511 20 5 EHBDHN CSc1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845878176 1137316598 /nfs/dbraw/zinc/31/65/98/1137316598.db2.gz UWVGZNWONADBQD-YMTOWFKASA-N 0 3 339.344 3.704 20 5 EHBDHN CC([C@H](OC(=O)C1CCC(F)(F)CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878962 1137316774 /nfs/dbraw/zinc/31/67/74/1137316774.db2.gz UJNSSYPWVOSMLD-HZMBPMFUSA-N 0 3 345.317 3.901 20 5 EHBDHN CC([C@H](OC(=O)[C@@H](C)c1cccs1)c1ccccc1F)[N+](=O)[O-] ZINC000845880655 1137316903 /nfs/dbraw/zinc/31/69/03/1137316903.db2.gz XNZMEGOZLPCYFT-RWSFTLGLSA-N 0 3 337.372 3.940 20 5 EHBDHN CCc1noc(CC)c1CN[C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866282124 1137342595 /nfs/dbraw/zinc/34/25/95/1137342595.db2.gz XVMUOGYPXLMNCZ-LLVKDONJSA-N 0 3 335.379 3.568 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1c2ccccc2[C@H](N)C1(C)C ZINC000867989024 1137392716 /nfs/dbraw/zinc/39/27/16/1137392716.db2.gz ZWTCCYLYYJTSBX-KRWDZBQOSA-N 0 3 339.395 3.650 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](O)c1ccccc1Cl ZINC000773011006 1137459186 /nfs/dbraw/zinc/45/91/86/1137459186.db2.gz QQJVHGFYNSZALU-YVEFUNNKSA-N 0 3 334.803 3.941 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](O)c1c(F)cccc1F ZINC000773016427 1137459603 /nfs/dbraw/zinc/45/96/03/1137459603.db2.gz YKEBDFVJJNEROT-BDJLRTHQSA-N 0 3 336.338 3.566 20 5 EHBDHN Cc1nccn1CCCCN(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000125739193 1137643540 /nfs/dbraw/zinc/64/35/40/1137643540.db2.gz OVFJVFCWPQZBOA-UHFFFAOYSA-N 0 3 336.823 3.665 20 5 EHBDHN CC(C)(C)[C@H]1CCCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878054897 1137700907 /nfs/dbraw/zinc/70/09/07/1137700907.db2.gz NAHCIYHOLCLRLE-CQSZACIVSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@@H]1CCC[C@@H](NCc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H]1C ZINC000878446549 1137716274 /nfs/dbraw/zinc/71/62/74/1137716274.db2.gz GNYSIRQZZLGKCH-MBNYWOFBSA-N 0 3 330.388 3.559 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1nnc(CN(CCC2CC2)CC2CC2)o1 ZINC000878995337 1137734734 /nfs/dbraw/zinc/73/47/34/1137734734.db2.gz BXTILWPGZSSJGU-UHFFFAOYSA-N 0 3 342.399 3.657 20 5 EHBDHN O=[N+]([O-])c1cnc2c(c1)CN(CC1CCC(C(F)(F)F)CC1)CC2 ZINC000332498162 1137945627 /nfs/dbraw/zinc/94/56/27/1137945627.db2.gz CHKVCHPOYKFPGT-UHFFFAOYSA-N 0 3 343.349 3.717 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[C@@H](C)CC1 ZINC000068837698 1138086307 /nfs/dbraw/zinc/08/63/07/1138086307.db2.gz RXSDBQYYTWVLNO-OLZOCXBDSA-N 0 3 330.388 3.828 20 5 EHBDHN CCOc1ccc([C@H](C)NCc2ccc(COC)cc2)cc1[N+](=O)[O-] ZINC000152735884 1139106289 /nfs/dbraw/zinc/10/62/89/1139106289.db2.gz STVINMOGGWVGAB-AWEZNQCLSA-N 0 3 344.411 3.991 20 5 EHBDHN Cc1ccc([C@H](C)NC[C@H]2COC3(CCC(C)CC3)O2)cc1[N+](=O)[O-] ZINC000777313948 1139583166 /nfs/dbraw/zinc/58/31/66/1139583166.db2.gz SBUIGHYUTUAKNH-XEUAFLOLSA-N 0 3 348.443 3.876 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@@H](O)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271025739 1141296400 /nfs/dbraw/zinc/29/64/00/1141296400.db2.gz BBXDJHABSSFHEL-SJKOYZFVSA-N 0 3 348.374 3.517 20 5 EHBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CCCc2c[nH]nc21 ZINC000271558773 1141398003 /nfs/dbraw/zinc/39/80/03/1141398003.db2.gz WIBDAPHEKCVWEI-KBPBESRZSA-N 0 3 346.456 3.856 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN[C@H](C)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000430219833 1015087241 /nfs/dbraw/zinc/08/72/41/1015087241.db2.gz NWZFVASZVGGNBO-XEKQOVJPSA-N 0 3 342.395 3.646 20 5 EHBDHN Cc1c([C@H](C)NCc2ccc(-n3cccn3)cc2)cccc1[N+](=O)[O-] ZINC000157583421 1015111449 /nfs/dbraw/zinc/11/14/49/1015111449.db2.gz ZASXXSRRFQTSIN-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN CCOc1cc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)ccc1O ZINC000459476202 1032190871 /nfs/dbraw/zinc/19/08/71/1032190871.db2.gz HACLXHJXLLSOTB-UHFFFAOYSA-N 0 3 330.384 3.724 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593524 1032314592 /nfs/dbraw/zinc/31/45/92/1032314592.db2.gz VOYBOPWMXNVOAE-SCLBCKFNSA-N 0 3 334.416 3.710 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(Cc3cnn4ccccc34)C2)cc1 ZINC000449501188 1032680953 /nfs/dbraw/zinc/68/09/53/1032680953.db2.gz PGAWOHGJYQDMGZ-INIZCTEOSA-N 0 3 336.395 3.622 20 5 EHBDHN C[C@@H](NCc1cnn(C)c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151144377 1019378170 /nfs/dbraw/zinc/37/81/70/1019378170.db2.gz VYWYNTZOYSGXFA-GFCCVEGCSA-N 0 3 342.424 3.908 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN(C)[C@@H](C)Cc1ccc(C)cc1 ZINC001167453970 1020658751 /nfs/dbraw/zinc/65/87/51/1020658751.db2.gz PKACUIPBTDIAQD-HNNXBMFYSA-N 0 3 328.412 3.975 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510436042 1021148001 /nfs/dbraw/zinc/14/80/01/1021148001.db2.gz YAQLVGKIUURGKP-GDBMZVCRSA-N 0 3 336.395 3.953 20 5 EHBDHN C[C@@H](O)CC(C)(C)CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602549292 1032959594 /nfs/dbraw/zinc/95/95/94/1032959594.db2.gz AGTBVGRAMIIVPT-SNVBAGLBSA-N 0 3 334.338 3.500 20 5 EHBDHN CC[C@@](C)(O)CN(Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000439262693 1021286123 /nfs/dbraw/zinc/28/61/23/1021286123.db2.gz PSDDLPZWYRTDEL-LJQANCHMSA-N 0 3 328.412 3.758 20 5 EHBDHN C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000518562181 1021319956 /nfs/dbraw/zinc/31/99/56/1021319956.db2.gz BHSTZGIQJXBDNX-FPWDIPAHSA-N 0 3 344.436 3.670 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCCN(c2ccccc2)CC1 ZINC000518582800 1021348874 /nfs/dbraw/zinc/34/88/74/1021348874.db2.gz XCMDCXZVEIAVMD-MRXNPFEDSA-N 0 3 325.412 3.868 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCC1(c2ccccc2)CC1 ZINC000509608508 1021551782 /nfs/dbraw/zinc/55/17/82/1021551782.db2.gz MBNNDFMKUCWRMN-UHFFFAOYSA-N 0 3 326.396 3.815 20 5 EHBDHN CCN(CC)[C@@H](CNc1c(OC)cccc1[N+](=O)[O-])c1ccco1 ZINC000519619942 1021576222 /nfs/dbraw/zinc/57/62/22/1021576222.db2.gz XFRJDQVDIRBGQS-AWEZNQCLSA-N 0 3 333.388 3.691 20 5 EHBDHN C[C@@H](NC[C@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000090920826 1021819336 /nfs/dbraw/zinc/81/93/36/1021819336.db2.gz BWEJWJDXYGWFEP-HWPZZCPQSA-N 0 3 338.766 3.772 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[C@]2(C1)CCCOC2 ZINC000602651340 1033039923 /nfs/dbraw/zinc/03/99/23/1033039923.db2.gz HEHDOBKMWJQISD-HNNXBMFYSA-N 0 3 344.333 3.616 20 5 EHBDHN CCC[C@H](NCCn1c(C)ncc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000602806431 1033180302 /nfs/dbraw/zinc/18/03/02/1033180302.db2.gz SPGSCCQPYFOSDM-HNNXBMFYSA-N 0 3 338.358 3.509 20 5 EHBDHN COc1ccccc1CN(CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000522269015 1024127271 /nfs/dbraw/zinc/12/72/71/1024127271.db2.gz OXUAKONHZBDXAO-UHFFFAOYSA-N 0 3 326.396 3.811 20 5 EHBDHN CC(=O)c1cc(NC[C@@H](C)N(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000342232317 1024497676 /nfs/dbraw/zinc/49/76/76/1024497676.db2.gz YCYNPBUTAGAKOU-CQSZACIVSA-N 0 3 341.411 3.730 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNCC[C@H]3CCCC3(F)F)nc2c1 ZINC000895544303 1024602689 /nfs/dbraw/zinc/60/26/89/1024602689.db2.gz IFWZCBSXWCLMNU-SNVBAGLBSA-N 0 3 325.315 3.651 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CC[C@@H](c3ccc4cccnc4n3)C2)cc1 ZINC000602889922 1033245050 /nfs/dbraw/zinc/24/50/50/1033245050.db2.gz XAMPVCFOVPVQEF-MRXNPFEDSA-N 0 3 334.379 3.528 20 5 EHBDHN COC(=O)[C@H](CCN[C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000425461756 1025367220 /nfs/dbraw/zinc/36/72/20/1025367220.db2.gz SJOQELMWSYLMHX-RHSMWYFYSA-N 0 3 342.395 3.592 20 5 EHBDHN CC[C@H](C)[C@H](C)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240798 1025489491 /nfs/dbraw/zinc/48/94/91/1025489491.db2.gz RFGPMOAFHOPEDG-JSGCOSHPSA-N 0 3 333.432 3.741 20 5 EHBDHN CO[C@@H](C)CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000442997470 1025639818 /nfs/dbraw/zinc/63/98/18/1025639818.db2.gz YVHHIKROGQUGTB-LBPRGKRZSA-N 0 3 334.347 3.651 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CC[C@@H](c2ccccc2F)C1 ZINC000503656013 1028007465 /nfs/dbraw/zinc/00/74/65/1028007465.db2.gz YMIGEBYZTAMROD-CQSZACIVSA-N 0 3 330.359 3.602 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@@H](c1ccccc1)C1CCOCC1 ZINC000367723822 1028511906 /nfs/dbraw/zinc/51/19/06/1028511906.db2.gz NBZKSNSABWXOBX-IBGZPJMESA-N 0 3 326.396 3.852 20 5 EHBDHN CC[C@H](C)[C@H](C)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285229 1029573520 /nfs/dbraw/zinc/57/35/20/1029573520.db2.gz XUAKTXAIKNBLPT-JSGCOSHPSA-N 0 3 333.432 3.741 20 5 EHBDHN CCOC(=O)[C@@]1(C(C)C)CCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000446890941 1029842967 /nfs/dbraw/zinc/84/29/67/1029842967.db2.gz RKEAYSJBNSWOIL-FUKPKEADSA-N 0 3 346.427 3.519 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCCN(c2ccccc2)CC1 ZINC000441215841 1030009649 /nfs/dbraw/zinc/00/96/49/1030009649.db2.gz GBDNGXBYHKZIFV-INIZCTEOSA-N 0 3 325.412 3.868 20 5 EHBDHN C[C@@H]1C[C@H](C)[C@H](C)N(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737962 1031703032 /nfs/dbraw/zinc/70/30/32/1031703032.db2.gz HERGFMCDWSRMQA-AGIUHOORSA-N 0 3 330.388 3.511 20 5 EHBDHN Cn1cccc1[C@@H]1CCCCN1CCOc1ccc([N+](=O)[O-])cc1 ZINC000472312500 1031770982 /nfs/dbraw/zinc/77/09/82/1031770982.db2.gz DXUSMCVFXVQFBC-SFHVURJKSA-N 0 3 329.400 3.539 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CCC(C4(O)CC4)CC3)o2)cc1 ZINC000593647760 1033608409 /nfs/dbraw/zinc/60/84/09/1033608409.db2.gz JSYOEJZGTUXABL-UHFFFAOYSA-N 0 3 342.395 3.592 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)c(F)c1 ZINC000598986700 1033612255 /nfs/dbraw/zinc/61/22/55/1033612255.db2.gz LGUGKOLKKOXONM-HYVNUMGLSA-N 0 3 332.762 3.815 20 5 EHBDHN C[C@H](COc1c(F)cccc1F)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000595072774 1033647431 /nfs/dbraw/zinc/64/74/31/1033647431.db2.gz QOPVEJWVYZVXLI-NEPJUHHUSA-N 0 3 336.338 3.991 20 5 EHBDHN COc1cccc([C@H](CN[C@H](C)c2cccc([N+](=O)[O-])c2)OC)c1 ZINC000599060971 1033700565 /nfs/dbraw/zinc/70/05/65/1033700565.db2.gz ICONOWLMTAMBHD-ACJLOTCBSA-N 0 3 330.384 3.642 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@H]2c2ccc(O)cc2)c1 ZINC000604484187 1034389431 /nfs/dbraw/zinc/38/94/31/1034389431.db2.gz CNHSJGNVLHAVGU-SFHVURJKSA-N 0 3 328.368 3.516 20 5 EHBDHN CC(C)n1ncc2c1C[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000365139432 1034923230 /nfs/dbraw/zinc/92/32/30/1034923230.db2.gz RWUNUMNOACHQNQ-AWEZNQCLSA-N 0 3 348.834 3.673 20 5 EHBDHN CN1CC[C@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000571573354 1035540007 /nfs/dbraw/zinc/54/00/07/1035540007.db2.gz RJBZRLUDQCVAFT-WMZOPIPTSA-N 0 3 345.830 3.783 20 5 EHBDHN CCCN(Cc1ccc([N+](=O)[O-])c(OCC)c1)C[C@H]1CCCCO1 ZINC000492531542 1035934090 /nfs/dbraw/zinc/93/40/90/1035934090.db2.gz FZLVYITZVFEUIC-MRXNPFEDSA-N 0 3 336.432 3.775 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@H]2/C=C/c2ccccc2)c1 ZINC000780396957 1035995314 /nfs/dbraw/zinc/99/53/14/1035995314.db2.gz GRGGMFHENBNMTN-KALAYHLKSA-N 0 3 338.407 3.806 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000056201446 1036140204 /nfs/dbraw/zinc/14/02/04/1036140204.db2.gz YIDIYSPAUDJCND-HUUCEWRRSA-N 0 3 341.411 3.889 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cccc(CN(C)C)c1 ZINC000590549951 1036934515 /nfs/dbraw/zinc/93/45/15/1036934515.db2.gz JGAYTCLWTIUZAZ-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN C[C@@]1(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCO1 ZINC000180740731 1037137943 /nfs/dbraw/zinc/13/79/43/1037137943.db2.gz CCZXNUSHEVDOAS-MOPGFXCFSA-N 0 3 326.396 3.843 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC(C)(C)c1ccccn1 ZINC000595041463 1037211450 /nfs/dbraw/zinc/21/14/50/1037211450.db2.gz LTPQVRZKZPQNHA-ZDUSSCGKSA-N 0 3 329.400 3.627 20 5 EHBDHN COc1ccc(F)cc1CNCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000462794845 1037408840 /nfs/dbraw/zinc/40/88/40/1037408840.db2.gz JDZGXPASKWQQKM-UHFFFAOYSA-N 0 3 338.766 3.728 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CN[C@@H]3CC[C@H]4C[C@H]4C3)cs2)c1 ZINC000592378778 1037949302 /nfs/dbraw/zinc/94/93/02/1037949302.db2.gz CVHLWTFQYWLXRQ-FPMFFAJLSA-N 0 3 329.425 3.997 20 5 EHBDHN Cc1cc(N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461959427 1038696614 /nfs/dbraw/zinc/69/66/14/1038696614.db2.gz PLTVMAQXRFUFKC-MAUKXSAKSA-N 0 3 329.375 3.900 20 5 EHBDHN CC[C@]1(CO)CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000190224111 1038773153 /nfs/dbraw/zinc/77/31/53/1038773153.db2.gz FYSLLEUGKPXIDC-IBGZPJMESA-N 0 3 344.411 3.839 20 5 EHBDHN CCOC(=O)C[C@@](C)(NCc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000481701963 1041270326 /nfs/dbraw/zinc/27/03/26/1041270326.db2.gz NALNOZWLKVODES-MRXNPFEDSA-N 0 3 342.823 3.706 20 5 EHBDHN CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCCO1 ZINC000511662218 1041372785 /nfs/dbraw/zinc/37/27/85/1041372785.db2.gz ANWYRJLWUGDZLD-MRXNPFEDSA-N 0 3 330.384 3.856 20 5 EHBDHN O=[N+]([O-])c1ccc2nc(NC[C@H]3CCCCN3C3CC3)sc2c1 ZINC000764940157 1127552490 /nfs/dbraw/zinc/55/24/90/1127552490.db2.gz FXUAOWQRKVNPTB-CYBMUJFWSA-N 0 3 332.429 3.633 20 5 EHBDHN C[C@H](CS(C)(=O)=O)NCc1c2ccccc2cc2ccccc21 ZINC000172122022 1127771243 /nfs/dbraw/zinc/77/12/43/1127771243.db2.gz XNVXJPSFEAJCDO-CQSZACIVSA-N 0 3 327.449 3.516 20 5 EHBDHN CO[C@@H](c1ccccc1F)[C@H](C)NCc1ccc([N+](=O)[O-])cc1C ZINC000542725229 1128563078 /nfs/dbraw/zinc/56/30/78/1128563078.db2.gz ZOPHUXMGXXLCBB-SCLBCKFNSA-N 0 3 332.375 3.908 20 5 EHBDHN COc1ccccc1[C@H](CNc1ccc([N+](=O)[O-])cc1)N1CCCC1 ZINC000301056598 1121193108 /nfs/dbraw/zinc/19/31/08/1121193108.db2.gz KNZNCTJPKUHKRA-SFHVURJKSA-N 0 3 341.411 3.852 20 5 EHBDHN CN(C)[C@@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1cccc(F)c1 ZINC000301806510 1129104596 /nfs/dbraw/zinc/10/45/96/1129104596.db2.gz WCZNTIMUEUKOIG-HNNXBMFYSA-N 0 3 339.317 3.727 20 5 EHBDHN CCCN(Cn1nc(C)c([N+](=O)[O-])c1C)[C@@H]1CCc2ccccc2C1 ZINC000919951297 1123243693 /nfs/dbraw/zinc/24/36/93/1123243693.db2.gz QNXXOHVUDFGCKE-GOSISDBHSA-N 0 3 342.443 3.635 20 5 EHBDHN CCC1CCC(N(C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000921046748 1123458734 /nfs/dbraw/zinc/45/87/34/1123458734.db2.gz QCWXEVOAXCWODT-UHFFFAOYSA-N 0 3 343.431 3.711 20 5 EHBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC[C@H](c2cc[nH]n2)C1 ZINC000615836013 1123884046 /nfs/dbraw/zinc/88/40/46/1123884046.db2.gz HCDDJXOIXIMFDU-DNXIFWLFSA-N 0 3 326.400 3.601 20 5 EHBDHN C[C@@H]1CCC[C@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000078539655 1129160237 /nfs/dbraw/zinc/16/02/37/1129160237.db2.gz DNJUPBFKECSJOH-DOMZBBRYSA-N 0 3 330.388 3.655 20 5 EHBDHN CN1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000301837154 1129174881 /nfs/dbraw/zinc/17/48/81/1129174881.db2.gz MKASNDFHOUXTGE-HIFRSBDPSA-N 0 3 332.791 3.501 20 5 EHBDHN COCc1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccc(F)cc1)N(C)C ZINC000080580385 1124531095 /nfs/dbraw/zinc/53/10/95/1124531095.db2.gz QRBUOTIANCWOGH-SFHVURJKSA-N 0 3 347.390 3.595 20 5 EHBDHN Cc1cc(NC[C@H](c2cccs2)N2CCCC2)ncc1[N+](=O)[O-] ZINC000080585180 1124534038 /nfs/dbraw/zinc/53/40/38/1124534038.db2.gz GQYRYKQAFHGPKC-CQSZACIVSA-N 0 3 332.429 3.609 20 5 EHBDHN CO[C@@H](CN(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000619808754 1125410567 /nfs/dbraw/zinc/41/05/67/1125410567.db2.gz ZIJBKBQBJGCBEK-IBGZPJMESA-N 0 3 326.396 3.947 20 5 EHBDHN Cc1cccc(F)c1CN[C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000766215009 1131371211 /nfs/dbraw/zinc/37/12/11/1131371211.db2.gz AFXYPJWSJOTAIX-ZDUSSCGKSA-N 0 3 345.374 3.549 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H](c1cccs1)C1CC1 ZINC000543438791 1129489267 /nfs/dbraw/zinc/48/92/67/1129489267.db2.gz NDQOQHBTXHXZAA-QGZVFWFLSA-N 0 3 345.424 3.644 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H](c1cccs1)C1CC1 ZINC000543438783 1129489489 /nfs/dbraw/zinc/48/94/89/1129489489.db2.gz NDQOQHBTXHXZAA-KRWDZBQOSA-N 0 3 345.424 3.644 20 5 EHBDHN C[C@@H](O)CCN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000093481054 1129590566 /nfs/dbraw/zinc/59/05/66/1129590566.db2.gz ZDFLICLIUBYECU-LLVKDONJSA-N 0 3 338.791 3.711 20 5 EHBDHN CC[C@@H](O)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000124326903 1129598327 /nfs/dbraw/zinc/59/83/27/1129598327.db2.gz CMMHPEIWLMWQFB-GFCCVEGCSA-N 0 3 338.791 3.759 20 5 EHBDHN O=[N+]([O-])c1cn(CN(C2CC2)C2CCCCC2)nc1-c1ccncc1 ZINC000742145069 1131690626 /nfs/dbraw/zinc/69/06/26/1131690626.db2.gz LLKGKIKNLFHMBN-UHFFFAOYSA-N 0 3 341.415 3.608 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@@H](C)c2ccc(C)cn2)c1F ZINC001173187671 1131993500 /nfs/dbraw/zinc/99/35/00/1131993500.db2.gz FFDZESAXMUPUPD-STQMWFEESA-N 0 3 347.390 3.728 20 5 EHBDHN COc1cccc(CN(C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1OC ZINC001173231190 1132009561 /nfs/dbraw/zinc/00/95/61/1132009561.db2.gz KJQBWOIBRVURHN-AWEZNQCLSA-N 0 3 344.411 3.675 20 5 EHBDHN C[C@H](c1ccccc1)[C@@H](CO)NCc1ccc([N+](=O)[O-])cc1Cl ZINC001168991822 1132626575 /nfs/dbraw/zinc/62/65/75/1132626575.db2.gz CERNDIOBGIMJKF-SJKOYZFVSA-N 0 3 334.803 3.502 20 5 EHBDHN CC1(C)C[C@@]1(C)CNCc1c(Br)cccc1[N+](=O)[O-] ZINC001179468524 1133253643 /nfs/dbraw/zinc/25/36/43/1133253643.db2.gz GIPPFGVQGNJSQN-AWEZNQCLSA-N 0 3 327.222 3.883 20 5 EHBDHN C[C@@H]1COC[C@@H]1NCc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001179644936 1133265875 /nfs/dbraw/zinc/26/58/75/1133265875.db2.gz AQHBBWLNBTUIFF-YGRLFVJLSA-N 0 3 336.775 3.633 20 5 EHBDHN Cc1ccc([C@@H](C)NCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000774843533 1134051447 /nfs/dbraw/zinc/05/14/47/1134051447.db2.gz JVHLVERDDRGUSQ-GFCCVEGCSA-N 0 3 347.802 3.846 20 5 EHBDHN CC[C@@](C)(NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000775386017 1134697071 /nfs/dbraw/zinc/69/70/71/1134697071.db2.gz BULSBCPZARIDEB-LJQANCHMSA-N 0 3 341.411 3.757 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCc3ccsc3C2)c([N+](=O)[O-])c1 ZINC001170348452 1134759671 /nfs/dbraw/zinc/75/96/71/1134759671.db2.gz XBUUVKXJTJUNPW-LBPRGKRZSA-N 0 3 332.425 3.654 20 5 EHBDHN COc1ccc(C[C@H](C)N2CC(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170351606 1134760712 /nfs/dbraw/zinc/76/07/12/1134760712.db2.gz GKIOVCMRESETDW-AWEZNQCLSA-N 0 3 326.396 3.634 20 5 EHBDHN CC(C)(C)OC(=O)CCN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194477856 1135276281 /nfs/dbraw/zinc/27/62/81/1135276281.db2.gz RNVGJJPAIJFRMW-HNNXBMFYSA-N 0 3 334.416 3.506 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2cnn(CN3CCC[C@H](C4CC4)C3)c2)cc1 ZINC000808231188 1135633748 /nfs/dbraw/zinc/63/37/48/1135633748.db2.gz ZLZYIVXLDLZYJV-INIZCTEOSA-N 0 3 326.400 3.538 20 5 EHBDHN O=[N+]([O-])c1cc(CN2CCCC[C@H]([C@H]3CCOC3)C2)ccc1Cl ZINC001198563866 1135830917 /nfs/dbraw/zinc/83/09/17/1135830917.db2.gz TXPOPYPMTOLTCL-GJZGRUSLSA-N 0 3 338.835 3.887 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCc1cscn1 ZINC000811481673 1136091573 /nfs/dbraw/zinc/09/15/73/1136091573.db2.gz JECWKMZXUAEVSH-UHFFFAOYSA-N 0 3 332.212 3.690 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCc1ccc(Cl)nc1 ZINC000850441293 1136259325 /nfs/dbraw/zinc/25/93/25/1136259325.db2.gz UPDHZOQJPWGTTK-LLVKDONJSA-N 0 3 335.791 3.545 20 5 EHBDHN CC(COC(=O)c1ccc(-c2cccc3cccnc32)cc1)[N+](=O)[O-] ZINC000813105708 1136289775 /nfs/dbraw/zinc/28/97/75/1136289775.db2.gz SIOPYFZZEQXQEM-CYBMUJFWSA-N 0 3 336.347 3.724 20 5 EHBDHN Cc1nn(CN2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000776774783 1136661301 /nfs/dbraw/zinc/66/13/01/1136661301.db2.gz OKJBUSBDADPSKT-KZNAEPCWSA-N 0 3 340.427 3.715 20 5 EHBDHN CC[C@@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000817414682 1136806630 /nfs/dbraw/zinc/80/66/30/1136806630.db2.gz ICZMXEJNNGWRTH-VXGBXAGGSA-N 0 3 333.215 3.949 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@](O)(c2ccccc2)C1 ZINC000859586369 1137021448 /nfs/dbraw/zinc/02/14/48/1137021448.db2.gz NNUFMVNEJLHNMS-HNAYVOBHSA-N 0 3 326.396 3.639 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000859830160 1137033588 /nfs/dbraw/zinc/03/35/88/1137033588.db2.gz NECOVKJHNUFIMG-VXFNFUGZSA-N 0 3 333.215 3.803 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CCO[C@H](c3ccncc3)C2)c1 ZINC000824949071 1137159014 /nfs/dbraw/zinc/15/90/14/1137159014.db2.gz XGIRVTLZIPFVQN-PBHICJAKSA-N 0 3 347.802 3.653 20 5 EHBDHN Cc1ccccc1CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845872618 1137315939 /nfs/dbraw/zinc/31/59/39/1137315939.db2.gz KLLVTXJLGLUCCA-SCLBCKFNSA-N 0 3 331.343 3.626 20 5 EHBDHN CC([C@H](OC(=O)C(F)=C1CCCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845877042 1137316405 /nfs/dbraw/zinc/31/64/05/1137316405.db2.gz DNLMYIBHGUWAIR-BMIGLBTASA-N 0 3 325.311 3.873 20 5 EHBDHN Cc1nc(C2CC2)oc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881178 1137316664 /nfs/dbraw/zinc/31/66/64/1137316664.db2.gz ZCNBEJIQPHQESM-BONVTDFDSA-N 0 3 348.330 3.563 20 5 EHBDHN CC([C@H](OC(=O)[C@@H](C)c1cccs1)c1ccccc1F)[N+](=O)[O-] ZINC000845880654 1137316734 /nfs/dbraw/zinc/31/67/34/1137316734.db2.gz XNZMEGOZLPCYFT-PGUXBMHVSA-N 0 3 337.372 3.940 20 5 EHBDHN CC([C@@H](OC(=O)C[C@@H](C)c1ccncc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881162 1137316868 /nfs/dbraw/zinc/31/68/68/1137316868.db2.gz YPPPTEJNMJUCAX-SNUQEOBHSA-N 0 3 346.358 3.664 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H]1C[C@H]1c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882197 1137317027 /nfs/dbraw/zinc/31/70/27/1137317027.db2.gz NWJZSXCVXTXKJA-BUIXCFAXSA-N 0 3 343.354 3.879 20 5 EHBDHN C[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)[C@](C)(O)c1ccccc1 ZINC000846035340 1137328354 /nfs/dbraw/zinc/32/83/54/1137328354.db2.gz GSQXXGWVKYLMJJ-PXAZEXFGSA-N 0 3 334.803 3.634 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](O)c1ccsc1 ZINC000872037789 1137566982 /nfs/dbraw/zinc/56/69/82/1137566982.db2.gz IEJCXHAIDRVGMU-YGRLFVJLSA-N 0 3 338.454 3.762 20 5 EHBDHN C[C@H](N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872057571 1137568672 /nfs/dbraw/zinc/56/86/72/1137568672.db2.gz GBQFDZKXLMIHHJ-SONRMIBWSA-N 0 3 334.391 3.732 20 5 EHBDHN C[C@@H](N[C@@H]1CCO[C@H](c2ccncc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872082916 1137570317 /nfs/dbraw/zinc/57/03/17/1137570317.db2.gz DUPCUFBTPUFACD-MRRJBJDNSA-N 0 3 345.374 3.700 20 5 EHBDHN C[C@@H](CC(=O)Nc1cccc(F)c1)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129598 1137573126 /nfs/dbraw/zinc/57/31/26/1137573126.db2.gz REMXLQIKFZEWMM-STQMWFEESA-N 0 3 345.374 3.802 20 5 EHBDHN Cc1n[nH]cc1C1CCN(Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000877506883 1137679096 /nfs/dbraw/zinc/67/90/96/1137679096.db2.gz GPUQJDRPIXUTFS-UHFFFAOYSA-N 0 3 328.416 3.623 20 5 EHBDHN C[C@@]1(CCNCc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@]1(F)Cl ZINC000877610953 1137682756 /nfs/dbraw/zinc/68/27/56/1137682756.db2.gz MRZOESBOUUGAMA-KGLIPLIRSA-N 0 3 327.743 3.530 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC2(CCOCC2)O1 ZINC000877993108 1137698926 /nfs/dbraw/zinc/69/89/26/1137698926.db2.gz XHLRZJCXRLBHBI-SFHVURJKSA-N 0 3 348.443 3.533 20 5 EHBDHN CCN(CC)[C@H](CNCc1ccc(C)c([N+](=O)[O-])c1)c1ccco1 ZINC000131452128 1137853576 /nfs/dbraw/zinc/85/35/76/1137853576.db2.gz CFTOOPLGHJGZHX-QGZVFWFLSA-N 0 3 331.416 3.669 20 5 EHBDHN CC(C)(C)CC(C)(C)NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000102794182 1137873956 /nfs/dbraw/zinc/87/39/56/1137873956.db2.gz KOGAWZWJQMROFU-UHFFFAOYSA-N 0 3 332.404 3.949 20 5 EHBDHN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2C)c(CN(C)C)c1 ZINC000072839555 1138108234 /nfs/dbraw/zinc/10/82/34/1138108234.db2.gz DTMKFQUFYIFRJN-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN CC[C@@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000302092481 1138711528 /nfs/dbraw/zinc/71/15/28/1138711528.db2.gz FEKLVSBBTSXTAX-OCCSQVGLSA-N 0 3 337.420 3.549 20 5 EHBDHN C[C@@H](NC[C@@H]1COC2(CCC(C)CC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777314754 1139585300 /nfs/dbraw/zinc/58/53/00/1139585300.db2.gz WEIPAKFDUHJCKM-KJUJZPGYSA-N 0 3 334.416 3.567 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC2CCN([C@@H](C)c3ccncc3)CC2)c1 ZINC000269750575 1141141552 /nfs/dbraw/zinc/14/15/52/1141141552.db2.gz ZUBVKXUTIWMZMJ-HNNXBMFYSA-N 0 3 340.427 3.936 20 5 EHBDHN COc1ccc(CN[C@@H](C)[C@H](OC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271548319 1141394420 /nfs/dbraw/zinc/39/44/20/1141394420.db2.gz UEFSGFWVDMEDHW-SGTLLEGYSA-N 0 3 348.374 3.608 20 5 EHBDHN CC(C)CN1CCN(c2cc(Cl)nc3ccc([N+](=O)[O-])cc32)CC1 ZINC001164657603 719337798 /nfs/dbraw/zinc/33/77/98/719337798.db2.gz UJIBPUXCFPIJPW-UHFFFAOYSA-N 0 3 348.834 3.574 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC(c3ccsc3)CC2)c1 ZINC000186947544 1014621656 /nfs/dbraw/zinc/62/16/56/1014621656.db2.gz LBYACTQSEWDPAG-KRWDZBQOSA-N 0 3 332.425 3.569 20 5 EHBDHN Cc1c([C@@H](C)NCc2ccc(-n3cccn3)cc2)cccc1[N+](=O)[O-] ZINC000157583319 1015110647 /nfs/dbraw/zinc/11/06/47/1015110647.db2.gz ZASXXSRRFQTSIN-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCO[C@@H](c3ccncc3)C2)c(Cl)c1 ZINC000449544020 1032735763 /nfs/dbraw/zinc/73/57/63/1032735763.db2.gz VAWJUWVJTBOIIH-RHSMWYFYSA-N 0 3 347.802 3.653 20 5 EHBDHN C[C@H](NCc1ccccc1Cn1cccn1)c1cccc([N+](=O)[O-])c1 ZINC000120188198 1017995756 /nfs/dbraw/zinc/99/57/56/1017995756.db2.gz YPSVTCXAMCSWNU-HNNXBMFYSA-N 0 3 336.395 3.690 20 5 EHBDHN CCOc1cc(CN2CC[C@@H](c3cc(C)ccn3)C2)ccc1[N+](=O)[O-] ZINC000579608382 1019257921 /nfs/dbraw/zinc/25/79/21/1019257921.db2.gz RZURRZXMDNDFFZ-MRXNPFEDSA-N 0 3 341.411 3.686 20 5 EHBDHN CN(C)Cc1cccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000129324238 1019485336 /nfs/dbraw/zinc/48/53/36/1019485336.db2.gz SBLMPYXUMHWSLJ-UHFFFAOYSA-N 0 3 333.775 3.562 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CCCCN2C2CC2)c(OC(F)F)c1 ZINC000433802582 1019646747 /nfs/dbraw/zinc/64/67/47/1019646747.db2.gz JPWCLJLDDYUXOH-ZDUSSCGKSA-N 0 3 341.358 3.625 20 5 EHBDHN Cc1noc(C)c1CCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602537545 1032950316 /nfs/dbraw/zinc/95/03/16/1032950316.db2.gz FJQSKKDESNGQSB-UHFFFAOYSA-N 0 3 343.305 3.551 20 5 EHBDHN COc1ccc2c(c1)CCN(C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000439778847 1021703147 /nfs/dbraw/zinc/70/31/47/1021703147.db2.gz BEZYZEYXWCHLBG-XQRVVYSFSA-N 0 3 338.407 3.717 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC[C@]1(CO)C[C@H]1c1ccccc1 ZINC000894535311 1022497881 /nfs/dbraw/zinc/49/78/81/1022497881.db2.gz BNKCJQKMKZIDHH-WMZOPIPTSA-N 0 3 346.814 3.504 20 5 EHBDHN Cc1ccc(CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc1 ZINC000602686724 1033067654 /nfs/dbraw/zinc/06/76/54/1033067654.db2.gz GYPKKYDPXLPBOG-UHFFFAOYSA-N 0 3 339.317 3.649 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN(C[C@@H]1CCCO1)C1CCCC1 ZINC000441452440 1022867505 /nfs/dbraw/zinc/86/75/05/1022867505.db2.gz XFOQKKOKZYVICG-KRWDZBQOSA-N 0 3 334.416 3.527 20 5 EHBDHN C[C@@]1(CNCc2cc(Br)c([N+](=O)[O-])s2)CC1(F)F ZINC000602712513 1033097149 /nfs/dbraw/zinc/09/71/49/1033097149.db2.gz YXGDMDAANYDXSI-VIFPVBQESA-N 0 3 341.177 3.554 20 5 EHBDHN CCN(CCc1ccccc1)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000507173326 1023173640 /nfs/dbraw/zinc/17/36/40/1023173640.db2.gz LTGCBQRJTGQROI-UHFFFAOYSA-N 0 3 344.411 3.677 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(Cc2cccc(-n3cccn3)c2)C2CC2)c1 ZINC000507174507 1023174662 /nfs/dbraw/zinc/17/46/62/1023174662.db2.gz RPWCJMXEDXMRRM-UHFFFAOYSA-N 0 3 348.406 3.945 20 5 EHBDHN Cc1ccccc1CN1CCCN(c2ccsc2[N+](=O)[O-])CC1 ZINC000063258402 1033135418 /nfs/dbraw/zinc/13/54/18/1033135418.db2.gz DSDPXQBMLRJUJC-UHFFFAOYSA-N 0 3 331.441 3.677 20 5 EHBDHN COc1cccc([C@H]2C[C@H](N(C)Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC000449757498 1033147783 /nfs/dbraw/zinc/14/77/83/1033147783.db2.gz SFGTUMVRHRCMFA-QAQDUYKDSA-N 0 3 326.396 3.981 20 5 EHBDHN CCO[C@@H]1CCC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000449752910 1033168020 /nfs/dbraw/zinc/16/80/20/1033168020.db2.gz DUDXMZWZCXDEMR-SJLPKXTDSA-N 0 3 330.384 3.902 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CC[C@@H](c2ccc3cccnc3n2)C1 ZINC000602889969 1033244161 /nfs/dbraw/zinc/24/41/61/1033244161.db2.gz XROGWXZLYJIYCE-OAHLLOKOSA-N 0 3 334.379 3.528 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000515506209 1025317796 /nfs/dbraw/zinc/31/77/96/1025317796.db2.gz OZMQLTRNPRBWEU-CQSZACIVSA-N 0 3 341.411 3.707 20 5 EHBDHN Cc1c(CN2CC[C@H](COc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000505844010 1025859934 /nfs/dbraw/zinc/85/99/34/1025859934.db2.gz CSUXFGUWZZDHHW-INIZCTEOSA-N 0 3 326.396 3.804 20 5 EHBDHN CCc1nc(C)c(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451543464 1026091051 /nfs/dbraw/zinc/09/10/51/1026091051.db2.gz BWBWRMHGOSQJMI-HNNXBMFYSA-N 0 3 329.400 3.833 20 5 EHBDHN CC(C)N(C)c1ccc(CN(C)CCc2cccc([N+](=O)[O-])c2)cn1 ZINC000338956852 1026302293 /nfs/dbraw/zinc/30/22/93/1026302293.db2.gz BHLQMAYJMWHTOP-UHFFFAOYSA-N 0 3 342.443 3.509 20 5 EHBDHN CC1CCC(N(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000339221913 1026433640 /nfs/dbraw/zinc/43/36/40/1026433640.db2.gz OBUXLCBKMZSARU-UHFFFAOYSA-N 0 3 345.443 3.601 20 5 EHBDHN C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000563418287 1026790693 /nfs/dbraw/zinc/79/06/93/1026790693.db2.gz NVLNIOWGVDTDBA-UGSOOPFHSA-N 0 3 349.394 3.514 20 5 EHBDHN CC[C@@H]1CCCC[C@@H]1N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681885 1028150467 /nfs/dbraw/zinc/15/04/67/1028150467.db2.gz RULKDUNXTZRSIV-PBHICJAKSA-N 0 3 333.432 3.742 20 5 EHBDHN CC[C@H]1C[C@@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000421391331 1028367157 /nfs/dbraw/zinc/36/71/57/1028367157.db2.gz UAFNQWCTPWXDCW-BBRMVZONSA-N 0 3 347.440 3.766 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421791730 1028800309 /nfs/dbraw/zinc/80/03/09/1028800309.db2.gz KLNPCKKAOLVBHQ-UHFFFAOYSA-N 0 3 341.411 3.834 20 5 EHBDHN CCC[C@H]1[C@@H](C)CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066368 1029235200 /nfs/dbraw/zinc/23/52/00/1029235200.db2.gz WSJVREGQZGKCNL-GUYCJALGSA-N 0 3 334.416 3.862 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CCN(CCCOc1ccc(F)cc1)C2 ZINC000536004244 1029716527 /nfs/dbraw/zinc/71/65/27/1029716527.db2.gz PRFKUMLQESBJPU-UHFFFAOYSA-N 0 3 330.359 3.561 20 5 EHBDHN Cc1cccc(CCCNc2cc(C)nc3ccc([N+](=O)[O-])cc32)n1 ZINC000343223078 1029813484 /nfs/dbraw/zinc/81/34/84/1029813484.db2.gz HKSRXYDIQXASGE-UHFFFAOYSA-N 0 3 336.395 3.621 20 5 EHBDHN Cc1c([C@@H](C)NCc2ccccc2-n2ccnc2)cccc1[N+](=O)[O-] ZINC000152241894 1029840683 /nfs/dbraw/zinc/84/06/83/1029840683.db2.gz VFNZTLKEVVUTHF-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN COc1ccc(OCCN(Cc2cccs2)C2CC2)c([N+](=O)[O-])c1 ZINC000441262923 1030195315 /nfs/dbraw/zinc/19/53/15/1030195315.db2.gz WHECYKCPMBSGIG-UHFFFAOYSA-N 0 3 348.424 3.708 20 5 EHBDHN CO[C@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000550894738 1030774146 /nfs/dbraw/zinc/77/41/46/1030774146.db2.gz GOMVSSDVNMRYBR-RTBURBONSA-N 0 3 326.396 3.699 20 5 EHBDHN O=[N+]([O-])c1ccc2[nH]c(CNC3CC(c4ccc(F)cc4)C3)nc2c1 ZINC000278611110 1031640499 /nfs/dbraw/zinc/64/04/99/1031640499.db2.gz GPBISVRRMRRHKA-UHFFFAOYSA-N 0 3 340.358 3.646 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@H]3CO[C@H](C4CC4)C3)o2)c1 ZINC000599006385 1033640684 /nfs/dbraw/zinc/64/06/84/1033640684.db2.gz HTWYBDMZTYYTAF-KDOFPFPSSA-N 0 3 328.368 3.512 20 5 EHBDHN Cc1noc(CN2CCC[C@@](C)(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595484678 1033809765 /nfs/dbraw/zinc/80/97/65/1033809765.db2.gz MVSZBDSABIJPGH-GOSISDBHSA-N 0 3 329.400 3.835 20 5 EHBDHN C[C@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CCc2ccccc21 ZINC000593094823 1033932468 /nfs/dbraw/zinc/93/24/68/1033932468.db2.gz IJGQHBOYITZDCI-ZDUSSCGKSA-N 0 3 337.379 3.898 20 5 EHBDHN C[C@H](c1ccco1)N(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000411385616 1034879609 /nfs/dbraw/zinc/87/96/09/1034879609.db2.gz HCAUZYDAYGYABW-CYBMUJFWSA-N 0 3 343.383 3.742 20 5 EHBDHN C[C@H](c1ccc(Cl)c(Cl)c1)N(C)CCn1cc([N+](=O)[O-])cn1 ZINC000472440667 1035049984 /nfs/dbraw/zinc/04/99/84/1035049984.db2.gz RKIXTIRDPHMKCG-SNVBAGLBSA-N 0 3 343.214 3.791 20 5 EHBDHN O=[N+]([O-])c1ccsc1N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1 ZINC000588072496 1035700269 /nfs/dbraw/zinc/70/02/69/1035700269.db2.gz RGCMIFZMAOVAAN-GOSISDBHSA-N 0 3 343.452 3.759 20 5 EHBDHN C[C@]12CN(Cc3nc4cc([N+](=O)[O-])ccc4o3)C[C@@H]1[C@@H]1CC[C@H]2C1 ZINC000582401932 1035751298 /nfs/dbraw/zinc/75/12/98/1035751298.db2.gz PVUKRJFHFOXQEH-AZGFTEDZSA-N 0 3 327.384 3.604 20 5 EHBDHN CC(C)[C@H]1CCCC[C@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000460361951 1036018430 /nfs/dbraw/zinc/01/84/30/1036018430.db2.gz JCMTYGUMJAHMCV-HZPDHXFCSA-N 0 3 344.415 3.949 20 5 EHBDHN CC(C)C[C@@H]1CCCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000130238590 1037038569 /nfs/dbraw/zinc/03/85/69/1037038569.db2.gz PPBILQSUFGLROC-HNNXBMFYSA-N 0 3 330.388 3.655 20 5 EHBDHN CC[C@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000341187524 1037743955 /nfs/dbraw/zinc/74/39/55/1037743955.db2.gz CUPAKXDAOCTMFW-HOCLYGCPSA-N 0 3 341.411 3.971 20 5 EHBDHN COCC1(NCc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)CCC1 ZINC000341357507 1038011123 /nfs/dbraw/zinc/01/11/23/1038011123.db2.gz QWHGPHJVTBBHDA-UHFFFAOYSA-N 0 3 346.383 3.522 20 5 EHBDHN C[C@H](NCc1ccccc1-c1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000378404937 1038592278 /nfs/dbraw/zinc/59/22/78/1038592278.db2.gz QLGYLBOYRWVUCD-AWEZNQCLSA-N 0 3 336.395 3.846 20 5 EHBDHN CC[C@]1(CO)CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000190214058 1038696915 /nfs/dbraw/zinc/69/69/15/1038696915.db2.gz QRXPFWSASVQAFD-IBGZPJMESA-N 0 3 344.411 3.839 20 5 EHBDHN C[C@H](C[C@H](O)c1cccs1)NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893268737 1038910503 /nfs/dbraw/zinc/91/05/03/1038910503.db2.gz YMZXDHSOBBCZGY-YGRLFVJLSA-N 0 3 340.832 3.912 20 5 EHBDHN C[C@@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)C1 ZINC000246585137 1038912844 /nfs/dbraw/zinc/91/28/44/1038912844.db2.gz GHVULNVRYMBPBZ-OLZOCXBDSA-N 0 3 330.388 3.513 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCc2nc3ccccc3s2)c(F)c1 ZINC000479984970 1038972873 /nfs/dbraw/zinc/97/28/73/1038972873.db2.gz QEOGNYVVCDZPOR-UHFFFAOYSA-N 0 3 331.372 3.676 20 5 EHBDHN COc1ccccc1C1(CNCc2csc([N+](=O)[O-])c2)CCC1 ZINC000185293957 1039067522 /nfs/dbraw/zinc/06/75/22/1039067522.db2.gz CXAMQJYNXQAKOW-UHFFFAOYSA-N 0 3 332.425 3.876 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@@H]3CCSC3)cs2)c1 ZINC000279941937 1039593303 /nfs/dbraw/zinc/59/33/03/1039593303.db2.gz JKGBXMGACQUEAW-NSHDSACASA-N 0 3 335.454 3.561 20 5 EHBDHN CN(C)[C@H]1CCOc2c(Nc3ncc(Cl)cc3[N+](=O)[O-])cccc21 ZINC000432927121 1040196771 /nfs/dbraw/zinc/19/67/71/1040196771.db2.gz GASUSMYISVCPIF-ZDUSSCGKSA-N 0 3 348.790 3.772 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCN2CC=CCC2)c2ccccc2)c1 ZINC000479526427 1040323454 /nfs/dbraw/zinc/32/34/54/1040323454.db2.gz MJOWCBPRGPLYFH-HXUWFJFHSA-N 0 3 337.423 3.536 20 5 EHBDHN CC[C@@H](N[C@H](C)c1ccc2[nH]c(=O)[nH]c2c1)c1cccc([N+](=O)[O-])c1 ZINC000123090414 1040482409 /nfs/dbraw/zinc/48/24/09/1040482409.db2.gz GECKAYUMESDVBT-IAQYHMDHSA-N 0 3 340.383 3.566 20 5 EHBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCCO1 ZINC000511657386 1040862312 /nfs/dbraw/zinc/86/23/12/1040862312.db2.gz QOJASFGGEHBTHB-MRXNPFEDSA-N 0 3 330.384 3.856 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC2CCC(O)(c3ccccc3)CC2)c(F)c1 ZINC000760645060 1041039005 /nfs/dbraw/zinc/03/90/05/1041039005.db2.gz ATLPJPHOJAJXNX-UHFFFAOYSA-N 0 3 344.386 3.654 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@H]2CCCN(c3ccccc3)C2)c(F)c1 ZINC000433199007 1041050617 /nfs/dbraw/zinc/05/06/17/1041050617.db2.gz JDJHCSAEDDGPAL-OAHLLOKOSA-N 0 3 343.402 3.740 20 5 EHBDHN CC1(C)CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCC[C@@H]21 ZINC000555721464 1041059494 /nfs/dbraw/zinc/05/94/94/1041059494.db2.gz REJPPJATMIELLI-GJZGRUSLSA-N 0 3 342.399 3.655 20 5 EHBDHN C[C@@H]1CCC[C@@H](NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000249370352 1041131188 /nfs/dbraw/zinc/13/11/88/1041131188.db2.gz AOTOWFIEKIJMBT-TYNCELHUSA-N 0 3 330.388 3.559 20 5 EHBDHN CC[C@@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CC1(C)C ZINC000419314212 1041253248 /nfs/dbraw/zinc/25/32/48/1041253248.db2.gz HOLVBZFZVWIMCZ-ZIAGYGMSSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@H](NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccn1 ZINC000181771124 1042082775 /nfs/dbraw/zinc/08/27/75/1042082775.db2.gz BVVWNHMFLIEBCQ-ZDUSSCGKSA-N 0 3 338.367 3.538 20 5 EHBDHN Cc1nc2c(s1)[C@@H](N(C)CCOc1cccc([N+](=O)[O-])c1)CCC2 ZINC000111310836 1042259505 /nfs/dbraw/zinc/25/95/05/1042259505.db2.gz ABUTZKAZXIPZSN-INIZCTEOSA-N 0 3 347.440 3.748 20 5 EHBDHN CN(C)[C@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1cccs1 ZINC000432320361 1042853798 /nfs/dbraw/zinc/85/37/98/1042853798.db2.gz OAFIBMCAXIMKPF-OAHLLOKOSA-N 0 3 342.424 3.919 20 5 EHBDHN C[C@@H]1CN(CCCCNc2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000432325860 1042906378 /nfs/dbraw/zinc/90/63/78/1042906378.db2.gz NCEADUSMRASLKE-BETUJISGSA-N 0 3 341.839 3.550 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC(c3ccccc3)CC2)c1 ZINC000178570631 1044648141 /nfs/dbraw/zinc/64/81/41/1044648141.db2.gz NQQMGSMVBCGTBV-IBGZPJMESA-N 0 3 326.396 3.508 20 5 EHBDHN CC[C@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000192493380 1126896901 /nfs/dbraw/zinc/89/69/01/1126896901.db2.gz UUJJFHVAEPMLFP-SFHVURJKSA-N 0 3 341.411 3.607 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000139654786 1127434948 /nfs/dbraw/zinc/43/49/48/1127434948.db2.gz KRVOQAJJHWMETL-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@H](c2ccc(F)cc2F)C2CC2)cc1 ZINC001168541068 1127615731 /nfs/dbraw/zinc/61/57/31/1127615731.db2.gz FVSWUSMJWJACQR-SFHVURJKSA-N 0 3 348.349 3.993 20 5 EHBDHN Cc1ccnc(NC[C@@H](c2ccccc2)N2CCCC2)c1[N+](=O)[O-] ZINC000301279635 1127622916 /nfs/dbraw/zinc/62/29/16/1127622916.db2.gz JRLGNHCNRJCGNA-INIZCTEOSA-N 0 3 326.400 3.547 20 5 EHBDHN Cc1ccnc(NC[C@@H](c2ccc(Cl)cc2)N(C)C)c1[N+](=O)[O-] ZINC000301484129 1128473392 /nfs/dbraw/zinc/47/33/92/1128473392.db2.gz VCFOXFYUTYBQLT-AWEZNQCLSA-N 0 3 334.807 3.666 20 5 EHBDHN C[C@@H]1CCC[C@H](NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000193327938 1121114364 /nfs/dbraw/zinc/11/43/64/1121114364.db2.gz AOTOWFIEKIJMBT-JMSVASOKSA-N 0 3 330.388 3.559 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@H]2CCCN2Cc2ccccc2)c(F)c1 ZINC000390707006 1129017602 /nfs/dbraw/zinc/01/76/02/1129017602.db2.gz RQSNQXTXBUBVME-MRXNPFEDSA-N 0 3 329.375 3.810 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H](c1ccccc1)C1CC1 ZINC000194552447 1122739864 /nfs/dbraw/zinc/73/98/64/1122739864.db2.gz PZYVCUKEUVWPNK-IBGZPJMESA-N 0 3 339.395 3.583 20 5 EHBDHN COc1ccc(-c2ccc(CN(C)[C@@H]3CCSC3)o2)c([N+](=O)[O-])c1 ZINC000130566112 1122777414 /nfs/dbraw/zinc/77/74/14/1122777414.db2.gz FAARRBCIBVTZCQ-GFCCVEGCSA-N 0 3 348.424 3.801 20 5 EHBDHN CC(C)CCOC1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000195198282 1123249867 /nfs/dbraw/zinc/24/98/67/1123249867.db2.gz WBZWKFWLEORWLO-UHFFFAOYSA-N 0 3 336.432 3.501 20 5 EHBDHN CC1(C)CN(Cc2ccccc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000078516976 1129154519 /nfs/dbraw/zinc/15/45/19/1129154519.db2.gz OHCKWLWQRCIUEZ-UHFFFAOYSA-N 0 3 339.439 3.691 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@H](CO)CC2CCCC2)c(Cl)c1 ZINC000466409869 1129428735 /nfs/dbraw/zinc/42/87/35/1129428735.db2.gz OZWZKCXUNSKJDW-CYBMUJFWSA-N 0 3 326.824 3.527 20 5 EHBDHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032642 1129764293 /nfs/dbraw/zinc/76/42/93/1129764293.db2.gz SPQUPQLHOYTZMS-DZGCQCFKSA-N 0 3 331.441 3.979 20 5 EHBDHN Cc1n[nH]cc1CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000171384370 1130050595 /nfs/dbraw/zinc/05/05/95/1130050595.db2.gz BVNKFYRMCKLASM-UHFFFAOYSA-N 0 3 328.397 3.645 20 5 EHBDHN CCN(CC)[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000173363621 1130219336 /nfs/dbraw/zinc/21/93/36/1130219336.db2.gz MYYMDQJYYMCLPG-WMLDXEAASA-N 0 3 331.416 3.922 20 5 EHBDHN C[C@H](NC[C@@H](c1c(F)cccc1F)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173419129 1130228081 /nfs/dbraw/zinc/22/80/81/1130228081.db2.gz SLTHKKUGMNNEBO-SJCJKPOMSA-N 0 3 349.381 3.827 20 5 EHBDHN C[C@@H](c1ccc(Cl)cc1)N(CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000174831167 1130386242 /nfs/dbraw/zinc/38/62/42/1130386242.db2.gz PDIBPQNVRMVQPY-LBPRGKRZSA-N 0 3 334.807 3.670 20 5 EHBDHN CCOC(=O)CC[C@@H]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246532328 1130390527 /nfs/dbraw/zinc/39/05/27/1130390527.db2.gz CNUYOTNLQMSFMT-CABCVRRESA-N 0 3 334.416 3.711 20 5 EHBDHN O=[N+]([O-])c1ccc2c(cnn2CN2CCC[C@]3(CC=CCC3)C2)c1 ZINC000733992027 1131180651 /nfs/dbraw/zinc/18/06/51/1131180651.db2.gz LNCZXIRPJQYIKR-GOSISDBHSA-N 0 3 326.400 3.724 20 5 EHBDHN CCCCN(CCCC)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742144603 1131690644 /nfs/dbraw/zinc/69/06/44/1131690644.db2.gz FAUMKAZMSAUITQ-UHFFFAOYSA-N 0 3 331.420 3.713 20 5 EHBDHN CCC[C@@H]1[C@H](C)CCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743380843 1131907407 /nfs/dbraw/zinc/90/74/07/1131907407.db2.gz SZYDYGVHTNKFKH-RHSMWYFYSA-N 0 3 343.431 3.711 20 5 EHBDHN Cc1ccc(C(=O)CN[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172912045 1131917931 /nfs/dbraw/zinc/91/79/31/1131917931.db2.gz LMXSFYPHOLFHNP-GOSISDBHSA-N 0 3 338.407 3.623 20 5 EHBDHN Cc1ccc(CN[C@H](C)c2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] ZINC000743498755 1131930530 /nfs/dbraw/zinc/93/05/30/1131930530.db2.gz RZAYYNXOJXSMCJ-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N[C@@H](C)c2ccc(C)cn2)c1F ZINC001173187404 1131993303 /nfs/dbraw/zinc/99/33/03/1131993303.db2.gz FFDZESAXMUPUPD-OLZOCXBDSA-N 0 3 347.390 3.728 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H](CO)c1ccccc1Cl ZINC001173225555 1132006338 /nfs/dbraw/zinc/00/63/38/1132006338.db2.gz RRROGRDBLGAUEU-YVEFUNNKSA-N 0 3 334.803 3.502 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)NCc1cc(-c2ccccc2)on1 ZINC001173235877 1132010676 /nfs/dbraw/zinc/01/06/76/1132010676.db2.gz VPUDHQHHXQQIGS-CQSZACIVSA-N 0 3 337.379 3.971 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NCc1nc2ccccc2s1 ZINC001173212087 1132014361 /nfs/dbraw/zinc/01/43/61/1132014361.db2.gz WOYRJPDWQGBUOA-LBPRGKRZSA-N 0 3 327.409 3.925 20 5 EHBDHN Cc1nn(CN(CCc2ccc(F)cc2)CC(C)C)c(C)c1[N+](=O)[O-] ZINC000746065304 1132364257 /nfs/dbraw/zinc/36/42/57/1132364257.db2.gz CNQYLERQTYIPTG-UHFFFAOYSA-N 0 3 348.422 3.705 20 5 EHBDHN C[C@H](c1ccccc1)[C@@H](CO)NCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000766967253 1132924534 /nfs/dbraw/zinc/92/45/34/1132924534.db2.gz IGQNOMCBQIYNBI-MLGOLLRUSA-N 0 3 334.803 3.502 20 5 EHBDHN C[C@@H]1CCC[C@H]1CNCc1c(Br)cccc1[N+](=O)[O-] ZINC001178558034 1133181354 /nfs/dbraw/zinc/18/13/54/1133181354.db2.gz WZZVXNVXEDJJGQ-MNOVXSKESA-N 0 3 327.222 3.883 20 5 EHBDHN CC(C)[C@H](NCc1ccc([N+](=O)[O-])cc1F)[C@@H](O)c1ccccc1 ZINC000788537326 1134138640 /nfs/dbraw/zinc/13/86/40/1134138640.db2.gz JHXSKLJVBLQITR-ROUUACIJSA-N 0 3 332.375 3.582 20 5 EHBDHN CC(C)C[C@]1(CO)CCCN1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000789508203 1134287836 /nfs/dbraw/zinc/28/78/36/1134287836.db2.gz ZUZYNILOULPDBO-INIZCTEOSA-N 0 3 326.824 3.621 20 5 EHBDHN CC(C)C[C@]1(CO)CCCN1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000789513472 1134289241 /nfs/dbraw/zinc/28/92/41/1134289241.db2.gz JZJGWRUGQURPFT-INIZCTEOSA-N 0 3 326.824 3.621 20 5 EHBDHN COc1ccc(C[C@@H](C)N(Cc2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC001170352869 1134754416 /nfs/dbraw/zinc/75/44/16/1134754416.db2.gz SIFBYIAYZFONLV-CYBMUJFWSA-N 0 3 330.384 3.792 20 5 EHBDHN CCC[C@H](NCc1ccc([N+](=O)[O-])cc1F)[C@@H](O)c1ccccc1 ZINC000793239061 1134886243 /nfs/dbraw/zinc/88/62/43/1134886243.db2.gz QJWPSNUTAPMPAD-ROUUACIJSA-N 0 3 332.375 3.726 20 5 EHBDHN CC[C@@H](C)N[C@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccco1 ZINC000804784281 1135199749 /nfs/dbraw/zinc/19/97/49/1135199749.db2.gz ZMCVOHGOQVPRDR-BXUZGUMPSA-N 0 3 348.359 3.637 20 5 EHBDHN CC(C)(C)OC(=O)CC[C@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC001195233623 1135389881 /nfs/dbraw/zinc/38/98/81/1135389881.db2.gz KDHWGDORZBMWJR-OAHLLOKOSA-N 0 3 348.443 3.929 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2cnn(CN3CCC[C@@H](C4CC4)C3)c2)cc1 ZINC000808231189 1135634047 /nfs/dbraw/zinc/63/40/47/1135634047.db2.gz ZLZYIVXLDLZYJV-MRXNPFEDSA-N 0 3 326.400 3.538 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H](CO)C1CCCCC1 ZINC000809974245 1135907227 /nfs/dbraw/zinc/90/72/27/1135907227.db2.gz QGDZZNBAFVTBQZ-CQSZACIVSA-N 0 3 347.242 3.932 20 5 EHBDHN CC[C@@H](NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCCO1 ZINC000809975716 1135907289 /nfs/dbraw/zinc/90/72/89/1135907289.db2.gz SIPIMPVNJOVDJP-CHWSQXEVSA-N 0 3 333.215 3.949 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCc1ccc(O)cc1 ZINC000811476826 1136096351 /nfs/dbraw/zinc/09/63/51/1136096351.db2.gz SVFPGIHNFXBTKH-UHFFFAOYSA-N 0 3 341.194 3.940 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2COC3(CCC3)C2)o1 ZINC000850367457 1136242593 /nfs/dbraw/zinc/24/25/93/1136242593.db2.gz JUCGPFOXTPKUGG-ZDUSSCGKSA-N 0 3 328.368 3.656 20 5 EHBDHN CC(COC(=O)c1ccccc1OCc1ccc(Cl)cc1)[N+](=O)[O-] ZINC000813101463 1136287525 /nfs/dbraw/zinc/28/75/25/1136287525.db2.gz AVPKVQURFDIOGR-GFCCVEGCSA-N 0 3 349.770 3.741 20 5 EHBDHN CC(COC(=O)[C@H](Sc1ccccc1)c1ccccc1)[N+](=O)[O-] ZINC000813105242 1136293817 /nfs/dbraw/zinc/29/38/17/1136293817.db2.gz XBDQMQCCJZWMTF-XJKSGUPXSA-N 0 3 331.393 3.728 20 5 EHBDHN CC(COC(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1)[N+](=O)[O-] ZINC000813110845 1136293888 /nfs/dbraw/zinc/29/38/88/1136293888.db2.gz KPVUWDCAOLUNFG-SECBINFHSA-N 0 3 332.183 3.624 20 5 EHBDHN CC(COC(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)[N+](=O)[O-] ZINC000813110816 1136294035 /nfs/dbraw/zinc/29/40/35/1136294035.db2.gz JZJZCSBAYCIVCE-VIFPVBQESA-N 0 3 343.257 3.787 20 5 EHBDHN CC(COC(=O)C1(Cc2cccc(Cl)c2)CCCC1)[N+](=O)[O-] ZINC000813107793 1136294232 /nfs/dbraw/zinc/29/42/32/1136294232.db2.gz WNYXNZLZCVABQT-GFCCVEGCSA-N 0 3 325.792 3.651 20 5 EHBDHN CCS[C@H](C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-])C(C)C ZINC000845878115 1137316487 /nfs/dbraw/zinc/31/64/87/1137316487.db2.gz ULCDRUDAXANQEF-CQDKDKBSSA-N 0 3 343.420 3.853 20 5 EHBDHN CC([C@@H](OC(=O)[C@H](C)c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881191 1137316844 /nfs/dbraw/zinc/31/68/44/1137316844.db2.gz ZENLTFVNDZVPQR-PBFPGSCMSA-N 0 3 331.343 3.879 20 5 EHBDHN CC([C@H](OC(=O)C[C@@H](C)c1ccncc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881163 1137316864 /nfs/dbraw/zinc/31/68/64/1137316864.db2.gz YPPPTEJNMJUCAX-VBHSOAQHSA-N 0 3 346.358 3.664 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H](C)c1cccs1)c1ccccc1F)[N+](=O)[O-] ZINC000845880652 1137316880 /nfs/dbraw/zinc/31/68/80/1137316880.db2.gz XNZMEGOZLPCYFT-FIXISWKDSA-N 0 3 337.372 3.940 20 5 EHBDHN CC([C@H](OC(=O)[C@@H]1C[C@H]1c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882207 1137317213 /nfs/dbraw/zinc/31/72/13/1137317213.db2.gz NWJZSXCVXTXKJA-UOUZQGKXSA-N 0 3 343.354 3.879 20 5 EHBDHN CC([C@@H](OC(=O)[C@H](C)CC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845883765 1137317237 /nfs/dbraw/zinc/31/72/37/1137317237.db2.gz VUFKYQPCMOTCJO-VDDIYKPWSA-N 0 3 337.269 3.664 20 5 EHBDHN C[C@H](N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872057566 1137568652 /nfs/dbraw/zinc/56/86/52/1137568652.db2.gz GBQFDZKXLMIHHJ-JQHQGBHXSA-N 0 3 334.391 3.732 20 5 EHBDHN C[C@H](CC(=O)Nc1ccccc1)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129590 1137573053 /nfs/dbraw/zinc/57/30/53/1137573053.db2.gz QLOMZECIFYVOHZ-KGLIPLIRSA-N 0 3 327.384 3.663 20 5 EHBDHN C[C@]1(CCNCc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@]1(F)Cl ZINC000877610952 1137682796 /nfs/dbraw/zinc/68/27/96/1137682796.db2.gz MRZOESBOUUGAMA-KBPBESRZSA-N 0 3 327.743 3.530 20 5 EHBDHN C[C@H]1CC(C)(C)CC[C@@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447923 1137716486 /nfs/dbraw/zinc/71/64/86/1137716486.db2.gz OVZLGIYKROZIIL-JSGCOSHPSA-N 0 3 344.415 3.949 20 5 EHBDHN C[C@@H]1C[C@@H](C)[C@H](C)N(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497113 1137718035 /nfs/dbraw/zinc/71/80/35/1137718035.db2.gz QTVGNSHLRMFMIN-UPJWGTAASA-N 0 3 330.388 3.511 20 5 EHBDHN CC(C)N(Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)CC1CCC1 ZINC000878516650 1137718671 /nfs/dbraw/zinc/71/86/71/1137718671.db2.gz UJABZBRTNFOACM-UHFFFAOYSA-N 0 3 330.388 3.655 20 5 EHBDHN CN(C)C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000282865591 1137889788 /nfs/dbraw/zinc/88/97/88/1137889788.db2.gz QQTBWHXXMDYZOK-KRWDZBQOSA-N 0 3 333.819 3.641 20 5 EHBDHN CC(C)N(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCC1 ZINC000068449345 1138085059 /nfs/dbraw/zinc/08/50/59/1138085059.db2.gz UEGWBRNIVWIWKB-UHFFFAOYSA-N 0 3 330.388 3.798 20 5 EHBDHN Cc1nc(C2CCN(Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)[nH]c1C ZINC000886664462 1138111218 /nfs/dbraw/zinc/11/12/18/1138111218.db2.gz NIZSHWOPIXIOQX-UHFFFAOYSA-N 0 3 348.834 3.968 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000091957895 1138223367 /nfs/dbraw/zinc/22/33/67/1138223367.db2.gz VRBOJDGOILLOBB-RIGVPDNZSA-N 0 3 342.395 3.789 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@H](C)C[C@H](C)C1 ZINC000263802840 1138370448 /nfs/dbraw/zinc/37/04/48/1138370448.db2.gz WIKUAGQISFWWMG-FRRDWIJNSA-N 0 3 330.388 3.684 20 5 EHBDHN C[C@H](NC[C@H]1COC2(CCCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777316148 1139577065 /nfs/dbraw/zinc/57/70/65/1139577065.db2.gz RSGAYGHEGXUSJG-YOEHRIQHSA-N 0 3 334.416 3.711 20 5 EHBDHN CCCCNC(=O)C1CCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000182590431 1139981429 /nfs/dbraw/zinc/98/14/29/1139981429.db2.gz APLUHPKJACTXSL-OAHLLOKOSA-N 0 3 347.459 3.593 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ccc3c(c1)OCCO3)CCC2 ZINC000192603349 1140539419 /nfs/dbraw/zinc/53/94/19/1140539419.db2.gz XHPAQZLIABUUGE-KRWDZBQOSA-N 0 3 340.379 3.533 20 5 EHBDHN CCCNc1ccc(CNCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000193152094 1140565142 /nfs/dbraw/zinc/56/51/42/1140565142.db2.gz UBTJFISJTHTFIB-UHFFFAOYSA-N 0 3 329.400 3.715 20 5 EHBDHN COc1cc(CN[C@@H]2CCC2(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000349037210 1141626342 /nfs/dbraw/zinc/62/63/42/1141626342.db2.gz RBPZUPRDUISFJB-CQSZACIVSA-N 0 3 344.358 3.526 20 5 EHBDHN COc1ccc(CN(Cc2ccc(O)cc2)CC2CC2)cc1[N+](=O)[O-] ZINC000349063075 1141631870 /nfs/dbraw/zinc/63/18/70/1141631870.db2.gz OVADXXSCOVPYGV-UHFFFAOYSA-N 0 3 342.395 3.721 20 5 EHBDHN CCOC(=O)C(C)(C)C1CCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000510077040 1014724696 /nfs/dbraw/zinc/72/46/96/1014724696.db2.gz AHTPXUJEWZKSAK-AWEZNQCLSA-N 0 3 348.443 3.957 20 5 EHBDHN CC[C@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000340152023 1016487117 /nfs/dbraw/zinc/48/71/17/1016487117.db2.gz IXEATXZKRJCMPF-KDOFPFPSSA-N 0 3 341.411 3.971 20 5 EHBDHN CC1(C)CN(Cc2cc(=O)oc3ccc4ccccc4c23)CC[C@H]1O ZINC000275435423 1016772040 /nfs/dbraw/zinc/77/20/40/1016772040.db2.gz JPPADSZWJPZAOK-GOSISDBHSA-N 0 3 337.419 3.539 20 5 EHBDHN COc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000449350802 1032465411 /nfs/dbraw/zinc/46/54/11/1032465411.db2.gz WKMYQYYEKMNKGT-ZDUSSCGKSA-N 0 3 330.384 3.771 20 5 EHBDHN CCC[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCC1 ZINC000459807922 1032483390 /nfs/dbraw/zinc/48/33/90/1032483390.db2.gz RPQVSKZHRHIDIE-HNNXBMFYSA-N 0 3 330.388 3.703 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1 ZINC000118838191 1017644003 /nfs/dbraw/zinc/64/40/03/1017644003.db2.gz ZRTIPLXTWQWQSK-UHFFFAOYSA-N 0 3 336.395 3.851 20 5 EHBDHN C[C@H]1CCN(c2ccc([N+](=O)[O-])s2)CCN1Cc1ccccc1 ZINC000610284395 1017685051 /nfs/dbraw/zinc/68/50/51/1017685051.db2.gz YCRPVESVRYBZPC-AWEZNQCLSA-N 0 3 331.441 3.757 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548010021 1018197094 /nfs/dbraw/zinc/19/70/94/1018197094.db2.gz BSXIIFICMOXOGP-RHSMWYFYSA-N 0 3 340.427 3.678 20 5 EHBDHN CC[C@@H](C)CN(CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000177855560 1020214208 /nfs/dbraw/zinc/21/42/08/1020214208.db2.gz DDLCOMAYZDYNNC-LLVKDONJSA-N 0 3 327.812 3.555 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CCC[C@H]2COCC[C@H]21 ZINC000602485461 1032913069 /nfs/dbraw/zinc/91/30/69/1032913069.db2.gz QRDDEVWPNMBQBA-GXTWGEPZSA-N 0 3 344.333 3.615 20 5 EHBDHN COc1ccc(CN2CC[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507667347 1021424772 /nfs/dbraw/zinc/42/47/72/1021424772.db2.gz URZYPFCWOPBDPA-KRWDZBQOSA-N 0 3 326.396 3.668 20 5 EHBDHN COc1ccc2c(c1)CCN(C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000439778846 1021704024 /nfs/dbraw/zinc/70/40/24/1021704024.db2.gz BEZYZEYXWCHLBG-GQCTYLIASA-N 0 3 338.407 3.717 20 5 EHBDHN CC[C@](C)(COc1ncccc1Cl)NCc1ccccc1[N+](=O)[O-] ZINC000441306994 1022140444 /nfs/dbraw/zinc/14/04/44/1022140444.db2.gz KUEPYYCATSKLJE-QGZVFWFLSA-N 0 3 349.818 3.981 20 5 EHBDHN CC(C)[C@@H]1CCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498570 1022727791 /nfs/dbraw/zinc/72/77/91/1022727791.db2.gz YFWBLTLOKRLXGT-GXTWGEPZSA-N 0 3 330.388 3.684 20 5 EHBDHN C[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCCC[C@@H]21 ZINC000248417902 1023260503 /nfs/dbraw/zinc/26/05/03/1023260503.db2.gz JXUAFBHIIUQWAD-DAXOMENPSA-N 0 3 342.399 3.655 20 5 EHBDHN CCO[C@@H]1CCC[C@H]1NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000449755673 1033172695 /nfs/dbraw/zinc/17/26/95/1033172695.db2.gz NXXYPTLGLUDKTF-SJLPKXTDSA-N 0 3 330.384 3.902 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CNC1(c2ccc3c(c2)OCO3)CC1 ZINC000538423815 1024346351 /nfs/dbraw/zinc/34/63/51/1024346351.db2.gz RBTYAUZQDUPLJL-HWKANZROSA-N 0 3 338.363 3.616 20 5 EHBDHN CCN(CC)[C@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000346404118 1024722852 /nfs/dbraw/zinc/72/28/52/1024722852.db2.gz PYLOXXMDCYNEQN-CYBMUJFWSA-N 0 3 338.795 3.731 20 5 EHBDHN O=[N+]([O-])c1sc(CN[C@@H]2C[C@H]3CCC[C@@H]32)cc1Br ZINC000897958707 1033258785 /nfs/dbraw/zinc/25/87/85/1033258785.db2.gz MHSGWLQUHKNQQL-POZPLHJXSA-N 0 3 331.235 3.697 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(CCN(C)C)C1CCCC1 ZINC000119952162 1025484340 /nfs/dbraw/zinc/48/43/40/1025484340.db2.gz YFBYIIZSWFSXOZ-UHFFFAOYSA-N 0 3 348.447 3.550 20 5 EHBDHN Cc1cc(CO)cc(C)c1CNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000896561979 1025607497 /nfs/dbraw/zinc/60/74/97/1025607497.db2.gz RNGCUAXERROESQ-UHFFFAOYSA-N 0 3 334.803 3.647 20 5 EHBDHN CCC(=O)c1ccc(N[C@@H]2CCN(C3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000479970958 1026919796 /nfs/dbraw/zinc/91/97/96/1026919796.db2.gz QMSXLSUAIUKGOO-CQSZACIVSA-N 0 3 331.416 3.616 20 5 EHBDHN Cc1csc(C2(N[C@H](C)Cc3ccccc3[N+](=O)[O-])CCC2)n1 ZINC000453173618 1027493789 /nfs/dbraw/zinc/49/37/89/1027493789.db2.gz KVCOSQPUOCCVFA-GFCCVEGCSA-N 0 3 331.441 3.960 20 5 EHBDHN CC[C@@H]1CCCC[C@H]1N(C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680972 1028150715 /nfs/dbraw/zinc/15/07/15/1028150715.db2.gz XWJDRIGGGIGOOL-RHSMWYFYSA-N 0 3 333.432 3.742 20 5 EHBDHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000074040800 1028594623 /nfs/dbraw/zinc/59/46/23/1028594623.db2.gz WMAOYQSITCIFSY-UHFFFAOYSA-N 0 3 339.351 3.655 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@H]3CC[C@@H](C)O3)o2)c([N+](=O)[O-])c1 ZINC000453631585 1030433717 /nfs/dbraw/zinc/43/37/17/1030433717.db2.gz OAMWBRBKAKUCFQ-TZMCWYRMSA-N 0 3 346.383 3.521 20 5 EHBDHN Cc1cccc([C@H]2CCCN2CCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000160082745 1030525117 /nfs/dbraw/zinc/52/51/17/1030525117.db2.gz ISJMEQPLZLDLHT-GOSISDBHSA-N 0 3 327.384 3.514 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@@H]2CCOC2)ccc1Oc1ccccc1Cl ZINC000178996007 1031060026 /nfs/dbraw/zinc/06/00/26/1031060026.db2.gz GRXPWEWJFOTMSU-CYBMUJFWSA-N 0 3 348.786 3.919 20 5 EHBDHN CCS[C@H]1CC[C@H](N(C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293224 1033575224 /nfs/dbraw/zinc/57/52/24/1033575224.db2.gz TUIYLQZGPKCQBV-ZFWWWQNUSA-N 0 3 348.472 3.816 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H](Cc1ccccc1)OC ZINC000595043247 1033662128 /nfs/dbraw/zinc/66/21/28/1033662128.db2.gz VNZOECWUPMQWSG-WMLDXEAASA-N 0 3 344.411 3.512 20 5 EHBDHN CO[C@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000599016359 1033665627 /nfs/dbraw/zinc/66/56/27/1033665627.db2.gz RIPGZXSIBXZQPE-MJHDQNEOSA-N 0 3 336.775 3.775 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NCC2CCN(Cc3ccncc3)CC2)c1 ZINC000596443513 1034247276 /nfs/dbraw/zinc/24/72/76/1034247276.db2.gz YVDRIOUYEYXECV-UHFFFAOYSA-N 0 3 340.427 3.622 20 5 EHBDHN CCOc1cc(CN2CCC[C@H](c3ccncc3)C2)ccc1[N+](=O)[O-] ZINC000451007155 1035025935 /nfs/dbraw/zinc/02/59/35/1035025935.db2.gz SQDBNSHQAHRVLN-KRWDZBQOSA-N 0 3 341.411 3.768 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCCn2ccnc2)c2ccccc2)c1 ZINC000179963807 1035095416 /nfs/dbraw/zinc/09/54/16/1035095416.db2.gz BWPUXWHXTTXJFX-LJQANCHMSA-N 0 3 336.395 3.561 20 5 EHBDHN COc1ccc([C@H](C)NCc2ccc(OC)c([N+](=O)[O-])c2)c(C)c1 ZINC000414084782 1035465591 /nfs/dbraw/zinc/46/55/91/1035465591.db2.gz XTJPXWGULLFYGL-ZDUSSCGKSA-N 0 3 330.384 3.771 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000534706573 1035503398 /nfs/dbraw/zinc/50/33/98/1035503398.db2.gz QVAMQLBUJOUIMA-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN O=[N+]([O-])c1ccsc1N1CC[C@]2(CCN(Cc3ccccc3)C2)C1 ZINC000588072497 1035699906 /nfs/dbraw/zinc/69/99/06/1035699906.db2.gz RGCMIFZMAOVAAN-SFHVURJKSA-N 0 3 343.452 3.759 20 5 EHBDHN Cc1ccc([C@H](C)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000056201703 1036139659 /nfs/dbraw/zinc/13/96/59/1036139659.db2.gz NWINZMQIQHUXKZ-UONOGXRCSA-N 0 3 327.384 3.581 20 5 EHBDHN CCOc1cc(CN(C)CC2(O)CCCCCC2)ccc1[N+](=O)[O-] ZINC000492819560 1036320949 /nfs/dbraw/zinc/32/09/49/1036320949.db2.gz SOYUMLVQBRQPDC-UHFFFAOYSA-N 0 3 336.432 3.511 20 5 EHBDHN Cc1ccc(CNC[C@]2(C)OCCc3sccc32)cc1[N+](=O)[O-] ZINC000589325776 1036343742 /nfs/dbraw/zinc/34/37/42/1036343742.db2.gz YBDBHLMVHGTSSF-KRWDZBQOSA-N 0 3 332.425 3.542 20 5 EHBDHN C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000026227442 1036399747 /nfs/dbraw/zinc/39/97/47/1036399747.db2.gz DZDUWKCDOAMESU-GFCCVEGCSA-N 0 3 347.802 3.928 20 5 EHBDHN C[C@H](O)C[C@H](C)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180601054 1036984269 /nfs/dbraw/zinc/98/42/69/1036984269.db2.gz YRPNWGWIWNQGAB-DOXZYTNZSA-N 0 3 328.412 3.681 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CNC2(c3cccc(Cl)c3)CC2)c1 ZINC000271758886 1037130057 /nfs/dbraw/zinc/13/00/57/1037130057.db2.gz HMAHWNZCXUIJPG-MRXNPFEDSA-N 0 3 332.787 3.561 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(NC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000192847035 1040576487 /nfs/dbraw/zinc/57/64/87/1040576487.db2.gz LQPGOCDWAWMIPC-QWHCGFSZSA-N 0 3 342.399 3.806 20 5 EHBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCCO1 ZINC000511657385 1040863043 /nfs/dbraw/zinc/86/30/43/1040863043.db2.gz QOJASFGGEHBTHB-INIZCTEOSA-N 0 3 330.384 3.856 20 5 EHBDHN CC[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CC1(C)C ZINC000419313684 1041249458 /nfs/dbraw/zinc/24/94/58/1041249458.db2.gz GNHFZXJFHWBANZ-ZIAGYGMSSA-N 0 3 330.388 3.559 20 5 EHBDHN Cc1nc(C)c([C@H](C)N(C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000106875323 1041787633 /nfs/dbraw/zinc/78/76/33/1041787633.db2.gz NLRAZLQZLISFTF-LBPRGKRZSA-N 0 3 335.429 3.740 20 5 EHBDHN CC(C)OCCN1CCC(Nc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432319357 1042844550 /nfs/dbraw/zinc/84/45/50/1042844550.db2.gz XXVCIUSKHRSPJE-UHFFFAOYSA-N 0 3 341.839 3.550 20 5 EHBDHN CC1CCC(N(C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728898041 1043671554 /nfs/dbraw/zinc/67/15/54/1043671554.db2.gz UKLYQRRQWLLJAJ-UHFFFAOYSA-N 0 3 328.416 3.926 20 5 EHBDHN C[C@@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000765848112 1128560183 /nfs/dbraw/zinc/56/01/83/1128560183.db2.gz FOXNBIITMGOLLW-WBMJQRKESA-N 0 3 326.352 3.725 20 5 EHBDHN CC(C)CN(CCN(C)C)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000495315608 1121063087 /nfs/dbraw/zinc/06/30/87/1121063087.db2.gz CRONOQWIMVNRQJ-UHFFFAOYSA-N 0 3 349.475 3.552 20 5 EHBDHN CCC[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000193630465 1121514232 /nfs/dbraw/zinc/51/42/32/1121514232.db2.gz PVTMPUWHQKBVHA-SFHVURJKSA-N 0 3 341.411 3.973 20 5 EHBDHN Cc1ccc(N2CCCN(Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000917088533 1122486212 /nfs/dbraw/zinc/48/62/12/1122486212.db2.gz KLVMEGJVIJJIEH-UHFFFAOYSA-N 0 3 325.412 3.616 20 5 EHBDHN CC(C)[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1F ZINC000180259813 1123976036 /nfs/dbraw/zinc/97/60/36/1123976036.db2.gz LHXTYGLUOGMRDI-OAHLLOKOSA-N 0 3 340.786 3.571 20 5 EHBDHN Cc1cc(C)cc([C@@H](C)NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000182906849 1125391564 /nfs/dbraw/zinc/39/15/64/1125391564.db2.gz CGYQUBWQYYUVGF-OAHLLOKOSA-N 0 3 341.411 3.809 20 5 EHBDHN Cc1cc(C)cc([C@@H](C)NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000182906824 1125391914 /nfs/dbraw/zinc/39/19/14/1125391914.db2.gz OFUNVUWRAFHINQ-OAHLLOKOSA-N 0 3 341.411 3.809 20 5 EHBDHN CC(C)(CCO)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000305846714 1129928526 /nfs/dbraw/zinc/92/85/26/1129928526.db2.gz SUMXIMBWKWYLKE-SFHVURJKSA-N 0 3 328.412 3.682 20 5 EHBDHN C[C@H](NCc1ccc(Cn2ccnc2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000173316591 1130205380 /nfs/dbraw/zinc/20/53/80/1130205380.db2.gz YJUXMNCGNUFARK-HNNXBMFYSA-N 0 3 336.395 3.690 20 5 EHBDHN Cc1ccc([C@@H](CN[C@H](C)c2cccc([N+](=O)[O-])c2)N2CCCC2)o1 ZINC000173371062 1130219394 /nfs/dbraw/zinc/21/93/94/1130219394.db2.gz WNANDWZYALZFQX-CRAIPNDOSA-N 0 3 343.427 3.984 20 5 EHBDHN Cn1cc(CN2CCC[C@@H]3CCC[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000245561734 1130239341 /nfs/dbraw/zinc/23/93/41/1130239341.db2.gz OHBGQELCUQLXGE-KBXCAEBGSA-N 0 3 340.427 3.760 20 5 EHBDHN COc1ccc(OCCN(C)[C@H](C)c2cccs2)c([N+](=O)[O-])c1 ZINC000173539080 1130244882 /nfs/dbraw/zinc/24/48/82/1130244882.db2.gz UYEOZADGXIKQGN-GFCCVEGCSA-N 0 3 336.413 3.737 20 5 EHBDHN Cc1ccc(CN[C@@H](C)c2cccc(-n3ccnc3)c2)cc1[N+](=O)[O-] ZINC000742391433 1131714927 /nfs/dbraw/zinc/71/49/27/1131714927.db2.gz HYVNGRXIUUBPQO-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@@H](NCc1ncccc1Cl)CC2 ZINC001172901369 1131884028 /nfs/dbraw/zinc/88/40/28/1131884028.db2.gz MLPBLDDETKZIMQ-AWEZNQCLSA-N 0 3 331.803 3.680 20 5 EHBDHN Cc1cc([C@H]2CCCN2[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910418 1131916918 /nfs/dbraw/zinc/91/69/18/1131916918.db2.gz ZFIDFAGNRXRWQF-QFBILLFUSA-N 0 3 341.411 3.976 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC[C@](C)(F)CC2)c1F ZINC001173178941 1131992245 /nfs/dbraw/zinc/99/22/45/1131992245.db2.gz CHZIUHQIWCWBSP-PXAZEXFGSA-N 0 3 342.386 3.888 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@@H]3CCC[C@@H]32)c1F ZINC001173196495 1131996656 /nfs/dbraw/zinc/99/66/56/1131996656.db2.gz NAAHBAXLNOBTRT-YDHLFZDLSA-N 0 3 336.407 3.938 20 5 EHBDHN COc1cccc(CN(C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1OC ZINC001173231193 1132008712 /nfs/dbraw/zinc/00/87/12/1132008712.db2.gz KJQBWOIBRVURHN-CQSZACIVSA-N 0 3 344.411 3.675 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@H]1CCOC12CCCC2 ZINC001176823942 1133003035 /nfs/dbraw/zinc/00/30/35/1133003035.db2.gz ZTTUPVDOGPOQHA-KRWDZBQOSA-N 0 3 334.416 3.573 20 5 EHBDHN CCCCC[C@H]1CCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767761318 1133048740 /nfs/dbraw/zinc/04/87/40/1133048740.db2.gz JXOLTSQMKMJXOL-INIZCTEOSA-N 0 3 343.431 3.856 20 5 EHBDHN O=[N+]([O-])c1cccc(Br)c1CNCC1(C2CC2)CC1 ZINC001178268208 1133151615 /nfs/dbraw/zinc/15/16/15/1133151615.db2.gz YWEMCVSNWWSMTO-UHFFFAOYSA-N 0 3 325.206 3.637 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CCNCc1ccc(F)cc1F ZINC001178326677 1133160249 /nfs/dbraw/zinc/16/02/49/1133160249.db2.gz OMAHBWKLLDHCMO-UHFFFAOYSA-N 0 3 326.730 3.859 20 5 EHBDHN COC[C@H](CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC001179662714 1133272286 /nfs/dbraw/zinc/27/22/86/1133272286.db2.gz TYFYCQRFKRKSFH-AWEZNQCLSA-N 0 3 349.456 3.727 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(C[C@@H](O)c2ccc(Cl)cc2)C2CC2)c1 ZINC000774658067 1133835484 /nfs/dbraw/zinc/83/54/84/1133835484.db2.gz CXRWSTPDSCPAIL-GOSISDBHSA-N 0 3 346.814 3.946 20 5 EHBDHN COc1ccc(CCCN(C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788479052 1134130007 /nfs/dbraw/zinc/13/00/07/1134130007.db2.gz MYRYPMQKSPDODD-UHFFFAOYSA-N 0 3 332.375 3.807 20 5 EHBDHN COc1cc2c(cc1F)CC[C@H]2N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788815724 1134176192 /nfs/dbraw/zinc/17/61/92/1134176192.db2.gz DPAYQIPTXJRSAC-QLJPJBMISA-N 0 3 345.374 3.663 20 5 EHBDHN CC(C)C[C@]1(CO)CCCN1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789501753 1134286201 /nfs/dbraw/zinc/28/62/01/1134286201.db2.gz CZFJCCGIFIETIA-INIZCTEOSA-N 0 3 326.824 3.621 20 5 EHBDHN CC(C)c1cccc2c1CCN(C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC000789549154 1134295413 /nfs/dbraw/zinc/29/54/13/1134295413.db2.gz PRMUAJJNYVRIFI-FQEVSTJZSA-N 0 3 340.423 3.810 20 5 EHBDHN COc1ccc(C[C@@H](C)N[C@@H](C)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC001170297603 1134737402 /nfs/dbraw/zinc/73/74/02/1134737402.db2.gz QPHNAKGPHUIHCJ-PWSUYJOCSA-N 0 3 335.429 3.650 20 5 EHBDHN COc1ccc(C[C@H](C)NCc2cccc(F)c2F)c([N+](=O)[O-])c1 ZINC001170304717 1134739792 /nfs/dbraw/zinc/73/97/92/1134739792.db2.gz GGAPILQMJGRDPQ-NSHDSACASA-N 0 3 336.338 3.602 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CC[C@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329026 1134749425 /nfs/dbraw/zinc/74/94/25/1134749425.db2.gz NGJAINQNLUDCDD-ABAIWWIYSA-N 0 3 346.349 3.604 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170328777 1134749759 /nfs/dbraw/zinc/74/97/59/1134749759.db2.gz MHWFYAAUODDHSD-LBPRGKRZSA-N 0 3 328.359 3.656 20 5 EHBDHN CC[C@@H](NCc1ccccc1CC(=O)OC)c1cccc([N+](=O)[O-])c1 ZINC000775537560 1135034164 /nfs/dbraw/zinc/03/41/64/1135034164.db2.gz AJIYMRBJLJFLKX-GOSISDBHSA-N 0 3 342.395 3.551 20 5 EHBDHN COc1cc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)c([N+](=O)[O-])cc1[O-] ZINC001199053506 1135876281 /nfs/dbraw/zinc/87/62/81/1135876281.db2.gz ZZWVRQRXCPJPNJ-UMVBOHGHSA-N 0 3 334.416 3.758 20 5 EHBDHN CC[C@H](NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000809975719 1135907596 /nfs/dbraw/zinc/90/75/96/1135907596.db2.gz SIPIMPVNJOVDJP-STQMWFEESA-N 0 3 333.215 3.949 20 5 EHBDHN CC[C@@H](C)[C@@](C)(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811479551 1136097666 /nfs/dbraw/zinc/09/76/66/1136097666.db2.gz HVRXDBQZIDHSQR-OTYXRUKQSA-N 0 3 335.231 3.788 20 5 EHBDHN COCC1(CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCC1 ZINC000811501163 1136100512 /nfs/dbraw/zinc/10/05/12/1136100512.db2.gz UKDQXLKATAOTRN-UHFFFAOYSA-N 0 3 333.215 3.808 20 5 EHBDHN C[C@H](N)c1ncc(-c2ccccc2)n1-c1cnc(Cl)cc1[N+](=O)[O-] ZINC001170679913 1136219243 /nfs/dbraw/zinc/21/92/43/1136219243.db2.gz LSWBWDKQCQPFEU-JTQLQIEISA-N 0 3 343.774 3.516 20 5 EHBDHN CC(C)[C@H](O)[C@@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000850553736 1136284224 /nfs/dbraw/zinc/28/42/24/1136284224.db2.gz CACWDPNOHAMSAL-AGRHKRQWSA-N 0 3 343.427 3.586 20 5 EHBDHN CC(COC(=O)[C@@H](Sc1ccccc1F)c1ccccc1)[N+](=O)[O-] ZINC000813103254 1136288334 /nfs/dbraw/zinc/28/83/34/1136288334.db2.gz ZIGHQLPDWRCTBJ-WBMJQRKESA-N 0 3 349.383 3.868 20 5 EHBDHN Cc1ccc(-c2ccc(C(=O)OCC(C)[N+](=O)[O-])c(F)c2)cc1C ZINC000813102571 1136288396 /nfs/dbraw/zinc/28/83/96/1136288396.db2.gz SCQWNCKZAVCNBR-CYBMUJFWSA-N 0 3 331.343 3.932 20 5 EHBDHN CC(COC(=O)[C@H](Sc1ccccc1F)c1ccccc1)[N+](=O)[O-] ZINC000813103248 1136288471 /nfs/dbraw/zinc/28/84/71/1136288471.db2.gz ZIGHQLPDWRCTBJ-BLLLJJGKSA-N 0 3 349.383 3.868 20 5 EHBDHN CC(COC(=O)c1ccccc1SCc1cccs1)[N+](=O)[O-] ZINC000813103026 1136288478 /nfs/dbraw/zinc/28/84/78/1136288478.db2.gz YKLCRDKKPNKJFC-LLVKDONJSA-N 0 3 337.422 3.862 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@@H]1CCN(c2ccccc2F)C1 ZINC000813792392 1136362681 /nfs/dbraw/zinc/36/26/81/1136362681.db2.gz XYPWABKATJMUGU-CQSZACIVSA-N 0 3 349.793 3.756 20 5 EHBDHN CC(C)[C@H](NCc1ccc(F)cc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000852034818 1136428625 /nfs/dbraw/zinc/42/86/25/1136428625.db2.gz JFHDHUVTBJXUFX-ZWKOTPCHSA-N 0 3 332.375 3.582 20 5 EHBDHN O=[N+]([O-])c1cn(CN(C2CC2)C2CCCCC2)nc1-c1ccccn1 ZINC000853489226 1136537213 /nfs/dbraw/zinc/53/72/13/1136537213.db2.gz KQQAXVYKNIYATQ-UHFFFAOYSA-N 0 3 341.415 3.608 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC(c3ccsc3)CC2)cc1 ZINC000776882661 1136773194 /nfs/dbraw/zinc/77/31/94/1136773194.db2.gz PVUXBNYOTRKKTO-QGZVFWFLSA-N 0 3 332.425 3.569 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCCc3c(F)cc(F)cc32)c1 ZINC000819333737 1136932308 /nfs/dbraw/zinc/93/23/08/1136932308.db2.gz REAOCOISQOVEML-QZTJIDSGSA-N 0 3 348.349 3.574 20 5 EHBDHN CC([C@H](OC(=O)[C@@H]1C[C@H]1c1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000860855113 1137081189 /nfs/dbraw/zinc/08/11/89/1137081189.db2.gz RKZIDUDXHVRFPP-BWPSIRRCSA-N 0 3 349.383 3.940 20 5 EHBDHN COCc1cc([N+](=O)[O-])ccc1NC[C@H](c1ccco1)N1CCCC1 ZINC000266029647 1137111748 /nfs/dbraw/zinc/11/17/48/1137111748.db2.gz RRGOJWLVGDKFQO-QGZVFWFLSA-N 0 3 345.399 3.583 20 5 EHBDHN C[C@H](CSc1ccccc1)N(C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359985 1137215321 /nfs/dbraw/zinc/21/53/21/1137215321.db2.gz LXGJXYNJJPNODU-RDTXWAMCSA-N 0 3 346.452 3.741 20 5 EHBDHN CC([C@H](OC(=O)[C@H](C)Oc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845872258 1137316001 /nfs/dbraw/zinc/31/60/01/1137316001.db2.gz FPRULOCMCAOKJD-IGCXYCKISA-N 0 3 347.342 3.543 20 5 EHBDHN CC([C@@H](OC(=O)C1CCC(F)(F)CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878967 1137316707 /nfs/dbraw/zinc/31/67/07/1137316707.db2.gz UJNSSYPWVOSMLD-QMTHXVAHSA-N 0 3 345.317 3.901 20 5 EHBDHN Cc1ccc([C@H](C)C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845878877 1137316889 /nfs/dbraw/zinc/31/68/89/1137316889.db2.gz TYNLTHOWGYHTQJ-OZVIIMIRSA-N 0 3 335.331 3.780 20 5 EHBDHN C[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)[C@@](C)(O)c1ccccc1 ZINC000846035342 1137328386 /nfs/dbraw/zinc/32/83/86/1137328386.db2.gz GSQXXGWVKYLMJJ-SJKOYZFVSA-N 0 3 334.803 3.634 20 5 EHBDHN COCCOc1cccc(CNCc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000873014392 1137588148 /nfs/dbraw/zinc/58/81/48/1137588148.db2.gz QBTALIDHMNVJQZ-UHFFFAOYSA-N 0 3 344.411 3.527 20 5 EHBDHN CC(C)[C@H]1CCCC[C@@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878419433 1137715083 /nfs/dbraw/zinc/71/50/83/1137715083.db2.gz FDTGRPKWLDKNLW-HIFRSBDPSA-N 0 3 344.415 3.949 20 5 EHBDHN CCC[C@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCC1 ZINC000878706078 1137725679 /nfs/dbraw/zinc/72/56/79/1137725679.db2.gz QAVMEWGZVBWKFN-AWEZNQCLSA-N 0 3 330.388 3.703 20 5 EHBDHN CCN(CC)[C@@H](CNCc1ccc(C)c([N+](=O)[O-])c1)c1ccco1 ZINC000131451929 1137853543 /nfs/dbraw/zinc/85/35/43/1137853543.db2.gz CFTOOPLGHJGZHX-KRWDZBQOSA-N 0 3 331.416 3.669 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000109763892 1137897244 /nfs/dbraw/zinc/89/72/44/1137897244.db2.gz LQFXJIKHAPFRNV-UHFFFAOYSA-N 0 3 336.395 3.851 20 5 EHBDHN CC1CCC(N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000072803691 1138107810 /nfs/dbraw/zinc/10/78/10/1138107810.db2.gz ONMLXQBKQMXDHM-UHFFFAOYSA-N 0 3 330.388 3.655 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCC3CCSCC3)cs2)c1 ZINC000264937911 1138680909 /nfs/dbraw/zinc/68/09/09/1138680909.db2.gz DVOJVDYKMRXDAM-UHFFFAOYSA-N 0 3 349.481 3.951 20 5 EHBDHN Cc1ccc(CNC2(c3ccc(F)cc3)CCOCC2)cc1[N+](=O)[O-] ZINC000174390467 1139418143 /nfs/dbraw/zinc/41/81/43/1139418143.db2.gz ZWNWXXWJWOHGON-UHFFFAOYSA-N 0 3 344.386 3.838 20 5 EHBDHN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384689 1139487633 /nfs/dbraw/zinc/48/76/33/1139487633.db2.gz KDLXXJFYCIOTSV-BSEYFRJRSA-N 0 3 346.452 3.568 20 5 EHBDHN CC(=O)Nc1ccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000182004610 1139944770 /nfs/dbraw/zinc/94/47/70/1139944770.db2.gz LVMMPFBQSBWWDZ-CHWSQXEVSA-N 0 3 327.384 3.965 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000182911818 1140000212 /nfs/dbraw/zinc/00/02/12/1140000212.db2.gz DJQBSAGIKSFGQZ-RLFYNMQTSA-N 0 3 328.416 3.744 20 5 EHBDHN Cc1ccc([C@H](C)NC[C@@H](O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000268776816 1140989472 /nfs/dbraw/zinc/98/94/72/1140989472.db2.gz WBSPZSVYHIVADF-APPDUMDISA-N 0 3 336.338 3.566 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000270372094 1141213800 /nfs/dbraw/zinc/21/38/00/1141213800.db2.gz KDVCMDKXOUKMLN-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN CCC1(O)CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000271167790 1141317352 /nfs/dbraw/zinc/31/73/52/1141317352.db2.gz CULLKDMFMYQULQ-UHFFFAOYSA-N 0 3 330.384 3.592 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000359872812 201114535 /nfs/dbraw/zinc/11/45/35/201114535.db2.gz PRWIPTCMUMLVSI-IEBWSBKVSA-N 0 3 326.396 3.771 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000359872818 201114614 /nfs/dbraw/zinc/11/46/14/201114614.db2.gz PRWIPTCMUMLVSI-MJGOQNOKSA-N 0 3 326.396 3.771 20 5 EHBDHN Cn1cc([C@H](NC/C=C/c2ccccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000538430306 1032358781 /nfs/dbraw/zinc/35/87/81/1032358781.db2.gz VALJVPTZZLATLY-LKUPDRCFSA-N 0 3 328.416 3.719 20 5 EHBDHN CN(C)[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)c1ccsc1 ZINC000026720213 1032395690 /nfs/dbraw/zinc/39/56/90/1032395690.db2.gz OIEWVVZTFXLRCG-KRWDZBQOSA-N 0 3 342.424 3.919 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000075680410 1032655993 /nfs/dbraw/zinc/65/59/93/1032655993.db2.gz UYUQMSWONFHLRB-ZIAGYGMSSA-N 0 3 349.431 3.502 20 5 EHBDHN Cc1nccc([C@@H]2CCCN([C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368003 1018535672 /nfs/dbraw/zinc/53/56/72/1018535672.db2.gz AQKGNPWQJAHLQC-UKRRQHHQSA-N 0 3 326.400 3.634 20 5 EHBDHN C[C@H](c1ccccc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000064915940 1018715326 /nfs/dbraw/zinc/71/53/26/1018715326.db2.gz WLQJUULOZPGUBZ-UKRRQHHQSA-N 0 3 329.375 3.981 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000182829997 1019758363 /nfs/dbraw/zinc/75/83/63/1019758363.db2.gz HJXJVCGQFUZNQS-KGLIPLIRSA-N 0 3 334.416 3.628 20 5 EHBDHN COC[C@@H](C)N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000510422309 1020867336 /nfs/dbraw/zinc/86/73/36/1020867336.db2.gz SXVOWXNDAGCSFJ-LLVKDONJSA-N 0 3 338.791 3.975 20 5 EHBDHN C[C@H](NC[C@H](O)c1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000187419754 1021090484 /nfs/dbraw/zinc/09/04/84/1021090484.db2.gz VKNPKYQIIMLSQJ-QFYYESIMSA-N 0 3 338.766 3.772 20 5 EHBDHN C[C@@H]1CCC[C@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000026468234 1033054517 /nfs/dbraw/zinc/05/45/17/1033054517.db2.gz UUHSYJINJVXCEZ-YPMHNXCESA-N 0 3 339.823 3.697 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC[C@@]1(CO)C[C@H]1c1ccccc1 ZINC000894535302 1022497858 /nfs/dbraw/zinc/49/78/58/1022497858.db2.gz BNKCJQKMKZIDHH-FUHWJXTLSA-N 0 3 346.814 3.504 20 5 EHBDHN C[C@@]1(CCCO)CCCN1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602668128 1033064182 /nfs/dbraw/zinc/06/41/82/1033064182.db2.gz UCMCBYREOSOMFR-HNNXBMFYSA-N 0 3 346.349 3.741 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN3CCC[C@@H]3Cc3ccccc3)nc2c1 ZINC000610580807 1022779990 /nfs/dbraw/zinc/77/99/90/1022779990.db2.gz LJZUEXLAKUFOJG-OAHLLOKOSA-N 0 3 337.379 3.943 20 5 EHBDHN COCCN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000507176082 1023175913 /nfs/dbraw/zinc/17/59/13/1023175913.db2.gz XGEKPJKEUHEIST-UHFFFAOYSA-N 0 3 332.425 3.934 20 5 EHBDHN C[C@@H](NC[C@H](O)c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000090936240 1023180458 /nfs/dbraw/zinc/18/04/58/1023180458.db2.gz SGGMYLMGKVJXLQ-HWPZZCPQSA-N 0 3 338.766 3.772 20 5 EHBDHN Cc1ncc([N+](=O)[O-])n1CCN(C)[C@@H](C)c1cc2ccccc2o1 ZINC000602758788 1033131159 /nfs/dbraw/zinc/13/11/59/1033131159.db2.gz NQUTWOXSYPWKHH-LBPRGKRZSA-N 0 3 328.372 3.539 20 5 EHBDHN COc1ccc2oc(CNCCOc3ccc([N+](=O)[O-])cc3)cc2c1 ZINC000535717304 1023590009 /nfs/dbraw/zinc/59/00/09/1023590009.db2.gz OGVYBHPJFMEJHY-UHFFFAOYSA-N 0 3 342.351 3.518 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425371666 1024894635 /nfs/dbraw/zinc/89/46/35/1024894635.db2.gz LOIXXGCCCVUSCF-MTGFJVSHSA-N 0 3 342.439 3.889 20 5 EHBDHN Cc1nc(CCNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)o1 ZINC000346824565 1025153069 /nfs/dbraw/zinc/15/30/69/1025153069.db2.gz KMPSMWFDXFAWFG-UHFFFAOYSA-N 0 3 341.367 3.792 20 5 EHBDHN CCc1noc(C)c1CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550427 1026102908 /nfs/dbraw/zinc/10/29/08/1026102908.db2.gz RQWHVYXUCHHVBT-HNNXBMFYSA-N 0 3 329.400 3.833 20 5 EHBDHN Cc1ccc(-c2nc(-c3ccc(CN(C)C)cc3)no2)cc1[N+](=O)[O-] ZINC000530871498 1026370755 /nfs/dbraw/zinc/37/07/55/1026370755.db2.gz GNOSBKOPQMKLCT-UHFFFAOYSA-N 0 3 338.367 3.682 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)ncn2C ZINC000342619173 1026474491 /nfs/dbraw/zinc/47/44/91/1026474491.db2.gz GTADDJXSXZKCAF-UHFFFAOYSA-N 0 3 338.411 3.892 20 5 EHBDHN CCCn1nccc1C1CCN(Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000502323139 1028099169 /nfs/dbraw/zinc/09/91/69/1028099169.db2.gz TYWOOBYZUGBDCN-UHFFFAOYSA-N 0 3 342.443 3.889 20 5 EHBDHN CCCN(CCN(C)C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000343055362 1028828018 /nfs/dbraw/zinc/82/80/18/1028828018.db2.gz RFWWRRVGXIHBOX-UHFFFAOYSA-N 0 3 335.451 3.802 20 5 EHBDHN CC(C)c1ccc(CN[C@H]2CCCc3[nH]c(=O)ccc32)cc1[N+](=O)[O-] ZINC000343088965 1029094730 /nfs/dbraw/zinc/09/47/30/1029094730.db2.gz ATGLIKXOCOFPJU-INIZCTEOSA-N 0 3 341.411 3.986 20 5 EHBDHN C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])s2)CCN1Cc1ccccc1 ZINC000192480561 1029684545 /nfs/dbraw/zinc/68/45/45/1029684545.db2.gz HDPGSRLYTSFHNX-GXTWGEPZSA-N 0 3 332.429 3.516 20 5 EHBDHN C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])s2)CCN1Cc1ccccc1 ZINC000192480570 1029684922 /nfs/dbraw/zinc/68/49/22/1029684922.db2.gz HDPGSRLYTSFHNX-OCCSQVGLSA-N 0 3 332.429 3.516 20 5 EHBDHN CC(C)(C)OC(=O)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000525184015 1029732588 /nfs/dbraw/zinc/73/25/88/1029732588.db2.gz APRPDCYRVJQRCH-UHFFFAOYSA-N 0 3 346.383 3.676 20 5 EHBDHN Cc1cccc([C@H](C)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000441207055 1029966581 /nfs/dbraw/zinc/96/65/81/1029966581.db2.gz XSTOQIZMMJLASI-INIZCTEOSA-N 0 3 325.412 3.786 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@H]1CC(C)(C)OC1(C)C ZINC000482157693 1030231513 /nfs/dbraw/zinc/23/15/13/1030231513.db2.gz NBXKFPJVEXNMRK-INIZCTEOSA-N 0 3 336.432 3.818 20 5 EHBDHN O=[N+]([O-])c1cccc(CN[C@@H](c2ccccc2)C2(CO)CCCC2)c1 ZINC000453614343 1030405252 /nfs/dbraw/zinc/40/52/52/1030405252.db2.gz MCWGMGLOCQXJPQ-IBGZPJMESA-N 0 3 340.423 3.978 20 5 EHBDHN C[C@@H]1[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)CCCN1C ZINC000343436006 1030867486 /nfs/dbraw/zinc/86/74/86/1030867486.db2.gz LJGSGCBFLROKBB-KUHUBIRLSA-N 0 3 333.435 3.601 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCCC12CCCCC2 ZINC000536176285 1031292184 /nfs/dbraw/zinc/29/21/84/1031292184.db2.gz FMQVRAQNPXBNTB-UHFFFAOYSA-N 0 3 331.416 3.640 20 5 EHBDHN COc1cc(CN[C@]2(C)CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000483752880 1031318999 /nfs/dbraw/zinc/31/89/99/1031318999.db2.gz FDQVXSKSXWYELI-LJQANCHMSA-N 0 3 326.396 3.945 20 5 EHBDHN COc1c([O-])ccc(C[NH2+]CCC2CCC(F)(F)CC2)c1[N+](=O)[O-] ZINC000898031792 1033296165 /nfs/dbraw/zinc/29/61/65/1033296165.db2.gz OBQMDZGPENVZIG-UHFFFAOYSA-N 0 3 344.358 3.614 20 5 EHBDHN CCS[C@@H]1CC[C@H](N(C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485910 1033366968 /nfs/dbraw/zinc/36/69/68/1033366968.db2.gz TZRWEYUWGDVNRN-DZGCQCFKSA-N 0 3 334.445 3.508 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000278781512 1033514521 /nfs/dbraw/zinc/51/45/21/1033514521.db2.gz DFDRNGSMGGNXMT-UHFFFAOYSA-N 0 3 340.427 3.507 20 5 EHBDHN O=[N+]([O-])c1ccccc1CCNCc1cccc(OC2CC2)c1F ZINC000594929682 1033552169 /nfs/dbraw/zinc/55/21/69/1033552169.db2.gz NHEKJXAZIXRLKF-UHFFFAOYSA-N 0 3 330.359 3.607 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21 ZINC000594996062 1033624130 /nfs/dbraw/zinc/62/41/30/1033624130.db2.gz RGCZCHDIBBGQQI-NZSAHSFTSA-N 0 3 342.370 3.561 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H]1CCC2(CCCC2)O1 ZINC000595046636 1033662482 /nfs/dbraw/zinc/66/24/82/1033662482.db2.gz LWBSDNQSYONQCE-ZFWWWQNUSA-N 0 3 334.416 3.746 20 5 EHBDHN COc1ccc([C@H](N[C@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000599093024 1033730758 /nfs/dbraw/zinc/73/07/58/1033730758.db2.gz MEDBTRPCEIIGQC-KZULUSFZSA-N 0 3 327.384 3.800 20 5 EHBDHN CC(=O)c1cc(NC[C@H]2CCN2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000599125693 1033745230 /nfs/dbraw/zinc/74/52/30/1033745230.db2.gz AKAOUAKENKXAMB-MRXNPFEDSA-N 0 3 331.416 3.616 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1[C@@H]2CC[C@H]1CC(C)C2 ZINC000595856400 1034009562 /nfs/dbraw/zinc/00/95/62/1034009562.db2.gz BWGNLJJOSXVNAC-ARQBPDDDSA-N 0 3 342.399 3.969 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C1CC1)C1CCC(C)CC1 ZINC000603895544 1034016221 /nfs/dbraw/zinc/01/62/21/1034016221.db2.gz ODJNRUGVBQZHEZ-UHFFFAOYSA-N 0 3 345.443 3.885 20 5 EHBDHN CCOc1ccc([C@@H](C)NCCSC(F)(F)F)cc1[N+](=O)[O-] ZINC000179404318 1034276939 /nfs/dbraw/zinc/27/69/39/1034276939.db2.gz PMRLRTWXFNYXDG-SECBINFHSA-N 0 3 338.351 3.897 20 5 EHBDHN Cn1ncc(C2CC2)c1CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597137898 1034560322 /nfs/dbraw/zinc/56/03/22/1034560322.db2.gz HOZDSUXCOVVDTL-MRXNPFEDSA-N 0 3 340.427 3.585 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN(CC2CC2)C2CCC2)c1 ZINC000475667915 1034626048 /nfs/dbraw/zinc/62/60/48/1034626048.db2.gz HXVGRFJCASVITC-UHFFFAOYSA-N 0 3 326.343 3.961 20 5 EHBDHN COc1cncc(/C=C\CCN(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000563061169 1035022447 /nfs/dbraw/zinc/02/24/47/1035022447.db2.gz ZKCWNQNTTDOJJZ-ALCCZGGFSA-N 0 3 327.384 3.534 20 5 EHBDHN CC(C)c1cnc(CNCCc2c[nH]c3ccc([N+](=O)[O-])cc23)s1 ZINC000581995318 1035671715 /nfs/dbraw/zinc/67/17/15/1035671715.db2.gz CUJBODABFQKTSV-UHFFFAOYSA-N 0 3 344.440 3.988 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000056201700 1036138921 /nfs/dbraw/zinc/13/89/21/1036138921.db2.gz NWINZMQIQHUXKZ-KGLIPLIRSA-N 0 3 327.384 3.581 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCc2ccncc2)c2ccccc2)c1 ZINC000493074922 1036640060 /nfs/dbraw/zinc/64/00/60/1036640060.db2.gz AJDAXAIHVORJBE-FQEVSTJZSA-N 0 3 333.391 3.912 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000170647941 1036660950 /nfs/dbraw/zinc/66/09/50/1036660950.db2.gz NOKSMWBHBKJRLS-UONOGXRCSA-N 0 3 349.431 3.502 20 5 EHBDHN C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cncn2)cc1 ZINC000152782683 1036722297 /nfs/dbraw/zinc/72/22/97/1036722297.db2.gz GLRDWIAFUSYIBO-ZIAGYGMSSA-N 0 3 337.383 3.587 20 5 EHBDHN Cc1ccccc1NC(=O)CCN[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271705490 1036961846 /nfs/dbraw/zinc/96/18/46/1036961846.db2.gz IFYPVMKCMYTHNT-CQSZACIVSA-N 0 3 327.384 3.583 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN([C@H](C)CO)C1CCCC1 ZINC000472619545 1037542776 /nfs/dbraw/zinc/54/27/76/1037542776.db2.gz RAQJWKFKECLYKC-CQSZACIVSA-N 0 3 336.432 3.507 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CCC(OCC2CCCC2)CC1 ZINC000177502800 1037560064 /nfs/dbraw/zinc/56/00/64/1037560064.db2.gz MCAMNBDJGDLFOO-UHFFFAOYSA-N 0 3 348.443 3.645 20 5 EHBDHN Cc1nc(CCNCc2ccc(Cl)cc2[N+](=O)[O-])sc1C ZINC000893156753 1037702025 /nfs/dbraw/zinc/70/20/25/1037702025.db2.gz SVGGLVIEBLVESH-UHFFFAOYSA-N 0 3 325.821 3.654 20 5 EHBDHN Cc1cc(C)cc([C@H](C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000540410482 1037907683 /nfs/dbraw/zinc/90/76/83/1037907683.db2.gz ZNLCJWYWDFNHES-GJZGRUSLSA-N 0 3 341.411 3.889 20 5 EHBDHN CC(C)(NCc1cc(-n2ccnc2)cs1)c1ccccc1[N+](=O)[O-] ZINC000492192557 1038103175 /nfs/dbraw/zinc/10/31/75/1038103175.db2.gz HOPDHILMJXZALX-UHFFFAOYSA-N 0 3 342.424 3.867 20 5 EHBDHN C/C(=C\c1ccccc1)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737317 1038501288 /nfs/dbraw/zinc/50/12/88/1038501288.db2.gz VVQCPKXQVUSWFV-GSPCDJLXSA-N 0 3 338.411 3.580 20 5 EHBDHN COc1cc(CN2CC[C@@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000489101300 1039621111 /nfs/dbraw/zinc/62/11/11/1039621111.db2.gz GISJMASOARRXLT-OAHLLOKOSA-N 0 3 330.359 3.732 20 5 EHBDHN COc1cc(CN(C)C2(C)CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000489879728 1040219959 /nfs/dbraw/zinc/21/99/59/1040219959.db2.gz FLZGECCNJDZSIJ-UHFFFAOYSA-N 0 3 344.358 3.969 20 5 EHBDHN C[C@H](N[C@@H]1CC2CCC1CC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000433062404 1040584016 /nfs/dbraw/zinc/58/40/16/1040584016.db2.gz SUIZOFDZNNGMAK-PIISCBOPSA-N 0 3 342.399 3.874 20 5 EHBDHN Cc1cscc1CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000487178461 1040766165 /nfs/dbraw/zinc/76/61/65/1040766165.db2.gz GAFAUQZVJIFOMQ-UHFFFAOYSA-N 0 3 342.424 3.655 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](c2ccc(O)cc2)C1 ZINC000600213370 1040850865 /nfs/dbraw/zinc/85/08/65/1040850865.db2.gz CSVDCTNAEJCRGZ-OAHLLOKOSA-N 0 3 342.395 3.689 20 5 EHBDHN CCOc1cccc(NC[C@@H](c2ccc(F)cc2)N(C)C)c1[N+](=O)[O-] ZINC000541551911 1040878759 /nfs/dbraw/zinc/87/87/59/1040878759.db2.gz SDGVRCIOSWGKPM-INIZCTEOSA-N 0 3 347.390 3.847 20 5 EHBDHN COC(=O)c1cc([C@H](C)N(C)CCc2ccccc2[N+](=O)[O-])oc1C ZINC000433178860 1041010194 /nfs/dbraw/zinc/01/01/94/1041010194.db2.gz CQORMHLEDGYOHQ-LBPRGKRZSA-N 0 3 346.383 3.518 20 5 EHBDHN CC[C@H](C)CN(C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000111253532 1042254077 /nfs/dbraw/zinc/25/40/77/1042254077.db2.gz HIZJUVAOCIPLJF-QWRGUYRKSA-N 0 3 327.812 3.553 20 5 EHBDHN CN(Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)CC(C)(C)O ZINC000093414644 1042296834 /nfs/dbraw/zinc/29/68/34/1042296834.db2.gz LEKZPEHUGHUNRT-UHFFFAOYSA-N 0 3 348.374 3.729 20 5 EHBDHN Cc1ccc([C@@H](C)NC[C@@H](c2ccco2)N2CCCC2)cc1[N+](=O)[O-] ZINC000120315750 1042390411 /nfs/dbraw/zinc/39/04/11/1042390411.db2.gz HXSFQSJUXLYBPP-QAPCUYQASA-N 0 3 343.427 3.984 20 5 EHBDHN C[C@H](NCc1ccc(N2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000122137881 1042864964 /nfs/dbraw/zinc/86/49/64/1042864964.db2.gz MQZVJWMHTOKLLU-AWEZNQCLSA-N 0 3 339.395 3.572 20 5 EHBDHN C[C@H]1CN(CCCCNc2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000432325862 1042906870 /nfs/dbraw/zinc/90/68/70/1042906870.db2.gz NCEADUSMRASLKE-STQMWFEESA-N 0 3 341.839 3.550 20 5 EHBDHN COCC1(CCNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000571880325 1043750974 /nfs/dbraw/zinc/75/09/74/1043750974.db2.gz ADPNCDVPHURHDP-UHFFFAOYSA-N 0 3 347.440 3.625 20 5 EHBDHN CC[C@@H](C)CN(CC)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000764283771 1127473371 /nfs/dbraw/zinc/47/33/71/1127473371.db2.gz SKDKRSHBQKCVCY-LLVKDONJSA-N 0 3 327.812 3.555 20 5 EHBDHN CCN(CCc1cccs1)Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000764943314 1127552349 /nfs/dbraw/zinc/55/23/49/1127552349.db2.gz DOSJENUSAGJBKX-UHFFFAOYSA-N 0 3 344.440 3.837 20 5 EHBDHN COc1ccc([C@@H](C)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1C ZINC000273018395 1128432985 /nfs/dbraw/zinc/43/29/85/1128432985.db2.gz CESZKXDDZOUSLP-CYBMUJFWSA-N 0 3 330.384 3.771 20 5 EHBDHN CC(C)(C)[C@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000273063153 1128438618 /nfs/dbraw/zinc/43/86/18/1128438618.db2.gz MVAURWNQFASBPI-IUODEOHRSA-N 0 3 326.824 3.932 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(N[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000301479811 1128468730 /nfs/dbraw/zinc/46/87/30/1128468730.db2.gz NQIWRUHVONMVPK-INIZCTEOSA-N 0 3 341.411 3.680 20 5 EHBDHN CCOC1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000091677700 1128779231 /nfs/dbraw/zinc/77/92/31/1128779231.db2.gz SHFUZXGEDBNONN-UHFFFAOYSA-N 0 3 330.384 3.856 20 5 EHBDHN Cc1ccc(CN[C@H](CN(C)C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000554938856 1128905348 /nfs/dbraw/zinc/90/53/48/1128905348.db2.gz YPVLMEHAQIKDBJ-QGZVFWFLSA-N 0 3 347.846 3.949 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@H](O)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000153114207 1120691440 /nfs/dbraw/zinc/69/14/40/1120691440.db2.gz MDSPIIGBWVPNLZ-KSSFIOAISA-N 0 3 344.411 3.686 20 5 EHBDHN COc1ccccc1[C@@H](CNc1ccc([N+](=O)[O-])cc1)N1CCCC1 ZINC000301056597 1121193174 /nfs/dbraw/zinc/19/31/74/1121193174.db2.gz KNZNCTJPKUHKRA-GOSISDBHSA-N 0 3 341.411 3.852 20 5 EHBDHN CC[C@@H](NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(C)cc1 ZINC000194014209 1121752507 /nfs/dbraw/zinc/75/25/07/1121752507.db2.gz LNMFOWWXAFEGCZ-QGZVFWFLSA-N 0 3 341.411 3.891 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)cnc1NC[C@H](c1ccccc1)N1CCCC1 ZINC000301747295 1129029143 /nfs/dbraw/zinc/02/91/43/1129029143.db2.gz QWHBTCKDHOILBS-MRXNPFEDSA-N 0 3 346.818 3.892 20 5 EHBDHN CC(C)C[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000155112443 1123189951 /nfs/dbraw/zinc/18/99/51/1123189951.db2.gz VUBXMDMGPPBSPE-AWEZNQCLSA-N 0 3 347.440 3.972 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)[C@@H]1CCCc2c1cnn2C ZINC000615835122 1123884231 /nfs/dbraw/zinc/88/42/31/1123884231.db2.gz PURRORKVIFRPAP-PMXLPMHFSA-N 0 3 340.427 3.741 20 5 EHBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC[C@H](c2cc[nH]n2)C1 ZINC000615836012 1123884398 /nfs/dbraw/zinc/88/43/98/1123884398.db2.gz HCDDJXOIXIMFDU-DKGMDFAASA-N 0 3 326.400 3.601 20 5 EHBDHN CCOc1cc(CN2CCC[C@H](C[C@@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216828 1124100346 /nfs/dbraw/zinc/10/03/46/1124100346.db2.gz ZQJWZVYOHHMWIH-WBVHZDCISA-N 0 3 348.443 3.632 20 5 EHBDHN CC[C@@H](NCc1ccc(OC)c(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000078635517 1129174834 /nfs/dbraw/zinc/17/48/34/1129174834.db2.gz UCIKRUAMTYNVDT-MRXNPFEDSA-N 0 3 330.384 3.853 20 5 EHBDHN CC(C)[C@@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1F ZINC000182157333 1125192101 /nfs/dbraw/zinc/19/21/01/1125192101.db2.gz GCVRFDNRCYSMHV-OAHLLOKOSA-N 0 3 340.786 3.571 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CC(C4CCOCC4)C3)o2)cc1 ZINC000619726605 1125389666 /nfs/dbraw/zinc/38/96/66/1125389666.db2.gz OTEHLUASXMPMBB-UHFFFAOYSA-N 0 3 342.395 3.713 20 5 EHBDHN CCOC(=O)CC[C@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000162044545 1129796919 /nfs/dbraw/zinc/79/69/19/1129796919.db2.gz CNUYOTNLQMSFMT-LSDHHAIUSA-N 0 3 334.416 3.711 20 5 EHBDHN CCC[C@@H](N[C@@H]1CCCc2nn(C)cc21)c1cccc([N+](=O)[O-])c1 ZINC000282509053 1129974379 /nfs/dbraw/zinc/97/43/79/1129974379.db2.gz SQGZRWBBRNFERJ-IAGOWNOFSA-N 0 3 328.416 3.837 20 5 EHBDHN CN(CCc1ccc(Cl)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000733301264 1131018813 /nfs/dbraw/zinc/01/88/13/1131018813.db2.gz ZFJJMOFIQCMGBT-UHFFFAOYSA-N 0 3 344.802 3.730 20 5 EHBDHN CC(C)(C)C[C@H]1CCCN1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742146882 1131691295 /nfs/dbraw/zinc/69/12/95/1131691295.db2.gz QUTPUKJPDRUQSA-OAHLLOKOSA-N 0 3 343.431 3.711 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC3(CCCC3)C2)c1F ZINC001173188472 1131993860 /nfs/dbraw/zinc/99/38/60/1131993860.db2.gz FOUJUQWVBKJNIS-ZDUSSCGKSA-N 0 3 336.407 3.940 20 5 EHBDHN CCN(Cc1ccncc1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184465 1131994163 /nfs/dbraw/zinc/99/41/63/1131994163.db2.gz NLNGUFBXLZLSFZ-ZDUSSCGKSA-N 0 3 347.390 3.591 20 5 EHBDHN CN(C)Cc1ccccc1-n1c2ccccc2cc2c(=O)c(N)ccc1-2 ZINC001173930346 1132187751 /nfs/dbraw/zinc/18/77/51/1132187751.db2.gz DMSRFKMSSOBABA-UHFFFAOYSA-N 0 3 343.430 3.739 20 5 EHBDHN CN(C)Cc1ccc(-n2c3ccccc3cc3c(=O)c(N)ccc2-3)cc1 ZINC001176295912 1132894461 /nfs/dbraw/zinc/89/44/61/1132894461.db2.gz QHLZGVGVBFXRBH-UHFFFAOYSA-N 0 3 343.430 3.739 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CCNCc1nc2c(s1)CCC2 ZINC001178326855 1133160052 /nfs/dbraw/zinc/16/00/52/1133160052.db2.gz RUUDGKSUAUFYHV-UHFFFAOYSA-N 0 3 337.832 3.526 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179348062 1133242926 /nfs/dbraw/zinc/24/29/26/1133242926.db2.gz NFFKLIRTWXZGTI-JWXAPSBJSA-N 0 3 330.384 3.756 20 5 EHBDHN CCN(Cc1ccc(C)c([N+](=O)[O-])c1)C[C@@H](O)c1ccc(C)cc1 ZINC000769483968 1133289061 /nfs/dbraw/zinc/28/90/61/1133289061.db2.gz QQJFNTVGECPOTR-LJQANCHMSA-N 0 3 328.412 3.767 20 5 EHBDHN O=[N+]([O-])c1ccc(N2CCN(C3CCCC3)CC2)c(C(F)F)c1 ZINC001184793025 1133991844 /nfs/dbraw/zinc/99/18/44/1133991844.db2.gz PGMMFTBZXFTPIU-UHFFFAOYSA-N 0 3 325.359 3.597 20 5 EHBDHN C[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1cccc(-n2cccn2)c1 ZINC000788488847 1134131477 /nfs/dbraw/zinc/13/14/77/1134131477.db2.gz MFSGZZLCFXHSQD-ZDUSSCGKSA-N 0 3 340.358 3.770 20 5 EHBDHN C[C@@H](NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000792877045 1134811495 /nfs/dbraw/zinc/81/14/95/1134811495.db2.gz PSUFYWYTFZYHGQ-CYBMUJFWSA-N 0 3 343.383 3.959 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN[C@H](c2ccc(F)cc2F)C2CC2)c1 ZINC001192617515 1135040794 /nfs/dbraw/zinc/04/07/94/1135040794.db2.gz UPOSFOPNHBMSFY-MSOLQXFVSA-N 0 3 348.349 3.647 20 5 EHBDHN CC[C@@H]1Cc2ccccc2CN1CCOc1ccccc1[N+](=O)[O-] ZINC001193119686 1135104769 /nfs/dbraw/zinc/10/47/69/1135104769.db2.gz YZXXWWCYLAWKQK-QGZVFWFLSA-N 0 3 326.396 3.811 20 5 EHBDHN CC[C@H](C)N[C@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804781931 1135199584 /nfs/dbraw/zinc/19/95/84/1135199584.db2.gz LBNHQALBKBOHIH-NWDGAFQWSA-N 0 3 348.359 3.637 20 5 EHBDHN CN(CCNC(C)(C)c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC001194683619 1135305524 /nfs/dbraw/zinc/30/55/24/1135305524.db2.gz PFDOCHPLTBLELO-UHFFFAOYSA-N 0 3 327.428 3.552 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]1CC1CCCC1 ZINC001195639453 1135445595 /nfs/dbraw/zinc/44/55/95/1135445595.db2.gz URHSTALJFIOSQE-MRXNPFEDSA-N 0 3 345.443 3.886 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)F)ccc1N1CCN(C2CCCC2)CC1 ZINC000809347544 1135822323 /nfs/dbraw/zinc/82/23/23/1135822323.db2.gz VQEUHAGZLUFTBB-UHFFFAOYSA-N 0 3 325.359 3.597 20 5 EHBDHN C[C@@H](O)C[C@H]1CCCCCN1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700321 1135868961 /nfs/dbraw/zinc/86/89/61/1135868961.db2.gz CPTYFTGQFHIUPE-TZMCWYRMSA-N 0 3 326.824 3.764 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCc1ccc(Cl)nc1 ZINC000850441294 1136259251 /nfs/dbraw/zinc/25/92/51/1136259251.db2.gz UPDHZOQJPWGTTK-NSHDSACASA-N 0 3 335.791 3.545 20 5 EHBDHN CC(COC(=O)COc1ccc(-c2ccccc2)cc1Cl)[N+](=O)[O-] ZINC000813113615 1136294663 /nfs/dbraw/zinc/29/46/63/1136294663.db2.gz RUFCWTQRDUFTEU-GFCCVEGCSA-N 0 3 349.770 3.594 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CC[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666338 1136491845 /nfs/dbraw/zinc/49/18/45/1136491845.db2.gz GMGJIIKVNURMBM-YJBOKZPZSA-N 0 3 346.814 3.771 20 5 EHBDHN Cc1ccc(O[C@@H]2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858040794 1136934439 /nfs/dbraw/zinc/93/44/39/1136934439.db2.gz QGEJQCXSUFLQPN-DOTOQJQBSA-N 0 3 341.411 3.821 20 5 EHBDHN CN(C)Cc1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000339058930 1137192411 /nfs/dbraw/zinc/19/24/11/1137192411.db2.gz JDCKZINDCPWFIW-UHFFFAOYSA-N 0 3 339.351 3.655 20 5 EHBDHN C[C@@H](CSc1ccccc1)N(C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359983 1137215348 /nfs/dbraw/zinc/21/53/48/1137215348.db2.gz LXGJXYNJJPNODU-KSSFIOAISA-N 0 3 346.452 3.741 20 5 EHBDHN COCc1cc([C@@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)ccc1OC ZINC000866539301 1137362856 /nfs/dbraw/zinc/36/28/56/1137362856.db2.gz JQFRTRQWJFLXAR-CQSZACIVSA-N 0 3 344.411 3.909 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000873097792 1137590165 /nfs/dbraw/zinc/59/01/65/1137590165.db2.gz FZHGVGQKFVNBHC-LFPIHBKWSA-N 0 3 346.452 3.800 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(CN2CCC[C@H]2C2CC2)o1 ZINC000878050630 1137700843 /nfs/dbraw/zinc/70/08/43/1137700843.db2.gz ZLZALHDQRGKBCE-ZDUSSCGKSA-N 0 3 348.790 3.673 20 5 EHBDHN C[C@H]1CCC[C@H]1NCc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878507752 1137718388 /nfs/dbraw/zinc/71/83/88/1137718388.db2.gz JPBFLDWDBDHSSH-JOYOIKCWSA-N 0 3 336.779 3.576 20 5 EHBDHN CC(C)n1cnnc1[C@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000118861037 1137935989 /nfs/dbraw/zinc/93/59/89/1137935989.db2.gz UBSOWEIZGBFNTQ-HOCLYGCPSA-N 0 3 343.431 3.708 20 5 EHBDHN C[C@@H]1C[C@@H](C)CC[C@@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000119245033 1137939506 /nfs/dbraw/zinc/93/95/06/1137939506.db2.gz GXQJTLBXQIGZSW-ZOWXZIJZSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@@H](NCc1ccc(F)c(CN(C)C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000120958380 1137953978 /nfs/dbraw/zinc/95/39/78/1137953978.db2.gz CQKHGNGACFPSAH-CYBMUJFWSA-N 0 3 331.391 3.646 20 5 EHBDHN CC(C)(C)OC(=O)CC1(NCc2cccnc2[N+](=O)[O-])CCCCC1 ZINC000886274505 1138063198 /nfs/dbraw/zinc/06/31/98/1138063198.db2.gz VCBQYJCDTYAZFT-UHFFFAOYSA-N 0 3 349.431 3.514 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@@H](O)c2ccccc2C)cc1[N+](=O)[O-] ZINC000153750109 1139150911 /nfs/dbraw/zinc/15/09/11/1139150911.db2.gz GQFIYOVMVJDOFD-RDTXWAMCSA-N 0 3 344.411 3.686 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177330032 1139613187 /nfs/dbraw/zinc/61/31/87/1139613187.db2.gz NUJRACZXLIEOQI-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](Cc2ccccc2)C1 ZINC000610215037 1015006763 /nfs/dbraw/zinc/00/67/63/1015006763.db2.gz YELKGCHBPYNEKH-INIZCTEOSA-N 0 3 326.396 3.668 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H](CC2CC2)C1 ZINC000339670820 1015491718 /nfs/dbraw/zinc/49/17/18/1015491718.db2.gz FUFRMWBBMHGYDF-JSGCOSHPSA-N 0 3 342.399 3.828 20 5 EHBDHN COc1ccc([C@@H](C)CN2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000538279529 1032267236 /nfs/dbraw/zinc/26/72/36/1032267236.db2.gz KEMYBECXNGQSGT-AWEZNQCLSA-N 0 3 326.396 3.765 20 5 EHBDHN COc1ccccc1/C=C\CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000567000770 1032291838 /nfs/dbraw/zinc/29/18/38/1032291838.db2.gz RJRNRLANVITAHV-YFHOEESVSA-N 0 3 326.396 3.791 20 5 EHBDHN COc1ccc(C)cc1[C@@H](C)NCCOc1ccccc1[N+](=O)[O-] ZINC000459666392 1032394931 /nfs/dbraw/zinc/39/49/31/1032394931.db2.gz MNPJCOIYRJDASK-CQSZACIVSA-N 0 3 330.384 3.641 20 5 EHBDHN COc1ccc(C2CCN([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)nc1 ZINC000593041483 1032676731 /nfs/dbraw/zinc/67/67/31/1032676731.db2.gz QKKXHQBVZLGNQU-AWEZNQCLSA-N 0 3 341.411 3.939 20 5 EHBDHN COc1ccc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1O ZINC000449506992 1032691837 /nfs/dbraw/zinc/69/18/37/1032691837.db2.gz ZZYMDYKZVKYOMK-MRXNPFEDSA-N 0 3 342.395 3.689 20 5 EHBDHN O=[N+]([O-])c1cc(F)ccc1NCC1(N2CCSCC2)CCCC1 ZINC000513184792 1019403014 /nfs/dbraw/zinc/40/30/14/1019403014.db2.gz PRUVTLCNHNLUMN-UHFFFAOYSA-N 0 3 339.436 3.507 20 5 EHBDHN CC[C@H](NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000341203900 1021094980 /nfs/dbraw/zinc/09/49/80/1021094980.db2.gz DEEIOVIOGVSHTP-INIZCTEOSA-N 0 3 327.384 3.583 20 5 EHBDHN CSCCCCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602559708 1032972598 /nfs/dbraw/zinc/97/25/98/1032972598.db2.gz ZWTXZGGUSDRZDH-UHFFFAOYSA-N 0 3 339.280 3.652 20 5 EHBDHN C[C@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccs1 ZINC000602561034 1032973211 /nfs/dbraw/zinc/97/32/11/1032973211.db2.gz PPYSTWHLKCFFGX-NSHDSACASA-N 0 3 331.397 3.766 20 5 EHBDHN COc1ccc(CN[C@@H]2CCCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000449653041 1032979660 /nfs/dbraw/zinc/97/96/60/1032979660.db2.gz RMKJOAIVIGBEEH-MRXNPFEDSA-N 0 3 341.411 3.664 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCCN(Cc3cccs3)C2)n1 ZINC000178201372 1022099812 /nfs/dbraw/zinc/09/98/12/1022099812.db2.gz LHOKEVPWLAWQKO-CQSZACIVSA-N 0 3 346.456 3.684 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548336453 1022375350 /nfs/dbraw/zinc/37/53/50/1022375350.db2.gz JTMBQUVGXPWYQY-GJZGRUSLSA-N 0 3 340.427 3.678 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN3CCC[C@H]3Cc3ccccc3)nc2c1 ZINC000610580805 1022780819 /nfs/dbraw/zinc/78/08/19/1022780819.db2.gz LJZUEXLAKUFOJG-HNNXBMFYSA-N 0 3 337.379 3.943 20 5 EHBDHN Cn1cc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C2CC2)n1 ZINC000894723774 1022820086 /nfs/dbraw/zinc/82/00/86/1022820086.db2.gz PLIIYLSILZFIIR-MRXNPFEDSA-N 0 3 340.427 3.585 20 5 EHBDHN CCCN(Cc1cccc([N+](=O)[O-])c1)C[C@@H]1COc2ccccc2O1 ZINC000610705517 1023277175 /nfs/dbraw/zinc/27/71/75/1023277175.db2.gz RIBLUEHQPADKBV-QGZVFWFLSA-N 0 3 342.395 3.647 20 5 EHBDHN CC(C)(CNCc1ccc([N+](=O)[O-])cc1Cl)C1(O)CCCC1 ZINC000449741235 1033143344 /nfs/dbraw/zinc/14/33/44/1033143344.db2.gz SVCRMAPTBPFYSO-UHFFFAOYSA-N 0 3 326.824 3.669 20 5 EHBDHN Cc1c(CN(Cc2ccccc2)CC2(CO)CC2)cccc1[N+](=O)[O-] ZINC000341951811 1023716979 /nfs/dbraw/zinc/71/69/79/1023716979.db2.gz NPMFVELGRVYJMR-UHFFFAOYSA-N 0 3 340.423 3.678 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000610818798 1023782784 /nfs/dbraw/zinc/78/27/84/1023782784.db2.gz SJTBIYJDLPQPAP-NWDGAFQWSA-N 0 3 340.383 3.897 20 5 EHBDHN CC1=NO[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000895311297 1024269649 /nfs/dbraw/zinc/26/96/49/1024269649.db2.gz ONSLNTSNSVIMHX-LBPRGKRZSA-N 0 3 331.397 3.578 20 5 EHBDHN CC1CCN([C@@H](CNc2ccc([N+](=O)[O-])cn2)c2cccs2)CC1 ZINC000025371280 1024733859 /nfs/dbraw/zinc/73/38/59/1024733859.db2.gz ZIQIOGHQRZKYGZ-HNNXBMFYSA-N 0 3 346.456 3.936 20 5 EHBDHN CC(C)n1cncc1CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000425369119 1024886663 /nfs/dbraw/zinc/88/66/63/1024886663.db2.gz LETUNNZTAPQTRX-INIZCTEOSA-N 0 3 328.416 3.752 20 5 EHBDHN CC1(C)CCCC[C@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000119943903 1025477859 /nfs/dbraw/zinc/47/78/59/1025477859.db2.gz MRPBGOVDVNFPSE-CQSZACIVSA-N 0 3 330.388 3.703 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H]2Cc3[nH]c4ccccc4c3C2)c(Cl)c1 ZINC000442852935 1025550687 /nfs/dbraw/zinc/55/06/87/1025550687.db2.gz YRXFWRUYQIPMEV-GFCCVEGCSA-N 0 3 341.798 3.987 20 5 EHBDHN CC[C@@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000738417609 1026075999 /nfs/dbraw/zinc/07/59/99/1026075999.db2.gz RAQBFCDBVOTHAZ-IAGOWNOFSA-N 0 3 336.338 3.647 20 5 EHBDHN CCN(Cc1ccccc1[N+](=O)[O-])[C@H](COC)Cc1ccccc1 ZINC000530627265 1026151544 /nfs/dbraw/zinc/15/15/44/1026151544.db2.gz NATVLFBXZOMGNG-SFHVURJKSA-N 0 3 328.412 3.674 20 5 EHBDHN Cc1cnc(NC[C@@H](c2cccs2)N2CCCC2)c([N+](=O)[O-])c1 ZINC000078625688 1028046646 /nfs/dbraw/zinc/04/66/46/1028046646.db2.gz NJUUNXDRHCJUGS-AWEZNQCLSA-N 0 3 332.429 3.609 20 5 EHBDHN CC[C@H]1CCCC[C@@H]1N(C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680974 1028150509 /nfs/dbraw/zinc/15/05/09/1028150509.db2.gz XWJDRIGGGIGOOL-YOEHRIQHSA-N 0 3 333.432 3.742 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(CCO)C1CCCCC1 ZINC000532747140 1028765588 /nfs/dbraw/zinc/76/55/88/1028765588.db2.gz QVSRIYYJURZQRO-UHFFFAOYSA-N 0 3 336.432 3.509 20 5 EHBDHN CC[C@H](O)CN(Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000441059130 1029725215 /nfs/dbraw/zinc/72/52/15/1029725215.db2.gz IJGYMGYUABMCMK-SFHVURJKSA-N 0 3 328.412 3.676 20 5 EHBDHN CC(C)(C)OC(=O)CCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000525697566 1030027575 /nfs/dbraw/zinc/02/75/75/1030027575.db2.gz CIGXLQHZNCXMPB-UHFFFAOYSA-N 0 3 346.383 3.676 20 5 EHBDHN CCC[C@H](N[C@H](C(=O)N(C)CC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000453295449 1030042323 /nfs/dbraw/zinc/04/23/23/1030042323.db2.gz YCNGUPWVIVCSHQ-IRXDYDNUSA-N 0 3 335.448 3.529 20 5 EHBDHN C[C@@H]1CCC[C@H](C)[C@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000245834570 1030268120 /nfs/dbraw/zinc/26/81/20/1030268120.db2.gz AVWQANPUKKMQHY-ATCWAGBWSA-N 0 3 330.388 3.559 20 5 EHBDHN CC(C)CC[C@@H]1CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532013892 1030272626 /nfs/dbraw/zinc/27/26/26/1030272626.db2.gz ZEALOROLMXXQAH-INIZCTEOSA-N 0 3 334.416 3.862 20 5 EHBDHN Cc1cccc([C@H]2CCCN2CCOc2cccc([N+](=O)[O-])c2)n1 ZINC000159870421 1030418449 /nfs/dbraw/zinc/41/84/49/1030418449.db2.gz JNXQIBNMAWEEAN-GOSISDBHSA-N 0 3 327.384 3.514 20 5 EHBDHN C[C@@H]1CCCC[C@@H]1N(C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607376 1030750967 /nfs/dbraw/zinc/75/09/67/1030750967.db2.gz OSCIMSKGPUCKGO-DOMZBBRYSA-N 0 3 330.388 3.655 20 5 EHBDHN CC1(C)C[C@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000160440654 1030754373 /nfs/dbraw/zinc/75/43/73/1030754373.db2.gz LGGKINBDIYWRBS-CYBMUJFWSA-N 0 3 347.440 3.766 20 5 EHBDHN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1cccc(CN(C)C)c1 ZINC000477203623 1031333355 /nfs/dbraw/zinc/33/33/55/1031333355.db2.gz NWKUYHCFXUTXAU-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H](c2nc(C)no2)C1 ZINC000347365243 1031870496 /nfs/dbraw/zinc/87/04/96/1031870496.db2.gz SZUBITLGGQRBPE-LRFDDAOPSA-N 0 3 342.399 3.569 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1c(C2CCC2)cnn1C ZINC000594984275 1033618397 /nfs/dbraw/zinc/61/83/97/1033618397.db2.gz QPIIBPYWRFSQFW-ZROIWOOFSA-N 0 3 340.427 3.789 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H](C)c1c(C)noc1C ZINC000595035036 1033654920 /nfs/dbraw/zinc/65/49/20/1033654920.db2.gz GMLKMSHAFHKRJQ-GHMZBOCLSA-N 0 3 333.388 3.663 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC1(c2ccccn2)CCC1 ZINC000595042534 1033660126 /nfs/dbraw/zinc/66/01/26/1033660126.db2.gz HKUVAUSLRGDSGS-CQSZACIVSA-N 0 3 341.411 3.771 20 5 EHBDHN CCc1nc(CCN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cs1 ZINC000595045352 1033663649 /nfs/dbraw/zinc/66/36/49/1033663649.db2.gz YWJPSRJAAAXJSL-NSHDSACASA-N 0 3 335.429 3.516 20 5 EHBDHN COc1cccc([C@H](CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)OC)c1 ZINC000599061971 1033701357 /nfs/dbraw/zinc/70/13/57/1033701357.db2.gz MXIKLEZSXSQVJS-LIRRHRJNSA-N 0 3 344.411 3.950 20 5 EHBDHN Cc1ccc(CN2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1[N+](=O)[O-] ZINC000597205770 1034609307 /nfs/dbraw/zinc/60/93/07/1034609307.db2.gz IMWYTWIDLUSZGV-RBUKOAKNSA-N 0 3 340.423 3.501 20 5 EHBDHN C[C@H](O)C1(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000597234408 1034615497 /nfs/dbraw/zinc/61/54/97/1034615497.db2.gz KTOUVMRYEJXFGI-LBPRGKRZSA-N 0 3 346.358 3.529 20 5 EHBDHN C[C@@H](O)C1(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000597234407 1034616330 /nfs/dbraw/zinc/61/63/30/1034616330.db2.gz KTOUVMRYEJXFGI-GFCCVEGCSA-N 0 3 346.358 3.529 20 5 EHBDHN Cc1c([C@@H](C)NCCNC(=O)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000089666372 1035511577 /nfs/dbraw/zinc/51/15/77/1035511577.db2.gz KEQGFXVDOFJAJL-OAHLLOKOSA-N 0 3 347.459 3.640 20 5 EHBDHN Cc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000056201701 1036140072 /nfs/dbraw/zinc/14/00/72/1036140072.db2.gz NWINZMQIQHUXKZ-KBPBESRZSA-N 0 3 327.384 3.581 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCC(=O)Nc1ccccc1 ZINC000164985599 1036180556 /nfs/dbraw/zinc/18/05/56/1036180556.db2.gz WWWAZKIOKYDYQX-AWEZNQCLSA-N 0 3 327.384 3.583 20 5 EHBDHN C[C@H](N[C@@H]1CCCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191290573 1036889541 /nfs/dbraw/zinc/88/95/41/1036889541.db2.gz GKIYEJFGJXXJCQ-SMDDNHRTSA-N 0 3 330.388 3.874 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)N2CC[C@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000443651849 1036940849 /nfs/dbraw/zinc/94/08/49/1036940849.db2.gz JXVZIURJJKLCLL-YDHLFZDLSA-N 0 3 333.432 3.598 20 5 EHBDHN CC[C@H]1CCCC[C@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000163396193 1037095186 /nfs/dbraw/zinc/09/51/86/1037095186.db2.gz OIDDBNWMHYVZHX-SWLSCSKDSA-N 0 3 330.388 3.703 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@@]3(C)CCO[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000542316627 1037281180 /nfs/dbraw/zinc/28/11/80/1037281180.db2.gz WUQDVDGPPMAKMV-XIKOKIGWSA-N 0 3 346.383 3.521 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1C[C@@H]1Cc1ccccc1 ZINC000462751804 1037364432 /nfs/dbraw/zinc/36/44/32/1037364432.db2.gz CFKAMZYKGYEIPL-YJBOKZPZSA-N 0 3 326.396 3.714 20 5 EHBDHN CC[C@H]1CCCC[C@@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000163410916 1037375019 /nfs/dbraw/zinc/37/50/19/1037375019.db2.gz XTSAZFUQMBCSMZ-WFASDCNBSA-N 0 3 330.388 3.703 20 5 EHBDHN CC[C@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341220565 1037784438 /nfs/dbraw/zinc/78/44/38/1037784438.db2.gz NVGNGAFCBIGPCG-DYVFJYSZSA-N 0 3 327.384 3.663 20 5 EHBDHN O=[N+]([O-])c1ccccc1CNCC[C@H]1CSc2ccccc2O1 ZINC000592373103 1037923742 /nfs/dbraw/zinc/92/37/42/1037923742.db2.gz UIUMLNCGYLQPNO-AWEZNQCLSA-N 0 3 330.409 3.628 20 5 EHBDHN Cc1cccc([C@H](O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC001167735185 1038444260 /nfs/dbraw/zinc/44/42/60/1038444260.db2.gz UTQFLTWBBXGVSJ-LJQANCHMSA-N 0 3 326.396 3.601 20 5 EHBDHN COc1cc(CN2CCC(c3ccc(O)cc3)CC2)ccc1[N+](=O)[O-] ZINC000485743591 1039505142 /nfs/dbraw/zinc/50/51/42/1039505142.db2.gz KJLIOZGLWANGQC-UHFFFAOYSA-N 0 3 342.395 3.689 20 5 EHBDHN Cc1cccc(-c2n[nH]cc2CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC000480480286 1039584642 /nfs/dbraw/zinc/58/46/42/1039584642.db2.gz HFMSTJRPOBUISN-UHFFFAOYSA-N 0 3 336.395 3.892 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ccc(CO)c(F)c1)CCCC2 ZINC000417342482 1039705118 /nfs/dbraw/zinc/70/51/18/1039705118.db2.gz PBSVVUDTRTXPJA-IBGZPJMESA-N 0 3 344.386 3.784 20 5 EHBDHN Cc1c(CN2CCC[C@H](Nc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000490071077 1040332891 /nfs/dbraw/zinc/33/28/91/1040332891.db2.gz YLNFBJVZKJEEGW-SFHVURJKSA-N 0 3 325.412 3.980 20 5 EHBDHN C[C@@]1(O)C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000418110588 1040585722 /nfs/dbraw/zinc/58/57/22/1040585722.db2.gz JPFMIGGJZWHCRV-RSVKCKOMSA-N 0 3 336.775 3.511 20 5 EHBDHN CCC[C@H](C)N(C)Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491182646 1040944128 /nfs/dbraw/zinc/94/41/28/1040944128.db2.gz NEFVVCIDCFUKLO-NSHDSACASA-N 0 3 346.374 3.868 20 5 EHBDHN CCS[C@H]1CCCCN(Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000738221953 1041081729 /nfs/dbraw/zinc/08/17/29/1041081729.db2.gz QFUGDAQOGSULIR-HNNXBMFYSA-N 0 3 334.445 3.510 20 5 EHBDHN O=[N+]([O-])c1ccc(CCNCc2cscc2Br)cc1 ZINC000382277639 1042677912 /nfs/dbraw/zinc/67/79/12/1042677912.db2.gz KBJFAZNSSIWVJQ-UHFFFAOYSA-N 0 3 341.230 3.751 20 5 EHBDHN CCN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCC1 ZINC000072948518 1042944170 /nfs/dbraw/zinc/94/41/70/1042944170.db2.gz LKHUOVGJRNOREZ-UHFFFAOYSA-N 0 3 330.388 3.799 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@@H]2CCCCS2)c1 ZINC000344362185 1043740377 /nfs/dbraw/zinc/74/03/77/1043740377.db2.gz RRSOQLZQZJMCRX-LBPRGKRZSA-N 0 3 332.372 3.572 20 5 EHBDHN C[C@H](NCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1COc2ccccc21 ZINC000185547094 1126932704 /nfs/dbraw/zinc/93/27/04/1126932704.db2.gz XILLVHZSWMXRDZ-XHDPSFHLSA-N 0 3 332.787 3.903 20 5 EHBDHN Cc1ccnc(NC[C@@H]2CCCN(Cc3cccs3)C2)c1[N+](=O)[O-] ZINC000301302497 1127736052 /nfs/dbraw/zinc/73/60/52/1127736052.db2.gz RWQOYZXBWFEFJM-AWEZNQCLSA-N 0 3 346.456 3.684 20 5 EHBDHN Cc1cnc(NC[C@H]2CCCN(C)[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000301444913 1127932497 /nfs/dbraw/zinc/93/24/97/1127932497.db2.gz NRPXYXQGNBOLEV-CZUORRHYSA-N 0 3 346.456 3.855 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CCN2Cc2ccccc2)c2ncccc12 ZINC000715715945 1128810779 /nfs/dbraw/zinc/81/07/79/1128810779.db2.gz VESHJPTWEKZESQ-INIZCTEOSA-N 0 3 348.406 3.829 20 5 EHBDHN Cc1nc(NC[C@@H](c2cccs2)N2CCCC2)ccc1[N+](=O)[O-] ZINC000301657099 1128847124 /nfs/dbraw/zinc/84/71/24/1128847124.db2.gz SFMXKZMFXFREEX-AWEZNQCLSA-N 0 3 332.429 3.609 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H](c1cccs1)C1CC1 ZINC000542511467 1120862181 /nfs/dbraw/zinc/86/21/81/1120862181.db2.gz RFDFIGGJFFMSBZ-KRWDZBQOSA-N 0 3 345.424 3.644 20 5 EHBDHN CCN(C)Cc1cccc(CNc2cccc([N+](=O)[O-])c2C(C)=O)c1 ZINC000763203557 1121868833 /nfs/dbraw/zinc/86/88/33/1121868833.db2.gz NOUPQABSKSEXBD-UHFFFAOYSA-N 0 3 341.411 3.861 20 5 EHBDHN CN(CCCCc1ccccc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917477103 1122612589 /nfs/dbraw/zinc/61/25/89/1122612589.db2.gz UGIZHFAOZKXCKW-UHFFFAOYSA-N 0 3 338.411 3.857 20 5 EHBDHN CC(C)c1ccc(CN(C)C[C@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000556894617 1123171904 /nfs/dbraw/zinc/17/19/04/1123171904.db2.gz CLXAZBCJPHOICK-GOSISDBHSA-N 0 3 342.439 3.754 20 5 EHBDHN CN1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000301837153 1129169096 /nfs/dbraw/zinc/16/90/96/1129169096.db2.gz MKASNDFHOUXTGE-DZGCQCFKSA-N 0 3 332.791 3.501 20 5 EHBDHN O=[N+]([O-])c1ccn(C2CCN(C/C=C\c3ccc(Cl)cc3)CC2)n1 ZINC000618759973 1125192234 /nfs/dbraw/zinc/19/22/34/1125192234.db2.gz JTAMJHGOOUTWQW-UPHRSURJSA-N 0 3 346.818 3.795 20 5 EHBDHN CCOc1cc(NC[C@@H](c2cccs2)N(C)C)ccc1[N+](=O)[O-] ZINC000080763402 1125348310 /nfs/dbraw/zinc/34/83/10/1125348310.db2.gz VXCNBTKGPBZUBJ-AWEZNQCLSA-N 0 3 335.429 3.770 20 5 EHBDHN C[C@@]1(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO[C@@H]1C1CC1 ZINC000543242307 1129366065 /nfs/dbraw/zinc/36/60/65/1129366065.db2.gz JYRCIKWWZPTKFE-RTBURBONSA-N 0 3 342.395 3.902 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H](C)c1c(C)cccc1C ZINC000555059632 1129524833 /nfs/dbraw/zinc/52/48/33/1129524833.db2.gz RJYZJGGPUBGQON-OAHLLOKOSA-N 0 3 341.411 3.809 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000331280987 1129658776 /nfs/dbraw/zinc/65/87/76/1129658776.db2.gz UPNMSOQLMODUQD-CABCVRRESA-N 0 3 347.459 3.530 20 5 EHBDHN Cc1cc(C)n(CCCNc2cc(C)nc3ccc([N+](=O)[O-])cc32)n1 ZINC000302168525 1129771380 /nfs/dbraw/zinc/77/13/80/1129771380.db2.gz LLQYNMHMFQVWSK-UHFFFAOYSA-N 0 3 339.399 3.767 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@H]3C3CCCC3)n2)c1 ZINC000055927423 1129790250 /nfs/dbraw/zinc/79/02/50/1129790250.db2.gz OVLWPJLRCGIEKS-INIZCTEOSA-N 0 3 342.399 3.799 20 5 EHBDHN Cc1ccc([C@@H](CN[C@@H](C)c2cccc([N+](=O)[O-])c2)N2CCCC2)o1 ZINC000173371036 1130219352 /nfs/dbraw/zinc/21/93/52/1130219352.db2.gz WNANDWZYALZFQX-MAUKXSAKSA-N 0 3 343.427 3.984 20 5 EHBDHN C[C@H](c1ccc(Cl)cc1)N(CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000174831174 1130387379 /nfs/dbraw/zinc/38/73/79/1130387379.db2.gz PDIBPQNVRMVQPY-GFCCVEGCSA-N 0 3 334.807 3.670 20 5 EHBDHN COc1ccccc1OCCNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429255562 1130400692 /nfs/dbraw/zinc/40/06/92/1130400692.db2.gz NNWAKKMKKCDBSG-UHFFFAOYSA-N 0 3 330.384 3.507 20 5 EHBDHN Cc1cccc(C)c1CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000738297761 1131467145 /nfs/dbraw/zinc/46/71/45/1131467145.db2.gz BJEGYSVOKIGAKQ-UHFFFAOYSA-N 0 3 325.412 3.534 20 5 EHBDHN Cc1nc([C@@H](C)N[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cs1 ZINC001172899035 1131883008 /nfs/dbraw/zinc/88/30/08/1131883008.db2.gz LBNVLCVHHMRUCS-ABAIWWIYSA-N 0 3 331.441 3.958 20 5 EHBDHN CC(=O)[C@@H](N[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172901828 1131885066 /nfs/dbraw/zinc/88/50/66/1131885066.db2.gz PRNYAYTUACMKCI-UYAOXDASSA-N 0 3 338.407 3.762 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N(C)Cc2cccs2)c1F ZINC001173188542 1131994124 /nfs/dbraw/zinc/99/41/24/1131994124.db2.gz GMRNPVRCDZFWKS-LLVKDONJSA-N 0 3 338.404 3.867 20 5 EHBDHN COc1ccc(F)c(CN[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1F ZINC001173216001 1132001578 /nfs/dbraw/zinc/00/15/78/1132001578.db2.gz GYDMZIYPTRFSPW-LLVKDONJSA-N 0 3 336.338 3.602 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@](CF)(C(F)(F)F)C1 ZINC001173221260 1132004242 /nfs/dbraw/zinc/00/42/42/1132004242.db2.gz GSEJDXUPRPRGAE-SMDDNHRTSA-N 0 3 334.313 3.750 20 5 EHBDHN COc1cccnc1[C@H](N[C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173228805 1132008518 /nfs/dbraw/zinc/00/85/18/1132008518.db2.gz KLGGMNMMAQCISX-SCLBCKFNSA-N 0 3 341.411 3.670 20 5 EHBDHN Cc1cc2cc3cc(C)c(Nc4cnn(CCO)c4)cc3nc2cc1N ZINC001176479645 1132943464 /nfs/dbraw/zinc/94/34/64/1132943464.db2.gz SVUTWOBTPBAEQR-UHFFFAOYSA-N 0 3 347.422 3.519 20 5 EHBDHN COCC[C@@H]1CCCCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000767941490 1133073734 /nfs/dbraw/zinc/07/37/34/1133073734.db2.gz RWUSEZAKLCKDED-ZDUSSCGKSA-N 0 3 326.824 3.887 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(C[C@@H](O)c2cccc(Cl)c2)C2CC2)c1 ZINC000768544274 1133157880 /nfs/dbraw/zinc/15/78/80/1133157880.db2.gz KUXCNTBBHQELRU-GOSISDBHSA-N 0 3 346.814 3.946 20 5 EHBDHN O=[N+]([O-])c1c(N2CCN(C3CCCC3)CC2)cccc1C(F)(F)F ZINC001184793222 1133991678 /nfs/dbraw/zinc/99/16/78/1133991678.db2.gz YNOBGVJMRWYQFI-UHFFFAOYSA-N 0 3 343.349 3.678 20 5 EHBDHN Cc1ccccc1[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774873511 1134089097 /nfs/dbraw/zinc/08/90/97/1134089097.db2.gz JGAUFQWRAYTOEC-CQSZACIVSA-N 0 3 341.367 3.801 20 5 EHBDHN CCCCO[C@@H]1C[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(C)C ZINC001170118492 1134327305 /nfs/dbraw/zinc/32/73/05/1134327305.db2.gz QXANYTVPNYAAFJ-HZPDHXFCSA-N 0 3 346.431 3.545 20 5 EHBDHN C[C@@H]1CN(CCCCNc2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000791412125 1134547408 /nfs/dbraw/zinc/54/74/08/1134547408.db2.gz BRMQVSUTVWYIKW-BETUJISGSA-N 0 3 341.839 3.550 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170326629 1134748436 /nfs/dbraw/zinc/74/84/36/1134748436.db2.gz AVXJPVCKUHXAPD-CQSZACIVSA-N 0 3 326.396 3.593 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCC[C@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346415 1134760060 /nfs/dbraw/zinc/76/00/60/1134760060.db2.gz NMMLDMXVCYYKEB-KSSFIOAISA-N 0 3 341.411 3.767 20 5 EHBDHN CN(CCSc1c([N+](=O)[O-])cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000804674193 1135164289 /nfs/dbraw/zinc/16/42/89/1135164289.db2.gz OKNQRONPQYUGEB-UHFFFAOYSA-N 0 3 347.396 3.727 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H](C3CCOCC3)C2)c(F)c1 ZINC001197283387 1135672866 /nfs/dbraw/zinc/67/28/66/1135672866.db2.gz BHKRZLWOBZZZHT-OAHLLOKOSA-N 0 3 336.407 3.763 20 5 EHBDHN COc1cc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)c([N+](=O)[O-])cc1[O-] ZINC001199053505 1135876355 /nfs/dbraw/zinc/87/63/55/1135876355.db2.gz ZZWVRQRXCPJPNJ-KCQAQPDRSA-N 0 3 334.416 3.758 20 5 EHBDHN CN1CC[C@@H](NCc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000810006291 1135913100 /nfs/dbraw/zinc/91/31/00/1135913100.db2.gz IONOOZLGSUXEGB-AEFFLSMTSA-N 0 3 345.830 3.783 20 5 EHBDHN C[C@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CN1C1CC1 ZINC000811484366 1136091743 /nfs/dbraw/zinc/09/17/43/1136091743.db2.gz VJUBXPBZFORUOO-JOYOIKCWSA-N 0 3 344.242 3.616 20 5 EHBDHN CC[C@H]1c2ccsc2CCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275027 1136129159 /nfs/dbraw/zinc/12/91/59/1136129159.db2.gz FOMIBXORJSPDOV-HOTGVXAUSA-N 0 3 332.425 3.699 20 5 EHBDHN C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274369 1136129398 /nfs/dbraw/zinc/12/93/98/1136129398.db2.gz HFTLOTDYQPDFFQ-GTNSWQLSSA-N 0 3 336.338 3.599 20 5 EHBDHN COC[C@H](C)Oc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000850312339 1136234105 /nfs/dbraw/zinc/23/41/05/1136234105.db2.gz JHYGVEYSHYOILR-GJZGRUSLSA-N 0 3 344.411 3.859 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C)[C@H](O)c1ccc(F)cc1 ZINC000850437083 1136258693 /nfs/dbraw/zinc/25/86/93/1136258693.db2.gz ZCJWUWGRTRDVRM-IUUKEHGRSA-N 0 3 348.374 3.515 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C)C[C@H](O)c1ccccc1 ZINC000850442017 1136259144 /nfs/dbraw/zinc/25/91/44/1136259144.db2.gz JRAKJLXVSXCYGZ-DEYYWGMASA-N 0 3 344.411 3.766 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C)[C@H](O)c1cccc(F)c1 ZINC000850444410 1136259876 /nfs/dbraw/zinc/25/98/76/1136259876.db2.gz JFUZKKSGQMVWSO-PZROIBLQSA-N 0 3 348.374 3.515 20 5 EHBDHN CCC[C@@H](NC[C@]12OCCC[C@H]1C2(F)F)c1cccc([N+](=O)[O-])c1 ZINC000850534080 1136281181 /nfs/dbraw/zinc/28/11/81/1136281181.db2.gz ILXFUVOJRBRIFP-OAGGEKHMSA-N 0 3 340.370 3.840 20 5 EHBDHN Cc1nc(-c2ccc(C)cc2C)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813106899 1136293911 /nfs/dbraw/zinc/29/39/11/1136293911.db2.gz HMFJKJBAZUHBRY-NSHDSACASA-N 0 3 334.397 3.557 20 5 EHBDHN CC(COC(=O)[C@@H](C)Sc1cc(Cl)ccc1Cl)[N+](=O)[O-] ZINC000813109768 1136294260 /nfs/dbraw/zinc/29/42/60/1136294260.db2.gz OKJBRONJRWXFSC-HTQZYQBOSA-N 0 3 338.212 3.682 20 5 EHBDHN CC(C)[C@@H](NCc1ccc(F)cc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000852034816 1136428444 /nfs/dbraw/zinc/42/84/44/1136428444.db2.gz JFHDHUVTBJXUFX-QZTJIDSGSA-N 0 3 332.375 3.582 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CNC2(c3cccc(Cl)c3)CC2)cc1 ZINC000776604832 1136468709 /nfs/dbraw/zinc/46/87/09/1136468709.db2.gz HTUMYYUIKDLWTE-MRXNPFEDSA-N 0 3 332.787 3.561 20 5 EHBDHN CC([C@@H](OC(=O)[C@H](F)Cc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845873710 1137316243 /nfs/dbraw/zinc/31/62/43/1137316243.db2.gz DRPICCPHTINLGT-CSMYWGQOSA-N 0 3 349.333 3.656 20 5 EHBDHN Cc1ccc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])s1 ZINC000845875047 1137316492 /nfs/dbraw/zinc/31/64/92/1137316492.db2.gz KVCGONARCLANMG-MEDUHNTESA-N 0 3 337.372 3.688 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H](C)c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881187 1137316911 /nfs/dbraw/zinc/31/69/11/1137316911.db2.gz ZENLTFVNDZVPQR-GDZNZVCISA-N 0 3 331.343 3.879 20 5 EHBDHN CC([C@@H](OC(=O)CCCOC(C)(C)C)c1ccccc1F)[N+](=O)[O-] ZINC000845883821 1137317164 /nfs/dbraw/zinc/31/71/64/1137317164.db2.gz WFPMMFVMXQEKEK-BLLLJJGKSA-N 0 3 341.379 3.671 20 5 EHBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)[C@](C)(O)c1ccccc1 ZINC000846035341 1137328462 /nfs/dbraw/zinc/32/84/62/1137328462.db2.gz GSQXXGWVKYLMJJ-SJCJKPOMSA-N 0 3 334.803 3.634 20 5 EHBDHN COc1ccc(CCN[C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000872017162 1137564762 /nfs/dbraw/zinc/56/47/62/1137564762.db2.gz VPCAWVSRPBJJPS-GFCCVEGCSA-N 0 3 348.374 3.644 20 5 EHBDHN C[C@H](N[C@@H]1CCO[C@@H](c2ccncc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872075566 1137570043 /nfs/dbraw/zinc/57/00/43/1137570043.db2.gz DUPCUFBTPUFACD-DXCKQFNASA-N 0 3 345.374 3.700 20 5 EHBDHN C[C@H](CC(=O)N(C)c1ccccc1)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129786 1137573041 /nfs/dbraw/zinc/57/30/41/1137573041.db2.gz TZLRSULDVHQSIH-CABCVRRESA-N 0 3 341.411 3.687 20 5 EHBDHN C[C@H](CC(=O)Nc1ccc(F)cc1)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129845 1137573090 /nfs/dbraw/zinc/57/30/90/1137573090.db2.gz YXPGREOAGBOLEB-OLZOCXBDSA-N 0 3 345.374 3.802 20 5 EHBDHN O=[N+]([O-])c1ccc(CCCCNCc2nc(Cl)cs2)cc1 ZINC000877070165 1137669458 /nfs/dbraw/zinc/66/94/58/1137669458.db2.gz SRJLXWBWYZSFMG-UHFFFAOYSA-N 0 3 325.821 3.817 20 5 EHBDHN C[C@H]1CCC[C@H](C)C1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878351736 1137712118 /nfs/dbraw/zinc/71/21/18/1137712118.db2.gz YYYORIHGIMNKLG-RYUDHWBXSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@H]1c2sccc2CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000880376968 1137777028 /nfs/dbraw/zinc/77/70/28/1137777028.db2.gz NBDHJYBJCBLCOW-LBPRGKRZSA-N 0 3 345.424 3.604 20 5 EHBDHN CN(C)C[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000282915562 1137952026 /nfs/dbraw/zinc/95/20/26/1137952026.db2.gz VKQITJVTLWLCER-QGZVFWFLSA-N 0 3 333.819 3.641 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC2(c3cccc(F)c3)CCOCC2)cc1 ZINC000174645700 1139432500 /nfs/dbraw/zinc/43/25/00/1139432500.db2.gz XAFDMELVUPRBCF-UHFFFAOYSA-N 0 3 330.359 3.529 20 5 EHBDHN C[C@H](NC[C@@H]1COC2(CCCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777316147 1139576536 /nfs/dbraw/zinc/57/65/36/1139576536.db2.gz RSGAYGHEGXUSJG-WMLDXEAASA-N 0 3 334.416 3.711 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000192024842 1140497598 /nfs/dbraw/zinc/49/75/98/1140497598.db2.gz JPDQFSMCKZKDQM-WBVHZDCISA-N 0 3 332.787 3.868 20 5 EHBDHN COc1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000192592576 1140539452 /nfs/dbraw/zinc/53/94/52/1140539452.db2.gz KMJXAOROBILUAP-KRWDZBQOSA-N 0 3 342.395 3.779 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[C@H]2c2cccc(F)c2)c1 ZINC000269684241 1141135593 /nfs/dbraw/zinc/13/55/93/1141135593.db2.gz SHZCKIMIUIZJOO-ROUUACIJSA-N 0 3 330.359 3.604 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891852 1141280462 /nfs/dbraw/zinc/28/04/62/1141280462.db2.gz PGJQAJVQSXMVLO-JSGCOSHPSA-N 0 3 341.415 3.531 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891854 1141280828 /nfs/dbraw/zinc/28/08/28/1141280828.db2.gz PGJQAJVQSXMVLO-TZMCWYRMSA-N 0 3 341.415 3.531 20 5 EHBDHN COc1ccc([C@H](NCc2ccc([N+](=O)[O-])c(F)c2)C2CC2)cc1 ZINC000283074742 1141547767 /nfs/dbraw/zinc/54/77/67/1141547767.db2.gz KIDNLCPHMPFKIR-GOSISDBHSA-N 0 3 330.359 3.983 20 5 EHBDHN Cc1cccc(-c2nc(-c3ccc(CN(C)C)cc3)no2)c1[N+](=O)[O-] ZINC000904627843 1032166778 /nfs/dbraw/zinc/16/67/78/1032166778.db2.gz WFNDWXKCXVFUEP-UHFFFAOYSA-N 0 3 338.367 3.682 20 5 EHBDHN O=[N+]([O-])c1ccccc1CCN[C@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449167725 1032260355 /nfs/dbraw/zinc/26/03/55/1032260355.db2.gz KRMHVVMNSBNSJY-ZDUSSCGKSA-N 0 3 336.313 3.832 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CC4(C3)CCOCC4)s2)cc1 ZINC000459623276 1032336086 /nfs/dbraw/zinc/33/60/86/1032336086.db2.gz RHCUYBOTTKDHFH-UHFFFAOYSA-N 0 3 344.436 3.936 20 5 EHBDHN Cc1ccc2c(c1)nc(CN[C@@H](C)Cc1ccccc1[N+](=O)[O-])n2C ZINC000449247100 1032385502 /nfs/dbraw/zinc/38/55/02/1032385502.db2.gz FDNJBGYMOUDFOY-AWEZNQCLSA-N 0 3 338.411 3.511 20 5 EHBDHN C[C@@H](CC(=O)Nc1cccc(F)c1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449349567 1032464656 /nfs/dbraw/zinc/46/46/56/1032464656.db2.gz QXXPEUZVUWCBGW-STQMWFEESA-N 0 3 345.374 3.802 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@H]2CCCC2(F)F)c1 ZINC000449497342 1032667911 /nfs/dbraw/zinc/66/79/11/1032667911.db2.gz QXQJSYBXQLRCKF-SNVBAGLBSA-N 0 3 336.285 3.721 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@]1(CO)C[C@H]1c1ccccc1 ZINC000289927277 1032676857 /nfs/dbraw/zinc/67/68/57/1032676857.db2.gz SRCUMVJZGINAQJ-WMZOPIPTSA-N 0 3 346.814 3.504 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@@]1(CO)C[C@@H]1c1ccccc1 ZINC000289927275 1032716792 /nfs/dbraw/zinc/71/67/92/1032716792.db2.gz SRCUMVJZGINAQJ-SJLPKXTDSA-N 0 3 346.814 3.504 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCO[C@@H](c3ccncc3)C2)c(Cl)c1 ZINC000449544021 1032735669 /nfs/dbraw/zinc/73/56/69/1032735669.db2.gz VAWJUWVJTBOIIH-WMLDXEAASA-N 0 3 347.802 3.653 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC(c3ccc4cccnc4n3)CC2)cc1 ZINC000594019481 1032793409 /nfs/dbraw/zinc/79/34/09/1032793409.db2.gz MUDOKXUFAKJRHP-UHFFFAOYSA-N 0 3 348.406 3.918 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@@H](n2ncc3ccccc32)C1 ZINC000513412990 1019643620 /nfs/dbraw/zinc/64/36/20/1019643620.db2.gz FQJGSDCNOXFQJS-KRZKXXONSA-N 0 3 348.406 3.905 20 5 EHBDHN COc1c([O-])ccc(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c1[N+](=O)[O-] ZINC000894231464 1019828242 /nfs/dbraw/zinc/82/82/42/1019828242.db2.gz NQRFJEHJEWXOSN-SHTZXODSSA-N 0 3 342.395 3.653 20 5 EHBDHN CO[C@]1(C)CCCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000280651992 1020567362 /nfs/dbraw/zinc/56/73/62/1020567362.db2.gz ZGZXJYCHAWXCHH-GOSISDBHSA-N 0 3 345.399 3.641 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCO[C@@H](c3ccccn3)C2)c(Cl)c1 ZINC000449616880 1032936280 /nfs/dbraw/zinc/93/62/80/1032936280.db2.gz SCKMLIRJNLWANY-CXAGYDPISA-N 0 3 347.802 3.653 20 5 EHBDHN CCOC(CCNc1cc(C)nc2ccc([N+](=O)[O-])cc21)OCC ZINC000276206971 1020898788 /nfs/dbraw/zinc/89/87/88/1020898788.db2.gz KQCKUQVEBMTTEK-UHFFFAOYSA-N 0 3 333.388 3.653 20 5 EHBDHN Cc1csc(CCCCNCc2nc3cc([N+](=O)[O-])ccc3o2)n1 ZINC000602534349 1032967125 /nfs/dbraw/zinc/96/71/25/1032967125.db2.gz TXKBQENFBIWKJX-UHFFFAOYSA-N 0 3 346.412 3.613 20 5 EHBDHN O=[N+]([O-])c1cccc(Cl)c1CN1CCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000322943097 1021474778 /nfs/dbraw/zinc/47/47/78/1021474778.db2.gz MUOVGBZQCTTXOG-SRCQZFHVSA-N 0 3 338.835 3.764 20 5 EHBDHN C[C@@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000090920828 1021819434 /nfs/dbraw/zinc/81/94/34/1021819434.db2.gz BWEJWJDXYGWFEP-QLJPJBMISA-N 0 3 338.766 3.772 20 5 EHBDHN COc1cccc2c1CCN(C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000426579134 1021967985 /nfs/dbraw/zinc/96/79/85/1021967985.db2.gz KNLYAZUUHCZSHE-YVMONPNESA-N 0 3 338.407 3.717 20 5 EHBDHN COc1cccc2c1CCN(C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000426579133 1021968637 /nfs/dbraw/zinc/96/86/37/1021968637.db2.gz KNLYAZUUHCZSHE-VMPITWQZSA-N 0 3 338.407 3.717 20 5 EHBDHN Cc1cc(Cl)cc(C)c1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000425986513 1022580078 /nfs/dbraw/zinc/58/00/78/1022580078.db2.gz WHCBEBMHPUWRDF-UHFFFAOYSA-N 0 3 348.834 3.899 20 5 EHBDHN CO[C@@H](c1ccccc1F)[C@@H](C)NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000538488089 1024398322 /nfs/dbraw/zinc/39/83/22/1024398322.db2.gz OGJSXJXIYMCCTE-FZKQIMNGSA-N 0 3 332.375 3.908 20 5 EHBDHN Cn1cccc1[C@@H]1CCCCN1CCOc1cccc([N+](=O)[O-])c1 ZINC000472328656 1033208307 /nfs/dbraw/zinc/20/83/07/1033208307.db2.gz OJUDZPUOKTVGOI-SFHVURJKSA-N 0 3 329.400 3.539 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c(F)c1 ZINC000326792086 1024654239 /nfs/dbraw/zinc/65/42/39/1024654239.db2.gz XTQLEUGSPOEJPM-JQHSSLGASA-N 0 3 336.407 3.640 20 5 EHBDHN Cc1c([C@@H](C)NCc2ccccc2-n2cccn2)cccc1[N+](=O)[O-] ZINC000119648377 1025125368 /nfs/dbraw/zinc/12/53/68/1025125368.db2.gz LQTLSJLBKBSOCA-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN CC1(C)CCCC[C@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000119806612 1025246960 /nfs/dbraw/zinc/24/69/60/1025246960.db2.gz PSMXHSUJZIMJBU-CQSZACIVSA-N 0 3 330.388 3.703 20 5 EHBDHN COc1ccccc1[C@@H](CNCc1ccc([N+](=O)[O-])cc1)OC(C)C ZINC000185718431 1025689318 /nfs/dbraw/zinc/68/93/18/1025689318.db2.gz AMQASYDVRPXTNJ-LJQANCHMSA-N 0 3 344.411 3.859 20 5 EHBDHN CC(=O)c1ccc(N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c([N+](=O)[O-])c1 ZINC000439128817 1025786655 /nfs/dbraw/zinc/78/66/55/1025786655.db2.gz PKKNKPZHMUKKLE-DJJJIMSYSA-N 0 3 341.411 3.901 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451412186 1025946058 /nfs/dbraw/zinc/94/60/58/1025946058.db2.gz FWFSNZZCDLBFFL-KZNAEPCWSA-N 0 3 348.443 3.507 20 5 EHBDHN Cc1cnc(C2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000277595912 1026250536 /nfs/dbraw/zinc/25/05/36/1026250536.db2.gz XDTOHYFUDIVKBG-UHFFFAOYSA-N 0 3 331.441 3.782 20 5 EHBDHN COc1cc(C[NH2+]CC(C)(C)C2=CCCCC2)c([N+](=O)[O-])cc1[O-] ZINC000479387556 1026615988 /nfs/dbraw/zinc/61/59/88/1026615988.db2.gz HOZLUXKPYOBVRF-UHFFFAOYSA-N 0 3 334.416 3.925 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCCc2c[nH]c3ccccc23)c(F)c1 ZINC000479957156 1026910421 /nfs/dbraw/zinc/91/04/21/1026910421.db2.gz HNWPWIMTSUKBBJ-UHFFFAOYSA-N 0 3 327.359 3.938 20 5 EHBDHN CC(C)(C)[C@@H]1CCCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000475630564 1028925135 /nfs/dbraw/zinc/92/51/35/1028925135.db2.gz GVUDRGNISXPOED-OAHLLOKOSA-N 0 3 334.416 3.719 20 5 EHBDHN COc1ccc(-c2ccc(CNCC3(OC)CCC3)o2)c([N+](=O)[O-])c1 ZINC000355763939 1029116709 /nfs/dbraw/zinc/11/67/09/1029116709.db2.gz HAVGPVQCMMPKKC-UHFFFAOYSA-N 0 3 346.383 3.522 20 5 EHBDHN CC[C@@H](C)[C@H](C)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285231 1029574026 /nfs/dbraw/zinc/57/40/26/1029574026.db2.gz XUAKTXAIKNBLPT-OCCSQVGLSA-N 0 3 333.432 3.741 20 5 EHBDHN CCOC(=O)[C@]1(C(C)C)CCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000446890943 1029842938 /nfs/dbraw/zinc/84/29/38/1029842938.db2.gz RKEAYSJBNSWOIL-QRBZPYHOSA-N 0 3 346.427 3.519 20 5 EHBDHN Cc1c(-c2noc([C@H](C)N3[C@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000453246159 1029973691 /nfs/dbraw/zinc/97/36/91/1029973691.db2.gz CRVLYZWHKXJQBY-LOWVWBTDSA-N 0 3 330.388 3.887 20 5 EHBDHN COc1cc2c(cc1OC)[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000453249883 1029979054 /nfs/dbraw/zinc/97/90/54/1029979054.db2.gz VZNKNBVYUKNORW-YVEFUNNKSA-N 0 3 342.395 3.950 20 5 EHBDHN COc1cc(CNCCC=C(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000483661701 1031267752 /nfs/dbraw/zinc/26/77/52/1031267752.db2.gz OBKMUDXQVFUOQC-UHFFFAOYSA-N 0 3 344.358 3.693 20 5 EHBDHN CCC1(CO)CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000129820853 1031369373 /nfs/dbraw/zinc/36/93/73/1031369373.db2.gz MTHUZMSFBWLEGY-UHFFFAOYSA-N 0 3 344.411 3.839 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H](CCO)c1ccccc1)CCC2 ZINC000278662891 1031890991 /nfs/dbraw/zinc/89/09/91/1031890991.db2.gz ITSSXHAUFQRXJQ-RTBURBONSA-N 0 3 326.396 3.686 20 5 EHBDHN C[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000594489942 1033393354 /nfs/dbraw/zinc/39/33/54/1033393354.db2.gz IDRAROJLZIBBQO-MLGOLLRUSA-N 0 3 340.379 3.704 20 5 EHBDHN Cc1ccc(C)c(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000061019952 1033438760 /nfs/dbraw/zinc/43/87/60/1033438760.db2.gz XAHGYLNAMDBFRO-UHFFFAOYSA-N 0 3 325.412 3.534 20 5 EHBDHN COC[C@@H](Cc1ccccc1)N[C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595011458 1033606172 /nfs/dbraw/zinc/60/61/72/1033606172.db2.gz HOQPSTJSHXREKQ-GDBMZVCRSA-N 0 3 344.411 3.512 20 5 EHBDHN COc1cccc([C@@H](CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)OC)c1 ZINC000599061969 1033701520 /nfs/dbraw/zinc/70/15/20/1033701520.db2.gz MXIKLEZSXSQVJS-IFXJQAMLSA-N 0 3 344.411 3.950 20 5 EHBDHN C[C@H](COCC1CC1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000593682190 1033751424 /nfs/dbraw/zinc/75/14/24/1033751424.db2.gz QIMTUDDPJBBAHV-CYBMUJFWSA-N 0 3 330.384 3.760 20 5 EHBDHN Cc1noc(CN2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)c1[N+](=O)[O-] ZINC000595489383 1033811123 /nfs/dbraw/zinc/81/11/23/1033811123.db2.gz ABBHJUKMPPXTFV-OAGGEKHMSA-N 0 3 327.384 3.659 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000603867929 1033994729 /nfs/dbraw/zinc/99/47/29/1033994729.db2.gz DGLVQZGLSXWRLT-GOSISDBHSA-N 0 3 330.359 3.950 20 5 EHBDHN Cn1ncc(C2CC2)c1CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597137897 1034559936 /nfs/dbraw/zinc/55/99/36/1034559936.db2.gz HOZDSUXCOVVDTL-INIZCTEOSA-N 0 3 340.427 3.585 20 5 EHBDHN CC[C@H](NCCn1ccc(C(F)(F)F)n1)c1cccc([N+](=O)[O-])c1 ZINC000601964777 1034851185 /nfs/dbraw/zinc/85/11/85/1034851185.db2.gz UJELKCDOCCFBFG-ZDUSSCGKSA-N 0 3 342.321 3.551 20 5 EHBDHN Cc1ccc([C@@H](C)NCCC(=O)Nc2ccccc2F)cc1[N+](=O)[O-] ZINC000411477298 1034891557 /nfs/dbraw/zinc/89/15/57/1034891557.db2.gz RULJTKIWUUNNTE-CYBMUJFWSA-N 0 3 345.374 3.722 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000179950820 1035076548 /nfs/dbraw/zinc/07/65/48/1035076548.db2.gz FNKYSVFIBUGZAY-CQSZACIVSA-N 0 3 348.786 3.607 20 5 EHBDHN CCN(CCc1cccs1)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589495764 1036438374 /nfs/dbraw/zinc/43/83/74/1036438374.db2.gz KMSYKCPXGZKFER-UHFFFAOYSA-N 0 3 348.424 3.508 20 5 EHBDHN CCC(CC)N(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000165372980 1036440402 /nfs/dbraw/zinc/44/04/02/1036440402.db2.gz JYDZIMZKNFIHDN-UHFFFAOYSA-N 0 3 330.388 3.798 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN[C@H](C)[C@H]1Oc2ccccc2[C@@H]1C ZINC000541691063 1036563078 /nfs/dbraw/zinc/56/30/78/1036563078.db2.gz URABNAIBUJMKBI-QUJCMNEKSA-N 0 3 342.395 3.646 20 5 EHBDHN CC(C)[C@@H](O)C1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000539588697 1036957520 /nfs/dbraw/zinc/95/75/20/1036957520.db2.gz GAGHUUSWPJGEMJ-GOSISDBHSA-N 0 3 344.411 3.742 20 5 EHBDHN CC[C@H](NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000341207215 1037763241 /nfs/dbraw/zinc/76/32/41/1037763241.db2.gz JRHQUQCAQMYVRD-HNNXBMFYSA-N 0 3 327.384 3.583 20 5 EHBDHN Cc1cccc([C@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC000540386802 1037878831 /nfs/dbraw/zinc/87/88/31/1037878831.db2.gz ZWRYDRZNOZLUHN-LSDHHAIUSA-N 0 3 341.411 3.889 20 5 EHBDHN CC(C)(C)OC(=O)C1(C)CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000592157418 1037899008 /nfs/dbraw/zinc/89/90/08/1037899008.db2.gz XJGLJGBIAPATNI-UHFFFAOYSA-N 0 3 348.443 3.581 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC2(C[C@H]1C)CCOCC2 ZINC000592181458 1037910819 /nfs/dbraw/zinc/91/08/19/1037910819.db2.gz DLFZCJVOKWRBFE-OAHLLOKOSA-N 0 3 348.443 3.773 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ccc(CO)cc1)CCCC2 ZINC000592392973 1037934442 /nfs/dbraw/zinc/93/44/42/1037934442.db2.gz NTLZHNCQAYUZTB-IBGZPJMESA-N 0 3 326.396 3.644 20 5 EHBDHN CN(CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccccc2)[nH]1 ZINC000549407518 1038321946 /nfs/dbraw/zinc/32/19/46/1038321946.db2.gz GCEBEYCQPLPVAL-UHFFFAOYSA-N 0 3 336.395 3.659 20 5 EHBDHN Cc1cccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000539290610 1038762925 /nfs/dbraw/zinc/76/29/25/1038762925.db2.gz ARCFYBURAKYVCX-CABCVRRESA-N 0 3 341.411 3.889 20 5 EHBDHN CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])[n-]1 ZINC000488465422 1039207296 /nfs/dbraw/zinc/20/72/96/1039207296.db2.gz OHIZDSVDFHALTP-IHRRRGAJSA-N 0 3 345.447 3.898 20 5 EHBDHN CCC[C@@H](C)[C@H]1CCCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804447 1040471905 /nfs/dbraw/zinc/47/19/05/1040471905.db2.gz YQTBZWDQIKKDOP-CXAGYDPISA-N 0 3 333.432 3.742 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCCC[C@H](CCOC)C1 ZINC000467269247 1040514564 /nfs/dbraw/zinc/51/45/64/1040514564.db2.gz RHINOVZMEKOZAZ-OAHLLOKOSA-N 0 3 336.432 3.632 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000151282659 1040736489 /nfs/dbraw/zinc/73/64/89/1040736489.db2.gz OTTIGFZZMVMZDI-UHFFFAOYSA-N 0 3 345.374 3.665 20 5 EHBDHN CC[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CC1(C)C ZINC000419313682 1041249850 /nfs/dbraw/zinc/24/98/50/1041249850.db2.gz GNHFZXJFHWBANZ-KGLIPLIRSA-N 0 3 330.388 3.559 20 5 EHBDHN CC(=O)c1ccc(N[C@H](C)CN2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000511710997 1041474169 /nfs/dbraw/zinc/47/41/69/1041474169.db2.gz CHYNDCFCJONRGN-HZSPNIEDSA-N 0 3 333.432 3.576 20 5 EHBDHN Cc1csc([C@@H](C)CNCc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000893563028 1042662713 /nfs/dbraw/zinc/66/27/13/1042662713.db2.gz HNNRSGPMAUBIJS-VIFPVBQESA-N 0 3 325.821 3.906 20 5 EHBDHN C[C@@H]1CN(CCCCNc2c(Cl)cccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000432325861 1042906750 /nfs/dbraw/zinc/90/67/50/1042906750.db2.gz NCEADUSMRASLKE-CHWSQXEVSA-N 0 3 341.839 3.550 20 5 EHBDHN Cc1nn(CCN(C)Cc2ccc(F)cc2)c2ccc([N+](=O)[O-])cc12 ZINC000344594690 1044166814 /nfs/dbraw/zinc/16/68/14/1044166814.db2.gz BFVNNBXGEDASOL-UHFFFAOYSA-N 0 3 342.374 3.524 20 5 EHBDHN Cc1cc(C)cc([C@H](C)NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000182906804 1127353643 /nfs/dbraw/zinc/35/36/43/1127353643.db2.gz OFUNVUWRAFHINQ-HNNXBMFYSA-N 0 3 341.411 3.809 20 5 EHBDHN C[C@@H]1CC2(CCC2)CN1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000762138264 1121126206 /nfs/dbraw/zinc/12/62/06/1121126206.db2.gz LECXIYFIUCFQEN-CQSZACIVSA-N 0 3 326.400 3.680 20 5 EHBDHN O=C(CN(C1CC1)C1CCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000064808050 1128965068 /nfs/dbraw/zinc/96/50/68/1128965068.db2.gz GBDLCHOQEOUVOI-UHFFFAOYSA-N 0 3 337.807 3.594 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c(Cl)c1 ZINC000322895817 1121681583 /nfs/dbraw/zinc/68/15/83/1121681583.db2.gz BSPBGKWGCYTILD-DJIMGWMZSA-N 0 3 338.835 3.764 20 5 EHBDHN O=[N+]([O-])c1cc(CNCCCOc2cccc3cccnc32)cs1 ZINC000113343053 1129002987 /nfs/dbraw/zinc/00/29/87/1129002987.db2.gz LGZBOIFLDIIYPO-UHFFFAOYSA-N 0 3 343.408 3.763 20 5 EHBDHN C[C@@H]1CCC[C@@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180146 1121798028 /nfs/dbraw/zinc/79/80/28/1121798028.db2.gz GNNJYBDKEINUEP-IUODEOHRSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@@H]1CN(CCCCNc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000301737023 1129011726 /nfs/dbraw/zinc/01/17/26/1129011726.db2.gz VOPYQHSCVAQMPJ-CHWSQXEVSA-N 0 3 341.839 3.550 20 5 EHBDHN COc1cc(CN(C(C)C)C2CCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000077357496 1129017014 /nfs/dbraw/zinc/01/70/14/1129017014.db2.gz UMJLQWFPIZZDIS-UHFFFAOYSA-N 0 3 344.358 3.968 20 5 EHBDHN CN(CCCCc1ccccc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917476581 1122612796 /nfs/dbraw/zinc/61/27/96/1122612796.db2.gz OVZHHHSSSLEYLD-UHFFFAOYSA-N 0 3 338.411 3.857 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC(c3ccccc3F)CC2)c1 ZINC000609895503 1123689025 /nfs/dbraw/zinc/68/90/25/1123689025.db2.gz ZRHBCIVABYQQAY-UHFFFAOYSA-N 0 3 344.386 3.992 20 5 EHBDHN CC1(C)CN(Cc2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1 ZINC000078516539 1129155856 /nfs/dbraw/zinc/15/58/56/1129155856.db2.gz YVJNKSBNILBYFN-UHFFFAOYSA-N 0 3 339.439 3.691 20 5 EHBDHN C[C@@H](N[C@H](C)c1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000078989297 1129220558 /nfs/dbraw/zinc/22/05/58/1129220558.db2.gz CNCWZPNQNDTMET-CHWSQXEVSA-N 0 3 328.368 3.778 20 5 EHBDHN Cc1c(NC(=O)[C@@H](C)N(C)C[C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181739 1129315918 /nfs/dbraw/zinc/31/59/18/1129315918.db2.gz IYXZSELUSQFTLB-HUUCEWRRSA-N 0 3 331.416 3.518 20 5 EHBDHN C[C@@H](NCc1ccc(O[C@H]2CCOC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000922540145 1129568090 /nfs/dbraw/zinc/56/80/90/1129568090.db2.gz GTRFHDNWSGEFDH-KUHUBIRLSA-N 0 3 342.395 3.613 20 5 EHBDHN CC(C)(C)CN(CCCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555350636 1129632726 /nfs/dbraw/zinc/63/27/26/1129632726.db2.gz RVEALRJOBRKPCZ-UHFFFAOYSA-N 0 3 348.365 3.844 20 5 EHBDHN C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2F)CCN1Cc1ccccc1 ZINC000742431373 1131730185 /nfs/dbraw/zinc/73/01/85/1131730185.db2.gz XXSLUIYRFCBGOJ-HNNXBMFYSA-N 0 3 343.402 3.835 20 5 EHBDHN O=[N+]([O-])c1ccc(N2CCN(CC3CCC3)CC2)c(C(F)(F)F)c1 ZINC000743845469 1131989896 /nfs/dbraw/zinc/98/98/96/1131989896.db2.gz CTFQMKSSSVIIGI-UHFFFAOYSA-N 0 3 343.349 3.536 20 5 EHBDHN Cc1ccn2cc(CN(C)[C@H](C)Cc3ccc([N+](=O)[O-])cc3)nc2c1 ZINC001173237751 1132026531 /nfs/dbraw/zinc/02/65/31/1132026531.db2.gz LYSXLJIXSRAALN-OAHLLOKOSA-N 0 3 338.411 3.614 20 5 EHBDHN CC(C)C[C@@H]1CCN(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000744437181 1132093846 /nfs/dbraw/zinc/09/38/46/1132093846.db2.gz JNGPPJGCDCFSEH-HNNXBMFYSA-N 0 3 328.416 3.784 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC(CC2CCOCC2)C1 ZINC001183560897 1133824226 /nfs/dbraw/zinc/82/42/26/1133824226.db2.gz JJDWPKSTJUUGRR-OQLLNIDSSA-N 0 3 330.428 3.747 20 5 EHBDHN C[C@@H]1C[C@H](Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])CN1C1CC1 ZINC001185775486 1134131771 /nfs/dbraw/zinc/13/17/71/1134131771.db2.gz QERDDIRMVBMERO-KOLCDFICSA-N 0 3 329.322 3.651 20 5 EHBDHN C[C@H]1C[C@H](Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])CN1C1CC1 ZINC001185775488 1134131867 /nfs/dbraw/zinc/13/18/67/1134131867.db2.gz QERDDIRMVBMERO-ONGXEEELSA-N 0 3 329.322 3.651 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCC[C@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC001170329061 1134749305 /nfs/dbraw/zinc/74/93/05/1134749305.db2.gz NVNNDWBXFAZDSU-KDOFPFPSSA-N 0 3 341.411 3.767 20 5 EHBDHN CN(CCN(Cc1cccc([N+](=O)[O-])c1)C1CC1)Cc1ccccc1 ZINC001191681524 1134898382 /nfs/dbraw/zinc/89/83/82/1134898382.db2.gz BWKBYVNCSVWRQN-UHFFFAOYSA-N 0 3 339.439 3.691 20 5 EHBDHN CCCN(Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])C(C)C ZINC001195595313 1135439875 /nfs/dbraw/zinc/43/98/75/1135439875.db2.gz AUABJLIQJOEYIU-UHFFFAOYSA-N 0 3 346.374 3.868 20 5 EHBDHN CC1(C)CCC[C@](CO)(NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001196219483 1135534057 /nfs/dbraw/zinc/53/40/57/1135534057.db2.gz YQBZILIHYXLWTF-INIZCTEOSA-N 0 3 326.824 3.669 20 5 EHBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])CCc1ccccc1[N+](=O)[O-] ZINC000809689321 1135872031 /nfs/dbraw/zinc/87/20/31/1135872031.db2.gz XPMSDRWAVJGPJO-TWGQIWQCSA-N 0 3 341.367 3.691 20 5 EHBDHN CN1CC[C@H](NCc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000810006293 1135913040 /nfs/dbraw/zinc/91/30/40/1135913040.db2.gz IONOOZLGSUXEGB-FUHWJXTLSA-N 0 3 345.830 3.783 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H]1CCCC[C@@H]1O ZINC000811480847 1136097502 /nfs/dbraw/zinc/09/75/02/1136097502.db2.gz IBKAHRZSDRZNSD-RNCFNFMXSA-N 0 3 333.215 3.542 20 5 EHBDHN Cc1cc([N+](=O)[O-])cc(-n2c(-c3ccccc3)cnc2[C@H](C)N)c1F ZINC001170686320 1136247441 /nfs/dbraw/zinc/24/74/41/1136247441.db2.gz OQKQVUZLOKPUFY-LBPRGKRZSA-N 0 3 340.358 3.915 20 5 EHBDHN CC(COC(=O)C1(Cc2cccc(Cl)c2)CCCC1)[N+](=O)[O-] ZINC000813107794 1136293952 /nfs/dbraw/zinc/29/39/52/1136293952.db2.gz WNYXNZLZCVABQT-LBPRGKRZSA-N 0 3 325.792 3.651 20 5 EHBDHN Cc1nc(-c2ccc(C)cc2C)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813106898 1136294307 /nfs/dbraw/zinc/29/43/07/1136294307.db2.gz HMFJKJBAZUHBRY-LLVKDONJSA-N 0 3 334.397 3.557 20 5 EHBDHN O=[N+]([O-])c1cc2c(cc1N[C@@H](c1ccccc1)C(F)(F)F)CNC2 ZINC001170883807 1136849132 /nfs/dbraw/zinc/84/91/32/1136849132.db2.gz QLKNLODBJPBTAC-HNNXBMFYSA-N 0 3 337.301 3.914 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCCc3c(F)cc(F)cc32)c1 ZINC000819333738 1136932199 /nfs/dbraw/zinc/93/21/99/1136932199.db2.gz REAOCOISQOVEML-ROUUACIJSA-N 0 3 348.349 3.574 20 5 EHBDHN Cc1ccc(O[C@H]2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858040798 1136934501 /nfs/dbraw/zinc/93/45/01/1136934501.db2.gz QGEJQCXSUFLQPN-RDJZCZTQSA-N 0 3 341.411 3.821 20 5 EHBDHN O=[N+]([O-])c1ccc(CCCCNCc2ccnc(Cl)c2F)cc1 ZINC000823955428 1137119206 /nfs/dbraw/zinc/11/92/06/1137119206.db2.gz LCWCRHLLTIODNH-UHFFFAOYSA-N 0 3 337.782 3.895 20 5 EHBDHN CC([C@H](OC(=O)C[C@@H](C)n1cccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845877410 1137316502 /nfs/dbraw/zinc/31/65/02/1137316502.db2.gz PPOQHDBYIGLQMX-IGCXYCKISA-N 0 3 334.347 3.528 20 5 EHBDHN CC([C@@H](OC(=O)c1coc(C2CCC2)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845879981 1137316655 /nfs/dbraw/zinc/31/66/55/1137316655.db2.gz JJUDXWKXMIJTRG-MEBBXXQBSA-N 0 3 348.330 3.645 20 5 EHBDHN CC(C)c1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])nc1 ZINC000845882682 1137317022 /nfs/dbraw/zinc/31/70/22/1137317022.db2.gz PQUUESMGLVHRMR-SJKOYZFVSA-N 0 3 346.358 3.907 20 5 EHBDHN C[C@H](N[C@@H]1CCO[C@H](c2ccncc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872075571 1137569974 /nfs/dbraw/zinc/56/99/74/1137569974.db2.gz DUPCUFBTPUFACD-QEORTHHSSA-N 0 3 345.374 3.700 20 5 EHBDHN Cc1ccccc1NC(=O)C[C@H](C)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129775 1137573178 /nfs/dbraw/zinc/57/31/78/1137573178.db2.gz RXBVVVFJLLTSGN-GJZGRUSLSA-N 0 3 341.411 3.971 20 5 EHBDHN CC1(C)C[C@H](NCc2cc(N)cc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000873288602 1137596460 /nfs/dbraw/zinc/59/64/60/1137596460.db2.gz JHBSDZJMMHPILD-KRWDZBQOSA-N 0 3 329.375 3.828 20 5 EHBDHN C[C@@H]1CC[C@@H](NCc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000878447312 1137716413 /nfs/dbraw/zinc/71/64/13/1137716413.db2.gz LKKDUMIJSFZSMP-YRGRVCCFSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@@H]1CCCC[C@@]1(C)NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878699153 1137725565 /nfs/dbraw/zinc/72/55/65/1137725565.db2.gz NYOQHZFUAZQRBJ-SJKOYZFVSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1nc(C2CCN([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)[nH]c1C ZINC000886665541 1138111379 /nfs/dbraw/zinc/11/13/79/1138111379.db2.gz AOTVICFYYZIKLV-AWEZNQCLSA-N 0 3 328.416 3.875 20 5 EHBDHN CCC[C@H](NCC[S@](=O)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000127424385 1138357230 /nfs/dbraw/zinc/35/72/30/1138357230.db2.gz TZWCMGNELWAFEP-OYHNWAKOSA-N 0 3 326.462 3.573 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000152743888 1139106806 /nfs/dbraw/zinc/10/68/06/1139106806.db2.gz NXZPLSONPVDFBG-YVEFUNNKSA-N 0 3 348.374 3.517 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000177361652 1139615616 /nfs/dbraw/zinc/61/56/16/1139615616.db2.gz VJYCIHDOBBCUKV-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN CCC[C@@H](NCc1ccc(CO)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000178564093 1139704876 /nfs/dbraw/zinc/70/48/76/1139704876.db2.gz RKPLBUGCWWTDTD-GOSISDBHSA-N 0 3 332.375 3.857 20 5 EHBDHN Cc1sc(C(=O)Nc2cc(C)cc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000270405884 1141218251 /nfs/dbraw/zinc/21/82/51/1141218251.db2.gz XTSRZTIXHYKZMU-UHFFFAOYSA-N 0 3 333.413 3.587 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CNCc1cccc(-c2nccn2C)c1 ZINC000359866639 201114929 /nfs/dbraw/zinc/11/49/29/201114929.db2.gz JDIFSMOLWBZSLO-UHFFFAOYSA-N 0 3 336.395 3.594 20 5 EHBDHN C[C@H](c1ccc([S@](C)=O)cc1)N(C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384708 1016122055 /nfs/dbraw/zinc/12/20/55/1016122055.db2.gz KDLXXJFYCIOTSV-SHACYNPGSA-N 0 3 346.452 3.568 20 5 EHBDHN COC[C@@H](C)NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000120400421 1016803578 /nfs/dbraw/zinc/80/35/78/1016803578.db2.gz GQFQIZBIILDIHU-GFCCVEGCSA-N 0 3 334.347 3.651 20 5 EHBDHN C[C@H]1CCCC[C@]1(C)NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000459615513 1032352658 /nfs/dbraw/zinc/35/26/58/1032352658.db2.gz PEABAZIOVPVEOP-SJCJKPOMSA-N 0 3 330.388 3.703 20 5 EHBDHN CCC[C@@H](NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000485201335 1032376974 /nfs/dbraw/zinc/37/69/74/1032376974.db2.gz GVLLDSHRXYYJKJ-MRXNPFEDSA-N 0 3 341.411 3.973 20 5 EHBDHN CCCCn1cc(CNC/C=C\c2ccccc2[N+](=O)[O-])c(C)n1 ZINC000538455942 1032383154 /nfs/dbraw/zinc/38/31/54/1032383154.db2.gz ZNTBQHUAVNJPED-CLFYSBASSA-N 0 3 328.416 3.703 20 5 EHBDHN CC(C)n1cc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449494380 1032659635 /nfs/dbraw/zinc/65/96/35/1032659635.db2.gz AOHBXNHZMDTMPE-KRWDZBQOSA-N 0 3 328.416 3.752 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@@H]3CCC[C@H]3OC)o2)c([N+](=O)[O-])c1 ZINC000449523430 1032719697 /nfs/dbraw/zinc/71/96/97/1032719697.db2.gz MYNHTUWJBJYMLT-CRAIPNDOSA-N 0 3 346.383 3.521 20 5 EHBDHN CC[C@@H](C[C@@H](C)CO)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610345671 1018360547 /nfs/dbraw/zinc/36/05/47/1018360547.db2.gz YGLVEXOWMUJLCN-OCCSQVGLSA-N 0 3 349.456 3.605 20 5 EHBDHN Cc1nccc([C@@H]2CCCN([C@@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368001 1018535233 /nfs/dbraw/zinc/53/52/33/1018535233.db2.gz AQKGNPWQJAHLQC-DZGCQCFKSA-N 0 3 326.400 3.634 20 5 EHBDHN CC(C)[C@@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000015549967 1018757968 /nfs/dbraw/zinc/75/79/68/1018757968.db2.gz HPUBOAXCUVUVJJ-RDTXWAMCSA-N 0 3 341.411 3.909 20 5 EHBDHN CN(c1ccsc1[N+](=O)[O-])[C@H]1CCCN(Cc2ccccc2)C1 ZINC000610431089 1019084157 /nfs/dbraw/zinc/08/41/57/1019084157.db2.gz QAYHKZROZCFXQP-HNNXBMFYSA-N 0 3 331.441 3.757 20 5 EHBDHN O=[N+]([O-])c1ccc(NCC2(N3CCSCC3)CCCC2)c(F)c1 ZINC000513168376 1019361812 /nfs/dbraw/zinc/36/18/12/1019361812.db2.gz ZASWXXQGEDTWBU-UHFFFAOYSA-N 0 3 339.436 3.507 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@H]2CCSc3ccc(F)cc32)cc1 ZINC000536860729 1019374494 /nfs/dbraw/zinc/37/44/94/1019374494.db2.gz AKUCOFQGPJSOKN-INIZCTEOSA-N 0 3 348.399 3.939 20 5 EHBDHN COc1cccc(NC[C@@H](c2cccs2)N2CCCC2)c1[N+](=O)[O-] ZINC000548117150 1019724103 /nfs/dbraw/zinc/72/41/03/1019724103.db2.gz MJBSJNHHGBENLR-AWEZNQCLSA-N 0 3 347.440 3.914 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000182830018 1019758009 /nfs/dbraw/zinc/75/80/09/1019758009.db2.gz HJXJVCGQFUZNQS-KBPBESRZSA-N 0 3 334.416 3.628 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN(C[C@@H]1CCOC1)C1CC1 ZINC000602439516 1032887908 /nfs/dbraw/zinc/88/79/08/1032887908.db2.gz HJAZHRCYOYJJIN-NSHDSACASA-N 0 3 344.333 3.615 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CCC[C@H]2COCC[C@@H]21 ZINC000602485462 1032912966 /nfs/dbraw/zinc/91/29/66/1032912966.db2.gz QRDDEVWPNMBQBA-JSGCOSHPSA-N 0 3 344.333 3.615 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(CCO)Cc1cccc(F)c1 ZINC000426368918 1021395179 /nfs/dbraw/zinc/39/51/79/1021395179.db2.gz CHRNBRSMMGTUMP-GDNBJRDFSA-N 0 3 344.386 3.632 20 5 EHBDHN CCNC(=O)c1ccc(CN[C@H](CC)c2cccc([N+](=O)[O-])c2)cc1 ZINC000156528505 1022511585 /nfs/dbraw/zinc/51/15/85/1022511585.db2.gz PRLKUVBDLRZHRA-GOSISDBHSA-N 0 3 341.411 3.585 20 5 EHBDHN COc1c([O-])ccc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)c1[N+](=O)[O-] ZINC000894579725 1022582904 /nfs/dbraw/zinc/58/29/04/1022582904.db2.gz AGUQYGUFNBXVDA-NSHDSACASA-N 0 3 344.358 3.614 20 5 EHBDHN Cc1c(CN2CCC[C@@H](Nc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000490071074 1023261066 /nfs/dbraw/zinc/26/10/66/1023261066.db2.gz YLNFBJVZKJEEGW-GOSISDBHSA-N 0 3 325.412 3.980 20 5 EHBDHN Cc1ccc([C@H](C)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000164526232 1023266266 /nfs/dbraw/zinc/26/62/66/1023266266.db2.gz KHVVKDNCTPWAQD-ZFWWWQNUSA-N 0 3 349.431 3.563 20 5 EHBDHN C[C@@H]1CC2(CC(NCc3cc(Cl)cc(Cl)c3[N+](=O)[O-])C2)CO1 ZINC000897775359 1033162687 /nfs/dbraw/zinc/16/26/87/1033162687.db2.gz CFUPZDAHHRCIFZ-DQSQBROSSA-N 0 3 345.226 3.949 20 5 EHBDHN Cc1nn(C(C)(C)C)cc1[C@H](C)NCCOc1ccccc1[N+](=O)[O-] ZINC000157562512 1024953235 /nfs/dbraw/zinc/95/32/35/1024953235.db2.gz WZZGTGQNVNLTIW-ZDUSSCGKSA-N 0 3 346.431 3.584 20 5 EHBDHN CO[C@H](CNC(C)(C)c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000451057493 1025339859 /nfs/dbraw/zinc/33/98/59/1025339859.db2.gz SWSAVXVBRLMFIU-INIZCTEOSA-N 0 3 328.412 3.677 20 5 EHBDHN Cc1c(CN2CCC([C@@H](O)c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000051531707 1025637763 /nfs/dbraw/zinc/63/77/63/1025637763.db2.gz AOMNSCQMHYUTJZ-FQEVSTJZSA-N 0 3 340.423 3.849 20 5 EHBDHN COCCNc1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000127106547 1026256362 /nfs/dbraw/zinc/25/63/62/1026256362.db2.gz RPUUPARSWPUYLX-HNNXBMFYSA-N 0 3 343.427 3.812 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[C@@H](C)C1 ZINC000452066902 1026461449 /nfs/dbraw/zinc/46/14/49/1026461449.db2.gz LTMLYUNZGAWWTE-VNHYZAJKSA-N 0 3 344.415 3.949 20 5 EHBDHN C[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000563418285 1026790444 /nfs/dbraw/zinc/79/04/44/1026790444.db2.gz NVLNIOWGVDTDBA-FZKQIMNGSA-N 0 3 349.394 3.514 20 5 EHBDHN CC(C)(C)OC1CC(N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000341633639 1026865709 /nfs/dbraw/zinc/86/57/09/1026865709.db2.gz ZDNIONSHOSVSFV-UHFFFAOYSA-N 0 3 348.443 3.784 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCC2(CO)CCCC2)c2ccccc2)c1 ZINC000186486033 1027377105 /nfs/dbraw/zinc/37/71/05/1027377105.db2.gz BFHLRWQJHVCDKS-IBGZPJMESA-N 0 3 340.423 3.827 20 5 EHBDHN CCC[C@@H](C)[C@@H]1CCCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804448 1028035651 /nfs/dbraw/zinc/03/56/51/1028035651.db2.gz YQTBZWDQIKKDOP-DYVFJYSZSA-N 0 3 333.432 3.742 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@@H]1CCCC[C@H]1OC(F)F ZINC000502590054 1028386557 /nfs/dbraw/zinc/38/65/57/1028386557.db2.gz BNXOFQYFBAWKNS-DGCLKSJQSA-N 0 3 334.750 3.888 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502601893 1028422196 /nfs/dbraw/zinc/42/21/96/1028422196.db2.gz RKMPLWBIGKFKMM-SFHVURJKSA-N 0 3 346.814 3.740 20 5 EHBDHN Cc1c(NC(=O)[C@@H](C)N(C)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000532755661 1028800109 /nfs/dbraw/zinc/80/01/09/1028800109.db2.gz IWKMMVPETHRMAP-CQSZACIVSA-N 0 3 333.432 3.742 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCCC2(O)CCC2)c2ccccc2)c1 ZINC000421851285 1028837019 /nfs/dbraw/zinc/83/70/19/1028837019.db2.gz FQDVQVOOQQXXEP-LJQANCHMSA-N 0 3 340.423 3.969 20 5 EHBDHN C[C@@H](c1ccccc1)N1CCC(Nc2ncc([N+](=O)[O-])s2)CC1 ZINC000192456943 1029671146 /nfs/dbraw/zinc/67/11/46/1029671146.db2.gz PSXNLGQYTDDVLX-LBPRGKRZSA-N 0 3 332.429 3.689 20 5 EHBDHN C[C@H](c1ccccc1)N1CCC(Nc2ncc([N+](=O)[O-])s2)CC1 ZINC000192456949 1029671216 /nfs/dbraw/zinc/67/12/16/1029671216.db2.gz PSXNLGQYTDDVLX-GFCCVEGCSA-N 0 3 332.429 3.689 20 5 EHBDHN C[C@@H]1CCC[C@H](C)[C@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000245892124 1030281649 /nfs/dbraw/zinc/28/16/49/1030281649.db2.gz QBFLQGLEWRYDBW-ATCWAGBWSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@H]1CCCC[C@@H]1N(C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607384 1030750402 /nfs/dbraw/zinc/75/04/02/1030750402.db2.gz OSCIMSKGPUCKGO-WFASDCNBSA-N 0 3 330.388 3.655 20 5 EHBDHN COc1cccc([C@H](CNc2ccc([N+](=O)[O-])cc2Cl)N(C)C)c1 ZINC000007979739 1031288052 /nfs/dbraw/zinc/28/80/52/1031288052.db2.gz WTNOZLCQAIKHAF-KRWDZBQOSA-N 0 3 349.818 3.972 20 5 EHBDHN CC(C)(C)O[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000594520097 1033427335 /nfs/dbraw/zinc/42/73/35/1033427335.db2.gz YTUZTSUNHZCVAT-AULYBMBSSA-N 0 3 344.358 3.632 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]12 ZINC000594996063 1033623289 /nfs/dbraw/zinc/62/32/89/1033623289.db2.gz RGCZCHDIBBGQQI-QXAKKESOSA-N 0 3 342.370 3.561 20 5 EHBDHN Cc1nccc([C@H]2CCCN([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834319 1033959743 /nfs/dbraw/zinc/95/97/43/1033959743.db2.gz QNUWPUOEJHIVET-BBRMVZONSA-N 0 3 326.400 3.634 20 5 EHBDHN CC[C@@H]1CC[C@@H](C)N(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000595785542 1034000435 /nfs/dbraw/zinc/00/04/35/1034000435.db2.gz XPULYPDFMMWVPD-CHWSQXEVSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@@H]1CC1(C)C ZINC000595909475 1034025919 /nfs/dbraw/zinc/02/59/19/1034025919.db2.gz OLRVGBRNXHMSRK-YPMHNXCESA-N 0 3 330.388 3.684 20 5 EHBDHN CN(C)[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1cccs1 ZINC000029871574 1035770690 /nfs/dbraw/zinc/77/06/90/1035770690.db2.gz UYJXSLKGWUVHFW-HNNXBMFYSA-N 0 3 342.424 3.919 20 5 EHBDHN Cc1ccc([C@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000056201447 1036139558 /nfs/dbraw/zinc/13/95/58/1036139558.db2.gz YIDIYSPAUDJCND-LSDHHAIUSA-N 0 3 341.411 3.889 20 5 EHBDHN COc1cc(CN(C)[C@@H]2CCc3ccccc3C2)c([N+](=O)[O-])cc1F ZINC000464677557 1036652265 /nfs/dbraw/zinc/65/22/65/1036652265.db2.gz LXLOIXRXELUVMC-MRXNPFEDSA-N 0 3 344.386 3.732 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@@H](CO)C2CCCCC2)c(Cl)c1 ZINC000590194596 1036793869 /nfs/dbraw/zinc/79/38/69/1036793869.db2.gz SABJPQDGTNTUGW-AWEZNQCLSA-N 0 3 326.824 3.527 20 5 EHBDHN O=[N+]([O-])c1ccc2cnn(CN3CCC[C@@H]3Cc3ccccc3)c2c1 ZINC000026235873 1036842127 /nfs/dbraw/zinc/84/21/27/1036842127.db2.gz OBRXLFOKULTMLD-QGZVFWFLSA-N 0 3 336.395 3.609 20 5 EHBDHN CC(C)[C@@](C)(O)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180528249 1036919454 /nfs/dbraw/zinc/91/94/54/1036919454.db2.gz KDLNFJOAUYJPJO-MOPGFXCFSA-N 0 3 328.412 3.681 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1C[C@H]1Cc1ccccc1 ZINC000462751801 1037364389 /nfs/dbraw/zinc/36/43/89/1037364389.db2.gz CFKAMZYKGYEIPL-CRAIPNDOSA-N 0 3 326.396 3.714 20 5 EHBDHN CO[C@H](CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000549390318 1037620526 /nfs/dbraw/zinc/62/05/26/1037620526.db2.gz ZNXWRVLFIYPQAX-LJQANCHMSA-N 0 3 326.396 3.947 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@@H]4CCCC[C@@H]43)n2)cc1 ZINC000103266260 1037813975 /nfs/dbraw/zinc/81/39/75/1037813975.db2.gz MMCVKFGFNRHEQZ-BBRMVZONSA-N 0 3 342.399 3.799 20 5 EHBDHN CC1CCC(N(CC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000053170403 1037919447 /nfs/dbraw/zinc/91/94/47/1037919447.db2.gz QXIGNYNULKSMLT-UHFFFAOYSA-N 0 3 331.416 3.576 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](c1cccs1)C1CC1 ZINC000540463546 1037964221 /nfs/dbraw/zinc/96/42/21/1037964221.db2.gz CQBDKJJVPVFHFI-QGZVFWFLSA-N 0 3 345.424 3.644 20 5 EHBDHN COc1ccc([C@H](C)CN2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000540481619 1037993164 /nfs/dbraw/zinc/99/31/64/1037993164.db2.gz YEAPNJKMRJKBPT-CQSZACIVSA-N 0 3 326.396 3.765 20 5 EHBDHN C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCc2occc21 ZINC000341439289 1038274532 /nfs/dbraw/zinc/27/45/32/1038274532.db2.gz HPNQJNXOZOUWKA-MLGOLLRUSA-N 0 3 343.383 3.572 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000552034825 1038754733 /nfs/dbraw/zinc/75/47/33/1038754733.db2.gz BXLLHLFXMMBMCA-KRWDZBQOSA-N 0 3 344.415 3.608 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCNC1(c2ccc(F)cc2F)CCC1 ZINC000539359650 1038847626 /nfs/dbraw/zinc/84/76/26/1038847626.db2.gz XRAUFTNAUOEZNP-UHFFFAOYSA-N 0 3 348.349 3.921 20 5 EHBDHN COc1ccc(CNC[C@@H]2CCC3(CCCCC3)O2)cc1[N+](=O)[O-] ZINC000480444407 1039564000 /nfs/dbraw/zinc/56/40/00/1039564000.db2.gz MCCFVGXAARMQOL-HNNXBMFYSA-N 0 3 334.416 3.575 20 5 EHBDHN CC(C)[C@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)(C)O ZINC000480444951 1039566571 /nfs/dbraw/zinc/56/65/71/1039566571.db2.gz MSMHNBFKDFXVQG-HNNXBMFYSA-N 0 3 349.456 3.603 20 5 EHBDHN CC[C@@H](C)CN(CC)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298583 1039815781 /nfs/dbraw/zinc/81/57/81/1039815781.db2.gz WZEQYKDAVIBUKV-VXGBXAGGSA-N 0 3 341.839 3.943 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC(CO)(c2ccccc2)CC1 ZINC000433065626 1040619276 /nfs/dbraw/zinc/61/92/76/1040619276.db2.gz FSPFFQDGCQLSAL-INIZCTEOSA-N 0 3 340.423 3.682 20 5 EHBDHN Cc1cc(NC2CCN([C@@H](C)c3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000092687371 1040696278 /nfs/dbraw/zinc/69/62/78/1040696278.db2.gz JTVYJOZBYRUZQC-HNNXBMFYSA-N 0 3 340.427 3.936 20 5 EHBDHN CC(C)(C)OC(=O)CCN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433233880 1041122227 /nfs/dbraw/zinc/12/22/27/1041122227.db2.gz HYYHVUVZZZPDFH-OAHLLOKOSA-N 0 3 334.416 3.639 20 5 EHBDHN CCC[C@@]1(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCOC1 ZINC000512890743 1041180298 /nfs/dbraw/zinc/18/02/98/1041180298.db2.gz MIJVNJTXFCOKSQ-GOSISDBHSA-N 0 3 330.384 3.904 20 5 EHBDHN CCC[C@H]1[C@@H](C)CCCN1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799436 1042700597 /nfs/dbraw/zinc/70/05/97/1042700597.db2.gz ZMGDHQPYHQJVRS-BBRMVZONSA-N 0 3 334.416 3.782 20 5 EHBDHN COc1cccc(OC)c1CNCCCCc1ccc([N+](=O)[O-])cc1 ZINC000511995857 1042948390 /nfs/dbraw/zinc/94/83/90/1042948390.db2.gz DCOWZNBACCPPGT-UHFFFAOYSA-N 0 3 344.411 3.725 20 5 EHBDHN C[C@@H](NC[C@H](O)c1cc(F)cc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000279411124 1044062911 /nfs/dbraw/zinc/06/29/11/1044062911.db2.gz DUGBDYNNZULVPX-HWPZZCPQSA-N 0 3 338.766 3.772 20 5 EHBDHN CN(Cc1ccc(F)c(Cl)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000763823644 1126877238 /nfs/dbraw/zinc/87/72/38/1126877238.db2.gz JHXJVZLJADNXEW-INIZCTEOSA-N 0 3 338.766 3.553 20 5 EHBDHN COc1cc(NC[C@@H](c2ccco2)N2CCCCC2)ccc1[N+](=O)[O-] ZINC000301337534 1127738441 /nfs/dbraw/zinc/73/84/41/1127738441.db2.gz DPCYWWAQNWBDBB-INIZCTEOSA-N 0 3 345.399 3.836 20 5 EHBDHN CC(C)(C)[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000054396904 1120372288 /nfs/dbraw/zinc/37/22/88/1120372288.db2.gz PTZOHVLZOMVLQY-SFHVURJKSA-N 0 3 341.411 3.910 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(c2cnn(C)c2)CC1 ZINC000272272247 1121509781 /nfs/dbraw/zinc/50/97/81/1121509781.db2.gz DJLQEPNXPHKXGB-CQSZACIVSA-N 0 3 328.416 3.577 20 5 EHBDHN COc1cccc([C@H](CNc2ccc(C)cc2[N+](=O)[O-])N(C)C)c1 ZINC000301098273 1121604706 /nfs/dbraw/zinc/60/47/06/1121604706.db2.gz SATQTHWJGUYSHP-SFHVURJKSA-N 0 3 329.400 3.627 20 5 EHBDHN C[C@H]1CCC[C@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180133 1121797779 /nfs/dbraw/zinc/79/77/79/1121797779.db2.gz GNNJYBDKEINUEP-WFASDCNBSA-N 0 3 330.388 3.655 20 5 EHBDHN CN1CCNC[C@H]1c1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001212224463 1122513333 /nfs/dbraw/zinc/51/33/33/1122513333.db2.gz MXMKPDQWEXKKBC-IBGZPJMESA-N 0 3 344.418 3.619 20 5 EHBDHN CC[C@H](C)[C@H]1CCCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001845 1123710945 /nfs/dbraw/zinc/71/09/45/1123710945.db2.gz DSIHTARBBOQNJP-SUMWQHHRSA-N 0 3 334.416 3.862 20 5 EHBDHN O=[N+]([O-])c1sccc1NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000619501077 1125356207 /nfs/dbraw/zinc/35/62/07/1125356207.db2.gz QHBMMZDSBCDBRR-UHFFFAOYSA-N 0 3 349.378 3.874 20 5 EHBDHN C[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCCC1 ZINC000182940920 1125406304 /nfs/dbraw/zinc/40/63/04/1125406304.db2.gz MPLMVYJDMFRYOO-LBPRGKRZSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1c(NC(=O)[C@@H](C)N2CC[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247735 1129370993 /nfs/dbraw/zinc/37/09/93/1129370993.db2.gz HYTRUVCPMJZSAN-KGLIPLIRSA-N 0 3 333.432 3.598 20 5 EHBDHN Cc1cc(NCc2cccnc2N(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000302138731 1129769666 /nfs/dbraw/zinc/76/96/66/1129769666.db2.gz DWODLHFOOVWLLI-UHFFFAOYSA-N 0 3 337.383 3.525 20 5 EHBDHN Cc1ccc2nccc(N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2c1 ZINC000302795369 1129792274 /nfs/dbraw/zinc/79/22/74/1129792274.db2.gz OPDWVRGSBNGQLC-AWEZNQCLSA-N 0 3 349.394 3.537 20 5 EHBDHN CCC[C@@H](N[C@H]1CCCc2nn(C)cc21)c1cccc([N+](=O)[O-])c1 ZINC000282509059 1129974569 /nfs/dbraw/zinc/97/45/69/1129974569.db2.gz SQGZRWBBRNFERJ-SJORKVTESA-N 0 3 328.416 3.837 20 5 EHBDHN CCN(CC)[C@@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000173363551 1130219600 /nfs/dbraw/zinc/21/96/00/1130219600.db2.gz MYYMDQJYYMCLPG-YOEHRIQHSA-N 0 3 331.416 3.922 20 5 EHBDHN CC(C)n1cnnc1[C@H]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246191471 1130354236 /nfs/dbraw/zinc/35/42/36/1130354236.db2.gz UBSOWEIZGBFNTQ-ZBFHGGJFSA-N 0 3 343.431 3.708 20 5 EHBDHN CN(CCNc1nc2ccc([N+](=O)[O-])cc2s1)Cc1ccccc1 ZINC000731209237 1130779066 /nfs/dbraw/zinc/77/90/66/1130779066.db2.gz NJGCJTFBMOAION-UHFFFAOYSA-N 0 3 342.424 3.748 20 5 EHBDHN C[C@H]1CC(C)(C)C[C@@](CO)(NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000740008101 1131516122 /nfs/dbraw/zinc/51/61/22/1131516122.db2.gz WSJLIYZEHPRLSQ-SJCJKPOMSA-N 0 3 340.851 3.915 20 5 EHBDHN CCC[C@H]1[C@@H](C)CCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743381055 1131914104 /nfs/dbraw/zinc/91/41/04/1131914104.db2.gz SZYDYGVHTNKFKH-YOEHRIQHSA-N 0 3 343.431 3.711 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCCC3(CCC3)C2)c1F ZINC001173191657 1131995724 /nfs/dbraw/zinc/99/57/24/1131995724.db2.gz FORQIYVTBWHAII-ZDUSSCGKSA-N 0 3 336.407 3.940 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NCC(=O)c1ccc(Cl)cc1 ZINC001173215787 1132001686 /nfs/dbraw/zinc/00/16/86/1132001686.db2.gz ZSRRVXZMLBSQOP-LBPRGKRZSA-N 0 3 332.787 3.652 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1nc(-c2ccccc2)cc1CN ZINC001173215662 1132002247 /nfs/dbraw/zinc/00/22/47/1132002247.db2.gz YCXLKZHJOJMJOE-CQSZACIVSA-N 0 3 336.395 3.721 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC(C(=O)OC(C)(C)C)CC1 ZINC001173228604 1132008346 /nfs/dbraw/zinc/00/83/46/1132008346.db2.gz YFOYLIKIAVNTNB-AWEZNQCLSA-N 0 3 348.443 3.580 20 5 EHBDHN COc1cccnc1[C@@H](N[C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173228796 1132008568 /nfs/dbraw/zinc/00/85/68/1132008568.db2.gz KLGGMNMMAQCISX-ACJLOTCBSA-N 0 3 341.411 3.670 20 5 EHBDHN CN(CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccccc2)o1 ZINC001169667692 1132814402 /nfs/dbraw/zinc/81/44/02/1132814402.db2.gz VBZKIDXMWBNOFB-UHFFFAOYSA-N 0 3 337.379 3.924 20 5 EHBDHN O=[N+]([O-])c1cc2c(cc1NCc1ccc(-c3ccccn3)cc1)CNC2 ZINC001169895036 1132888658 /nfs/dbraw/zinc/88/86/58/1132888658.db2.gz YIIMVWRIAZQESC-UHFFFAOYSA-N 0 3 346.390 3.872 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H](O)c3ccccc3)o2)cc1 ZINC001177117478 1133029828 /nfs/dbraw/zinc/02/98/28/1133029828.db2.gz WOCLFXHOLCUWMF-SFHVURJKSA-N 0 3 338.363 3.678 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@@H]1CCCc2nc(C)ncc21 ZINC000786810894 1133909681 /nfs/dbraw/zinc/90/96/81/1133909681.db2.gz BPVIFJGZFDXWCO-YVJSUPCUSA-N 0 3 338.411 3.764 20 5 EHBDHN CCN(CC(N)=O)Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000789597370 1134303992 /nfs/dbraw/zinc/30/39/92/1134303992.db2.gz ULHDKNIOLTUTFI-UHFFFAOYSA-N 0 3 326.827 3.954 20 5 EHBDHN Cc1ccc(CN2CC[C@@H](Nc3ncc(Cl)cc3[N+](=O)[O-])C2)cc1 ZINC001187390246 1134334186 /nfs/dbraw/zinc/33/41/86/1134334186.db2.gz FMGLOCPSZNTMRQ-OAHLLOKOSA-N 0 3 346.818 3.638 20 5 EHBDHN CCCN(CCn1c(C)ncc1[N+](=O)[O-])[C@H](C)c1ccccc1OC ZINC001190582185 1134722219 /nfs/dbraw/zinc/72/22/19/1134722219.db2.gz ROVKIAYDYONYFZ-CQSZACIVSA-N 0 3 346.431 3.582 20 5 EHBDHN COc1ccccc1C[C@@H]1CCCN1Cc1ccc([N+](=O)[O-])cc1F ZINC001190597234 1134725286 /nfs/dbraw/zinc/72/52/86/1134725286.db2.gz KXABDFKOJAHTDH-INIZCTEOSA-N 0 3 344.386 3.950 20 5 EHBDHN COc1ccc(C[C@@H](C)NCc2cccc(F)c2F)c([N+](=O)[O-])c1 ZINC001170304716 1134739866 /nfs/dbraw/zinc/73/98/66/1134739866.db2.gz GGAPILQMJGRDPQ-LLVKDONJSA-N 0 3 336.338 3.602 20 5 EHBDHN COc1cc(CN(C)CCc2ccccc2[N+](=O)[O-])ccc1Cl ZINC001194261195 1135251237 /nfs/dbraw/zinc/25/12/37/1135251237.db2.gz GWOCQOFKEBHCOB-UHFFFAOYSA-N 0 3 334.803 3.931 20 5 EHBDHN CC(C)O[C@@H]1C[C@H](NCc2cc(Cl)ccc2[N+](=O)[O-])C1(C)C ZINC001194457537 1135270285 /nfs/dbraw/zinc/27/02/85/1135270285.db2.gz NVYPKEHUIDKLNS-LSDHHAIUSA-N 0 3 326.824 3.930 20 5 EHBDHN CC(C)O[C@@H]1C[C@@H](NCc2cc(Cl)ccc2[N+](=O)[O-])C1(C)C ZINC001194457536 1135270432 /nfs/dbraw/zinc/27/04/32/1135270432.db2.gz NVYPKEHUIDKLNS-HUUCEWRRSA-N 0 3 326.824 3.930 20 5 EHBDHN Cc1ccc([C@@H](O)[C@@H](C)NCc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809701710 1135874344 /nfs/dbraw/zinc/87/43/44/1135874344.db2.gz JCOUALUGGMOFFB-PXAZEXFGSA-N 0 3 334.803 3.768 20 5 EHBDHN C[C@@]1(CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCCC[C@@H]1O ZINC000811483110 1136091429 /nfs/dbraw/zinc/09/14/29/1136091429.db2.gz BWNCBPXZKNGYLH-ZFWWWQNUSA-N 0 3 347.242 3.932 20 5 EHBDHN CC(COC(=O)c1cc(C2CC2)nc2ccc(Cl)cc21)[N+](=O)[O-] ZINC000813104546 1136288305 /nfs/dbraw/zinc/28/83/05/1136288305.db2.gz OHXCZDZXQOPTBK-VIFPVBQESA-N 0 3 334.759 3.588 20 5 EHBDHN CC(COC(=O)CC(Cc1ccccc1)Cc1ccccc1)[N+](=O)[O-] ZINC000813107594 1136294055 /nfs/dbraw/zinc/29/40/55/1136294055.db2.gz OSXVQIUOZXOXLX-INIZCTEOSA-N 0 3 341.407 3.687 20 5 EHBDHN CC(COC(=O)[C@H](Sc1ccccc1)c1ccccc1)[N+](=O)[O-] ZINC000813105239 1136294076 /nfs/dbraw/zinc/29/40/76/1136294076.db2.gz XBDQMQCCJZWMTF-CZUORRHYSA-N 0 3 331.393 3.728 20 5 EHBDHN C[C@H]1CCCC[C@H]1N(C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000173190399 1136341514 /nfs/dbraw/zinc/34/15/14/1136341514.db2.gz OADQQRRUZPCSFL-SWLSCSKDSA-N 0 3 330.388 3.655 20 5 EHBDHN O=[N+]([O-])c1ccc2cnn(CN3CCC[C@@H](c4ccccc4)C3)c2c1 ZINC000814226335 1136425700 /nfs/dbraw/zinc/42/57/00/1136425700.db2.gz VIQITTZAYISYIL-QGZVFWFLSA-N 0 3 336.395 3.782 20 5 EHBDHN CC1(C)CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000776591403 1136453780 /nfs/dbraw/zinc/45/37/80/1136453780.db2.gz MECOHKIAHSLRCG-ZWKOTPCHSA-N 0 3 326.396 3.711 20 5 EHBDHN C[C@H](NC[C@@H](O)c1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1 ZINC000815081445 1136548590 /nfs/dbraw/zinc/54/85/90/1136548590.db2.gz DTGZEUOQXQJNES-BLLLJJGKSA-N 0 3 326.352 3.725 20 5 EHBDHN CC([C@@H](OC(=O)C[C@@H](C)C(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000860855252 1137081179 /nfs/dbraw/zinc/08/11/79/1137081179.db2.gz VOGSOGQWHLPQGA-JRKPZEMJSA-N 0 3 337.269 3.664 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CNC2(c3ccccc3Cl)CCC2)c1 ZINC000844351884 1137214404 /nfs/dbraw/zinc/21/44/04/1137214404.db2.gz SPYWBAUOKPDGPD-KRWDZBQOSA-N 0 3 346.814 3.951 20 5 EHBDHN Cc1ccc(CCC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845873388 1137316069 /nfs/dbraw/zinc/31/60/69/1137316069.db2.gz CXMUUOIHUXHXRM-SJCJKPOMSA-N 0 3 335.331 3.609 20 5 EHBDHN CC([C@H](OC(=O)CCc1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000845874291 1137316115 /nfs/dbraw/zinc/31/61/15/1137316115.db2.gz YSBVCYNRDAHMMI-BZNIZROVSA-N 0 3 337.372 3.770 20 5 EHBDHN CC([C@H](OC(=O)[C@@H](F)Cc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845873711 1137316130 /nfs/dbraw/zinc/31/61/30/1137316130.db2.gz DRPICCPHTINLGT-DQYPLSBCSA-N 0 3 349.333 3.656 20 5 EHBDHN CC([C@H](OC(=O)c1ccnc(C2CC2)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845874750 1137316172 /nfs/dbraw/zinc/31/61/72/1137316172.db2.gz IMMFXFQWSDUGPW-GTNSWQLSSA-N 0 3 344.342 3.661 20 5 EHBDHN CC([C@H](OC(=O)CCCC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845872957 1137316187 /nfs/dbraw/zinc/31/61/87/1137316187.db2.gz AYGJOZCIBRRYQN-RNCFNFMXSA-N 0 3 337.269 3.808 20 5 EHBDHN CCO[C@H](CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-])C(C)C ZINC000845876760 1137316555 /nfs/dbraw/zinc/31/65/55/1137316555.db2.gz OMFDNKPORGDDRH-SRCQZFHVSA-N 0 3 341.379 3.526 20 5 EHBDHN CC([C@H](OC(=O)[C@@H](C)c1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000845876599 1137316583 /nfs/dbraw/zinc/31/65/83/1137316583.db2.gz NCRPQBMIQBVBQM-PGUXBMHVSA-N 0 3 337.372 3.940 20 5 EHBDHN CC([C@H](OC(=O)C[C@H]1CCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845882074 1137317092 /nfs/dbraw/zinc/31/70/92/1137317092.db2.gz NWGRLZFAAXCCQI-HFAKWTLXSA-N 0 3 345.317 3.901 20 5 EHBDHN CC([C@H](OC(=O)[C@@H]1CCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845881947 1137317170 /nfs/dbraw/zinc/31/71/70/1137317170.db2.gz MZNJYYGGHGYVHR-BREBYQMCSA-N 0 3 331.290 3.511 20 5 EHBDHN C[C@@H](NCCCCNc1ccccn1)c1c(F)cccc1[N+](=O)[O-] ZINC000872032433 1137566496 /nfs/dbraw/zinc/56/64/96/1137566496.db2.gz TZSFDNOULYBPDG-CYBMUJFWSA-N 0 3 332.379 3.672 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCC1SCCS1 ZINC000872087692 1137570553 /nfs/dbraw/zinc/57/05/53/1137570553.db2.gz GXFFXJBYJPQLIT-SECBINFHSA-N 0 3 330.500 3.773 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC[C@H](C)C1 ZINC000878691189 1137725269 /nfs/dbraw/zinc/72/52/69/1137725269.db2.gz LCACKYPKEMQJTG-MELADBBJSA-N 0 3 344.415 3.949 20 5 EHBDHN Cc1c(CNC2(c3cccc(F)c3)CCOCC2)cccc1[N+](=O)[O-] ZINC000131705918 1137859321 /nfs/dbraw/zinc/85/93/21/1137859321.db2.gz YWPLCUVGTDUZIM-UHFFFAOYSA-N 0 3 344.386 3.838 20 5 EHBDHN C[C@@H]1CC(C)(C)CC[C@@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120775129 1137952352 /nfs/dbraw/zinc/95/23/52/1137952352.db2.gz NBQBXQLKNNLRII-DOMZBBRYSA-N 0 3 344.415 3.949 20 5 EHBDHN Cc1ccccc1[C@@H](C)N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000120951462 1137953848 /nfs/dbraw/zinc/95/38/48/1137953848.db2.gz QQIPFWUIKSHWOM-KGLIPLIRSA-N 0 3 327.384 3.581 20 5 EHBDHN C[C@H](NC[C@H]1COC2(CCC(C)CC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777314760 1139584666 /nfs/dbraw/zinc/58/46/66/1139584666.db2.gz WEIPAKFDUHJCKM-YHOSQGMISA-N 0 3 334.416 3.567 20 5 EHBDHN C[C@H](O)c1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192724011 1140546294 /nfs/dbraw/zinc/54/62/94/1140546294.db2.gz HMAYABNBDWIFCQ-DJJJIMSYSA-N 0 3 326.396 3.815 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](CNC(=O)OC(C)(C)C)C1 ZINC000266552520 1140701700 /nfs/dbraw/zinc/70/17/00/1140701700.db2.gz UYUQMSWONFHLRB-KGLIPLIRSA-N 0 3 349.431 3.502 20 5 EHBDHN CC(C)Oc1cccc([C@H](O)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266813204 1140725555 /nfs/dbraw/zinc/72/55/55/1140725555.db2.gz WTCNAEHHAMCVKG-IFXJQAMLSA-N 0 3 344.411 3.766 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc2c(c1)CC(=O)N2C)c1cccc([N+](=O)[O-])c1 ZINC000266899163 1140735347 /nfs/dbraw/zinc/73/53/47/1140735347.db2.gz TUAYBGRJDUQEGE-OLZOCXBDSA-N 0 3 339.395 3.526 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC[C@@H]2C[C@@H](O)c2cccs2)cc1 ZINC000267463492 1140793960 /nfs/dbraw/zinc/79/39/60/1140793960.db2.gz TVBWOBSWKPVSCE-HZPDHXFCSA-N 0 3 332.425 3.744 20 5 EHBDHN CC[C@@H](NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccc2c(c1)CCO2 ZINC000268867219 1141011797 /nfs/dbraw/zinc/01/17/97/1141011797.db2.gz WWAFSPCDWPYGAU-MRXNPFEDSA-N 0 3 342.395 3.779 20 5 EHBDHN CC[C@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000340152024 1016487997 /nfs/dbraw/zinc/48/79/97/1016487997.db2.gz IXEATXZKRJCMPF-KSSFIOAISA-N 0 3 341.411 3.971 20 5 EHBDHN CC(C)C[C@H](N)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000430390138 1016612921 /nfs/dbraw/zinc/61/29/21/1016612921.db2.gz WZFPBILRKNTJIX-KRWDZBQOSA-N 0 3 343.383 3.699 20 5 EHBDHN COc1ccc(-c2ccc(CNC3CC(C)(F)C3)o2)c([N+](=O)[O-])c1 ZINC000449370830 1032485910 /nfs/dbraw/zinc/48/59/10/1032485910.db2.gz NIKKENODECQHQS-UHFFFAOYSA-N 0 3 334.347 3.844 20 5 EHBDHN COc1c([O-])ccc(C[NH2+][C@@H](C)[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000893099338 1018470298 /nfs/dbraw/zinc/47/02/98/1018470298.db2.gz LPSCNUHECWEEGT-OLZOCXBDSA-N 0 3 330.384 3.591 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@@H](c2ccccc2)N2CCCC2)c(F)c1 ZINC000513087555 1018938113 /nfs/dbraw/zinc/93/81/13/1018938113.db2.gz FJCYQRQOXTWGFF-SFHVURJKSA-N 0 3 329.375 3.983 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H]1CCCN(C)c2ccccc21 ZINC000449654022 1032980359 /nfs/dbraw/zinc/98/03/59/1032980359.db2.gz UTHLDUFSPLXUGM-SFHVURJKSA-N 0 3 325.412 3.964 20 5 EHBDHN COc1ccc(CN[C@H]2CCCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000449653040 1032980397 /nfs/dbraw/zinc/98/03/97/1032980397.db2.gz RMKJOAIVIGBEEH-INIZCTEOSA-N 0 3 341.411 3.664 20 5 EHBDHN COc1ccc([C@H](CNc2ccccc2[N+](=O)[O-])N2CCCC2)cc1 ZINC000025777470 1022144840 /nfs/dbraw/zinc/14/48/40/1022144840.db2.gz OXFDXKIPERVXHZ-IBGZPJMESA-N 0 3 341.411 3.852 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548336452 1022375143 /nfs/dbraw/zinc/37/51/43/1022375143.db2.gz JTMBQUVGXPWYQY-CABCVRRESA-N 0 3 340.427 3.678 20 5 EHBDHN COc1ccc(-c2ccc(CNCCOC(C)(C)C)o2)c([N+](=O)[O-])c1 ZINC000517535278 1022435215 /nfs/dbraw/zinc/43/52/15/1022435215.db2.gz GSHFXOLUGBUQJU-UHFFFAOYSA-N 0 3 348.399 3.768 20 5 EHBDHN CC(C)(C)c1ccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)s1 ZINC000425958345 1022457972 /nfs/dbraw/zinc/45/79/72/1022457972.db2.gz FUCAYCDQELPQKV-UHFFFAOYSA-N 0 3 348.472 3.987 20 5 EHBDHN C[C@H](c1ccccc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000507003548 1023081269 /nfs/dbraw/zinc/08/12/69/1023081269.db2.gz WLQJUULOZPGUBZ-HIFRSBDPSA-N 0 3 329.375 3.981 20 5 EHBDHN CC[C@@H](C)CN(C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000247494854 1023352370 /nfs/dbraw/zinc/35/23/70/1023352370.db2.gz HIZJUVAOCIPLJF-GHMZBOCLSA-N 0 3 327.812 3.553 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000065202009 1023890787 /nfs/dbraw/zinc/89/07/87/1023890787.db2.gz GXGSJZBOIVCUJQ-HNNXBMFYSA-N 0 3 331.441 3.980 20 5 EHBDHN C[C@@H]1CC[C@@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000248553205 1024341541 /nfs/dbraw/zinc/34/15/41/1024341541.db2.gz JLWZGJKDJNFVGR-TYNCELHUSA-N 0 3 330.388 3.559 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCOc1ncccc1Cl ZINC000539059977 1024728331 /nfs/dbraw/zinc/72/83/31/1024728331.db2.gz FNZAJBJVXHJERB-LBPRGKRZSA-N 0 3 335.791 3.681 20 5 EHBDHN CC1(C)CCCC[C@@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000119806435 1025246234 /nfs/dbraw/zinc/24/62/34/1025246234.db2.gz PSMXHSUJZIMJBU-AWEZNQCLSA-N 0 3 330.388 3.703 20 5 EHBDHN CC1(C)CCCC[C@@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000119943748 1025475025 /nfs/dbraw/zinc/47/50/25/1025475025.db2.gz MRPBGOVDVNFPSE-AWEZNQCLSA-N 0 3 330.388 3.703 20 5 EHBDHN CCC[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000451427332 1025968061 /nfs/dbraw/zinc/96/80/61/1025968061.db2.gz WYEZLQISHKJEBA-AWEZNQCLSA-N 0 3 332.404 3.949 20 5 EHBDHN Cc1cc(-c2nc(-c3ccc(CN(C)C)cc3)no2)cc([N+](=O)[O-])c1 ZINC000530632794 1026139282 /nfs/dbraw/zinc/13/92/82/1026139282.db2.gz RTRFIYNFFDVOQL-UHFFFAOYSA-N 0 3 338.367 3.682 20 5 EHBDHN CO[C@]1(C)CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000475274981 1026424677 /nfs/dbraw/zinc/42/46/77/1026424677.db2.gz KPRFQBBYSYBIIB-GOSISDBHSA-N 0 3 330.384 3.856 20 5 EHBDHN CC(C)c1ccc(C(=O)NC[C@@H]2N(C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC001271542698 1026841379 /nfs/dbraw/zinc/84/13/79/1026841379.db2.gz IDABGWASBRMWFE-KRWDZBQOSA-N 0 3 347.459 3.568 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCC2(CO)CCCC2)c2ccccc2)c1 ZINC000186486051 1027376703 /nfs/dbraw/zinc/37/67/03/1027376703.db2.gz BFHLRWQJHVCDKS-LJQANCHMSA-N 0 3 340.423 3.827 20 5 EHBDHN CC(C)c1ccc(C(=O)Nc2ccc3c(c2)CNC3)cc1[N+](=O)[O-] ZINC000423692338 1028566992 /nfs/dbraw/zinc/56/69/92/1028566992.db2.gz FZIZUQNNGJSBGY-UHFFFAOYSA-N 0 3 325.368 3.574 20 5 EHBDHN Cc1ccc(Sc2ccc(CN[C@@H]3CC[C@H]3O)cc2[N+](=O)[O-])cc1 ZINC000424195445 1028879125 /nfs/dbraw/zinc/87/91/25/1028879125.db2.gz DHJCCKSVRQGBMI-NVXWUHKLSA-N 0 3 344.436 3.667 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000532918386 1029068946 /nfs/dbraw/zinc/06/89/46/1029068946.db2.gz TVWJNQJALFDRQG-FDQGKXFDSA-N 0 3 345.443 3.742 20 5 EHBDHN Cc1cc(-n2ccnc2)ccc1CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000192152421 1029604774 /nfs/dbraw/zinc/60/47/74/1029604774.db2.gz BZULNZIOAIOQDB-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN CN(C)c1cccc([C@@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000525271929 1029765973 /nfs/dbraw/zinc/76/59/73/1029765973.db2.gz VNGKAPBOZWYRSO-IBGZPJMESA-N 0 3 325.412 3.998 20 5 EHBDHN Cc1c(-c2noc([C@H](C)N3[C@H](C)CC[C@H]3C)n2)cccc1[N+](=O)[O-] ZINC000453246612 1029973242 /nfs/dbraw/zinc/97/32/42/1029973242.db2.gz CRVLYZWHKXJQBY-WZRBSPASSA-N 0 3 330.388 3.887 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC[C@@H](c2ccc(Cl)cc2)N(C)C)n1 ZINC000532217625 1030485248 /nfs/dbraw/zinc/48/52/48/1030485248.db2.gz BKWBTXMKZLTMFI-HNNXBMFYSA-N 0 3 334.807 3.666 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1cccc(-n2ccnc2)c1 ZINC000532224217 1030490892 /nfs/dbraw/zinc/49/08/92/1030490892.db2.gz VGXRXGNTCGFVHP-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN CC[C@H](Cc1ccccc1)N(C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482683456 1030639113 /nfs/dbraw/zinc/63/91/13/1030639113.db2.gz YHPIYHGQCKDBTM-OAHLLOKOSA-N 0 3 338.411 3.924 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC(c2cn[nH]c2)CC1 ZINC000347370071 1031428578 /nfs/dbraw/zinc/42/85/78/1031428578.db2.gz URKWECPQTRDBBX-NTEUORMPSA-N 0 3 326.400 3.601 20 5 EHBDHN COc1ccc(CN[C@@H]2CCc3cc(C)cc(C)c32)cc1[N+](=O)[O-] ZINC000594493196 1033393986 /nfs/dbraw/zinc/39/39/86/1033393986.db2.gz GMUCFCXRIWWDLR-MRXNPFEDSA-N 0 3 326.396 3.997 20 5 EHBDHN O=[N+]([O-])c1cccc(CCNCc2cc(F)ccc2OC(F)F)c1 ZINC000594933942 1033583153 /nfs/dbraw/zinc/58/31/53/1033583153.db2.gz AXXMAVPKOVHJPB-UHFFFAOYSA-N 0 3 340.301 3.668 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNCCCc2ccco2)c1 ZINC000594997483 1033623674 /nfs/dbraw/zinc/62/36/74/1033623674.db2.gz NFWJLICQNKMVCJ-UHFFFAOYSA-N 0 3 326.299 3.512 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@@H]3CO[C@H](C4CC4)C3)o2)c1 ZINC000599006390 1033639273 /nfs/dbraw/zinc/63/92/73/1033639273.db2.gz HTWYBDMZTYYTAF-KSSFIOAISA-N 0 3 328.368 3.512 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](C)c1ncc(C)s1 ZINC000595034325 1033655353 /nfs/dbraw/zinc/65/53/53/1033655353.db2.gz VGFYUMZYGMYGBS-JQWIXIFHSA-N 0 3 335.429 3.823 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C1CC1)[C@@H]1CCCCO1 ZINC000595044487 1033662567 /nfs/dbraw/zinc/66/25/67/1033662567.db2.gz ALYJPADQFRQXRL-IWEFOYFVSA-N 0 3 334.416 3.602 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCc1noc2ccccc12 ZINC000595051871 1033667985 /nfs/dbraw/zinc/66/79/85/1033667985.db2.gz WHCAFIKPRZLUIB-GFCCVEGCSA-N 0 3 341.367 3.638 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NC[C@H](CO)CC2CC2)c2ccccc2)c1 ZINC000595089277 1033698098 /nfs/dbraw/zinc/69/80/98/1033698098.db2.gz NBWMPSDUGGHEPQ-OXQOHEQNSA-N 0 3 340.423 3.682 20 5 EHBDHN Cc1noc(CN(CCc2ccccc2)C2CCCC2)c1[N+](=O)[O-] ZINC000595297653 1033721510 /nfs/dbraw/zinc/72/15/10/1033721510.db2.gz YACSEIVBKLJPDR-UHFFFAOYSA-N 0 3 329.400 3.879 20 5 EHBDHN COc1ccc([C@H]2CCN(Cc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000599679784 1034106623 /nfs/dbraw/zinc/10/66/23/1034106623.db2.gz OVYJVFDHZXZOJV-HNNXBMFYSA-N 0 3 330.359 3.732 20 5 EHBDHN COc1cc(CNCCCF)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000136507798 1034796791 /nfs/dbraw/zinc/79/67/91/1034796791.db2.gz RSAJTCKZUCYUNP-UHFFFAOYSA-N 0 3 348.374 3.632 20 5 EHBDHN Cc1cc(N(C)C2CCN(CCC(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000450947396 1034969073 /nfs/dbraw/zinc/96/90/73/1034969073.db2.gz BNLZMBJHHZPXKJ-UHFFFAOYSA-N 0 3 345.365 3.756 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000612593292 1035084104 /nfs/dbraw/zinc/08/41/04/1035084104.db2.gz ZMXSRVXWQQCWNQ-YJBOKZPZSA-N 0 3 348.349 3.883 20 5 EHBDHN CCC[C@@](C)(O)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492223243 1035511308 /nfs/dbraw/zinc/51/13/08/1035511308.db2.gz KJPKBMVZVVPMOW-RTBURBONSA-N 0 3 328.412 3.825 20 5 EHBDHN COc1ccc(CN[C@H](C)[C@@H](OC)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271973790 1035576612 /nfs/dbraw/zinc/57/66/12/1035576612.db2.gz ICKBADDEYGPDSH-KZULUSFZSA-N 0 3 348.374 3.608 20 5 EHBDHN CC(C)[C@H]1CCCC[C@@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000460350125 1035945390 /nfs/dbraw/zinc/94/53/90/1035945390.db2.gz UWKZVLKNBSREBN-CVEARBPZSA-N 0 3 344.415 3.949 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C(C)C)[C@H](O)C(F)(F)F ZINC000589162654 1036288370 /nfs/dbraw/zinc/28/83/70/1036288370.db2.gz SIHFOKLGWQVUPA-BPNCWPANSA-N 0 3 334.338 3.502 20 5 EHBDHN CC(C)c1ccc([C@H]2CCCN2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000535381396 1036423398 /nfs/dbraw/zinc/42/33/98/1036423398.db2.gz IHTRECUFMZVADI-GOSISDBHSA-N 0 3 328.416 3.752 20 5 EHBDHN O=[N+]([O-])c1cc(CNCCc2ccccc2OC(F)(F)F)cs1 ZINC000237718208 1036876937 /nfs/dbraw/zinc/87/69/37/1036876937.db2.gz DSGIAEUMNOZBHF-UHFFFAOYSA-N 0 3 346.330 3.887 20 5 EHBDHN CCOc1cccc(NC[C@@H](c2cccc(F)c2)N(C)C)c1[N+](=O)[O-] ZINC000542467866 1037399578 /nfs/dbraw/zinc/39/95/78/1037399578.db2.gz BTCINVQZLZJRJZ-INIZCTEOSA-N 0 3 347.390 3.847 20 5 EHBDHN C[C@H]1CCc2nc(CNCCc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000152535250 1037852399 /nfs/dbraw/zinc/85/23/99/1037852399.db2.gz QXMXAFHCSJGUTP-LBPRGKRZSA-N 0 3 331.441 3.508 20 5 EHBDHN C[C@@H](NCc1ccccc1-c1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000378404938 1038592960 /nfs/dbraw/zinc/59/29/60/1038592960.db2.gz QLGYLBOYRWVUCD-CQSZACIVSA-N 0 3 336.395 3.846 20 5 EHBDHN CCC(=O)c1ccc(N[C@H]2CCN(C3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000479970957 1038967397 /nfs/dbraw/zinc/96/73/97/1038967397.db2.gz QMSXLSUAIUKGOO-AWEZNQCLSA-N 0 3 331.416 3.616 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCCOC3)o2)c(Cl)c1 ZINC000237816786 1039433875 /nfs/dbraw/zinc/43/38/75/1039433875.db2.gz WKGHKOCGGMVQNA-LLVKDONJSA-N 0 3 336.775 3.777 20 5 EHBDHN O=[N+]([O-])c1ccn(C2CCN([C@H]3CCc4ccc(Cl)cc43)CC2)n1 ZINC000488968491 1039516296 /nfs/dbraw/zinc/51/62/96/1039516296.db2.gz ASFJMTBZWSILFG-INIZCTEOSA-N 0 3 346.818 3.769 20 5 EHBDHN COc1cc(CN(C)CCc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000489181958 1039712177 /nfs/dbraw/zinc/71/21/77/1039712177.db2.gz BRCOMFCWDCYKCI-UHFFFAOYSA-N 0 3 334.803 3.931 20 5 EHBDHN CCc1ccc([C@H](NCC2(N(C)C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000417357838 1039717716 /nfs/dbraw/zinc/71/77/16/1039717716.db2.gz SGGXAWBEICPAAZ-GOSISDBHSA-N 0 3 343.427 3.523 20 5 EHBDHN CC[C@@H]1CCCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000042145534 1040022100 /nfs/dbraw/zinc/02/21/00/1040022100.db2.gz OEFKWKVBBIYNSF-QWHCGFSZSA-N 0 3 330.388 3.828 20 5 EHBDHN CC(C)OCCCN(C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549861102 1040066627 /nfs/dbraw/zinc/06/66/27/1040066627.db2.gz YVOZPGGESQSMOH-UHFFFAOYSA-N 0 3 334.338 3.861 20 5 EHBDHN O=[N+]([O-])c1ccccc1CNC[C@H](c1ccco1)N1CCCCC1 ZINC000072726068 1040320485 /nfs/dbraw/zinc/32/04/85/1040320485.db2.gz ADGDTRPNNYCVNE-QGZVFWFLSA-N 0 3 329.400 3.505 20 5 EHBDHN CCC[C@H](C)[C@@H]1CCCN1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787134 1040444758 /nfs/dbraw/zinc/44/47/58/1040444758.db2.gz HEDIZDDHMCMDDG-YOEHRIQHSA-N 0 3 333.432 3.742 20 5 EHBDHN CC[C@@H]1CCCCCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000150735760 1040886248 /nfs/dbraw/zinc/88/62/48/1040886248.db2.gz SHPRGLJINCGHBX-CQSZACIVSA-N 0 3 330.388 3.799 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN(C)C1Cc2ccccc2C1 ZINC000511658258 1041040456 /nfs/dbraw/zinc/04/04/56/1041040456.db2.gz WAQCQZNYCNSMCP-UHFFFAOYSA-N 0 3 326.396 3.593 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@H]1CCCC[C@H]1n1cccn1 ZINC000128573394 1041153445 /nfs/dbraw/zinc/15/34/45/1041153445.db2.gz JNDSVNAWVBTNFR-LSDHHAIUSA-N 0 3 334.807 3.718 20 5 EHBDHN Cc1c(NC(=O)[C@@H](C)N[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000107071090 1041814384 /nfs/dbraw/zinc/81/43/84/1041814384.db2.gz WIEMDAXVWDXFQZ-ZIAGYGMSSA-N 0 3 327.384 3.581 20 5 EHBDHN CCC[C@@H]1[C@@H](C)CCCN1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799439 1042700828 /nfs/dbraw/zinc/70/08/28/1042700828.db2.gz ZMGDHQPYHQJVRS-XJKSGUPXSA-N 0 3 334.416 3.782 20 5 EHBDHN C[C@H]1CC(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)O1 ZINC000128713657 1042868987 /nfs/dbraw/zinc/86/89/87/1042868987.db2.gz AZYCNJAXBFQCSM-RYUDHWBXSA-N 0 3 347.440 3.764 20 5 EHBDHN C[C@H](NC[C@@H](O)c1cc(F)cc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000279411125 1044061237 /nfs/dbraw/zinc/06/12/37/1044061237.db2.gz DUGBDYNNZULVPX-MGPLVRAMSA-N 0 3 338.766 3.772 20 5 EHBDHN CCN(CC)[C@H](CNCc1ccc([N+](=O)[O-])cc1C)c1ccco1 ZINC000183455611 1125568041 /nfs/dbraw/zinc/56/80/41/1125568041.db2.gz NKNPWHNLNBRXOU-QGZVFWFLSA-N 0 3 331.416 3.669 20 5 EHBDHN CC(C)C[C@@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000542486181 1120609381 /nfs/dbraw/zinc/60/93/81/1120609381.db2.gz YPVMKENUQWEDPL-UKRRQHHQSA-N 0 3 326.824 3.932 20 5 EHBDHN C[C@@H]1C[C@H](c2cccc(F)c2)N(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154373077 1122586343 /nfs/dbraw/zinc/58/63/43/1122586343.db2.gz RYXQVYFTNQFPSG-ZNOIYHFQSA-N 0 3 344.386 3.850 20 5 EHBDHN CCN(Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@@H](C)CO ZINC000556945848 1123226790 /nfs/dbraw/zinc/22/67/90/1123226790.db2.gz DKRKLIWTQHOVDQ-ZDUSSCGKSA-N 0 3 348.374 3.729 20 5 EHBDHN CCOc1cc(CN2CCC[C@H](C[C@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216826 1124100496 /nfs/dbraw/zinc/10/04/96/1124100496.db2.gz ZQJWZVYOHHMWIH-NVXWUHKLSA-N 0 3 348.443 3.632 20 5 EHBDHN Cc1ccc(C)c(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000069161194 1124496349 /nfs/dbraw/zinc/49/63/49/1124496349.db2.gz MCDAEJVWTNPNNP-UHFFFAOYSA-N 0 3 325.412 3.534 20 5 EHBDHN CCC1CCC(N(C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000330627268 1129642020 /nfs/dbraw/zinc/64/20/20/1129642020.db2.gz JWWQUEXDTKIURV-UHFFFAOYSA-N 0 3 333.432 3.742 20 5 EHBDHN Cc1c(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cnn1C ZINC000156564049 1129725268 /nfs/dbraw/zinc/72/52/68/1129725268.db2.gz RSIBRKGWBWNASG-UHFFFAOYSA-N 0 3 342.424 3.655 20 5 EHBDHN Cc1c(NC(=O)[C@@H](C)NC(C)(C)c2cccs2)cccc1[N+](=O)[O-] ZINC000543506116 1129908405 /nfs/dbraw/zinc/90/84/05/1129908405.db2.gz ODUBJZFHYXZTGB-GFCCVEGCSA-N 0 3 347.440 3.817 20 5 EHBDHN C[C@H](N[C@H]1CCCC[C@H]1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171414158 1130054763 /nfs/dbraw/zinc/05/47/63/1130054763.db2.gz QCLLMALIXMXFJB-XUJVJEKNSA-N 0 3 330.388 3.874 20 5 EHBDHN C[C@@H](NCc1cccc(Cn2ccnc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173314319 1130205743 /nfs/dbraw/zinc/20/57/43/1130205743.db2.gz XMEFPLSUFVUZGX-OAHLLOKOSA-N 0 3 336.395 3.690 20 5 EHBDHN CC(C)(C)C[C@@H]1CCCN1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742146881 1131690934 /nfs/dbraw/zinc/69/09/34/1131690934.db2.gz QUTPUKJPDRUQSA-HNNXBMFYSA-N 0 3 343.431 3.711 20 5 EHBDHN CCC[C@@H]1[C@H](C)CCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381102 1131914154 /nfs/dbraw/zinc/91/41/54/1131914154.db2.gz VZVFOFQIPWOCED-RHSMWYFYSA-N 0 3 343.431 3.711 20 5 EHBDHN CCN(Cc1ccncc1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184461 1131993946 /nfs/dbraw/zinc/99/39/46/1131993946.db2.gz NLNGUFBXLZLSFZ-CYBMUJFWSA-N 0 3 347.390 3.591 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(C)C[C@@H]1c1ccccc1 ZINC001173223482 1132005219 /nfs/dbraw/zinc/00/52/19/1132005219.db2.gz ANFJYUGABFRLNS-OXJNMPFZSA-N 0 3 339.439 3.515 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N(C)CCC(=O)c1cccs1 ZINC001173230804 1132009695 /nfs/dbraw/zinc/00/96/95/1132009695.db2.gz GQEFQAZTXISVET-CYBMUJFWSA-N 0 3 332.425 3.792 20 5 EHBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCSC[C@H]2c2cccc(Cl)c2)C1 ZINC001169037125 1132637340 /nfs/dbraw/zinc/63/73/40/1132637340.db2.gz JBPHTXISHRIDJD-KCXAZCMYSA-N 0 3 340.876 3.875 20 5 EHBDHN C[C@@H](N)c1ccn(-c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC001169232670 1132703599 /nfs/dbraw/zinc/70/35/99/1132703599.db2.gz ICCXLGOMIFCFDK-GFCCVEGCSA-N 0 3 340.408 3.951 20 5 EHBDHN CCCCC[C@H]1CCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767765742 1133050263 /nfs/dbraw/zinc/05/02/63/1133050263.db2.gz RWZYZTWFGXRRHN-INIZCTEOSA-N 0 3 343.431 3.856 20 5 EHBDHN CCc1cc(CN[C@@H](CC)CSc2ccccc2[N+](=O)[O-])[nH]n1 ZINC000768104425 1133095599 /nfs/dbraw/zinc/09/55/99/1133095599.db2.gz KDAMLRKJGDGHEB-ZDUSSCGKSA-N 0 3 334.445 3.541 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN[C@H](C)c1ccc(NC(N)=O)cc1 ZINC001177803793 1133104449 /nfs/dbraw/zinc/10/44/49/1133104449.db2.gz GZXAZIIKMPMXRO-CYBMUJFWSA-N 0 3 342.399 3.553 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN[C@H]2CCc3cc(F)c(F)c(F)c32)cc1 ZINC001181807815 1133530948 /nfs/dbraw/zinc/53/09/48/1133530948.db2.gz JHGNLJJVBUEQFA-AWEZNQCLSA-N 0 3 336.313 3.832 20 5 EHBDHN CC[C@@H](C)C[C@@H](CO)NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001182519794 1133692328 /nfs/dbraw/zinc/69/23/28/1133692328.db2.gz BQHLDDXUVRMXNI-MFKMUULPSA-N 0 3 334.338 3.500 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CNCCc2ccc(F)c(F)c2)c1 ZINC000786818525 1133911325 /nfs/dbraw/zinc/91/13/25/1133911325.db2.gz HOJUBBVCNSPZNS-UHFFFAOYSA-N 0 3 326.730 3.859 20 5 EHBDHN Cc1cccc(CCCN2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC001190331431 1134683892 /nfs/dbraw/zinc/68/38/92/1134683892.db2.gz GHXFPWKFQKBBJW-UHFFFAOYSA-N 0 3 339.439 3.658 20 5 EHBDHN COc1ccc(C[C@H](C)N2CC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350556 1134760620 /nfs/dbraw/zinc/76/06/20/1134760620.db2.gz BCKOBKZPJAPXAH-KSSFIOAISA-N 0 3 326.396 3.981 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(C(C)(C)O)cc1 ZINC000775568706 1135096217 /nfs/dbraw/zinc/09/62/17/1135096217.db2.gz PUHSZCBCSXZTRD-AWEZNQCLSA-N 0 3 328.412 3.981 20 5 EHBDHN C[C@](CO)(NCc1cc(Cl)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000747529482 1135742469 /nfs/dbraw/zinc/74/24/69/1135742469.db2.gz DNBYUKCMODMRON-MRXNPFEDSA-N 0 3 326.824 3.669 20 5 EHBDHN C[C@@H](CO)N(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CCC1 ZINC000809999424 1135912616 /nfs/dbraw/zinc/91/26/16/1135912616.db2.gz HLFBNPMPKMLSDK-JTQLQIEISA-N 0 3 347.242 3.885 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1COC2(CCCCC2)O1 ZINC000776169988 1136020626 /nfs/dbraw/zinc/02/06/26/1136020626.db2.gz HKDIOKNAVBVMNS-GOEBONIOSA-N 0 3 334.416 3.630 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CCNCc1cc(F)ccc1F ZINC001201692584 1136057263 /nfs/dbraw/zinc/05/72/63/1136057263.db2.gz CPIMTOQVJYLLBG-UHFFFAOYSA-N 0 3 326.730 3.859 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C)[C@@H](O)c1cccc(F)c1 ZINC000850444408 1136259807 /nfs/dbraw/zinc/25/98/07/1136259807.db2.gz JFUZKKSGQMVWSO-OAVHHTNSSA-N 0 3 348.374 3.515 20 5 EHBDHN CC([C@@H](OC(=O)[C@H](C)Cc1ccco1)c1ccccc1F)[N+](=O)[O-] ZINC000851109241 1136338370 /nfs/dbraw/zinc/33/83/70/1136338370.db2.gz WCJZKJIPLBSKPN-BFQNTYOBSA-N 0 3 335.331 3.547 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC(c3ccc(F)cc3)CC2)cc1 ZINC000776591949 1136453119 /nfs/dbraw/zinc/45/31/19/1136453119.db2.gz MEJSCVDMXLZVSK-IBGZPJMESA-N 0 3 344.386 3.647 20 5 EHBDHN COc1ccc(C[C@H](C)N(C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000109839897 1136895029 /nfs/dbraw/zinc/89/50/29/1136895029.db2.gz UENAJHQRQGOMMZ-AWEZNQCLSA-N 0 3 344.411 3.675 20 5 EHBDHN CC([C@@H](OC(=O)c1coc(C(F)F)c1)c1ccccc1F)[N+](=O)[O-] ZINC000860854647 1137081227 /nfs/dbraw/zinc/08/12/27/1137081227.db2.gz FMSREQZVMVLMGU-AMIZOPFISA-N 0 3 343.257 3.920 20 5 EHBDHN CCCCSCC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845873229 1137316161 /nfs/dbraw/zinc/31/61/61/1137316161.db2.gz CBJCNWNINJMKEJ-IAQYHMDHSA-N 0 3 329.393 3.609 20 5 EHBDHN CC(C)c1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845873287 1137316310 /nfs/dbraw/zinc/31/63/10/1137316310.db2.gz CFSOPPDSJDQGHU-SJKOYZFVSA-N 0 3 346.358 3.907 20 5 EHBDHN CC([C@H](OC(=O)c1coc(C2CCC2)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845879979 1137316651 /nfs/dbraw/zinc/31/66/51/1137316651.db2.gz JJUDXWKXMIJTRG-BMIGLBTASA-N 0 3 348.330 3.645 20 5 EHBDHN Cc1sccc1CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845880018 1137316728 /nfs/dbraw/zinc/31/67/28/1137316728.db2.gz JXXVBKGLANAQSY-MGPLVRAMSA-N 0 3 337.372 3.688 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000121154167 1137369685 /nfs/dbraw/zinc/36/96/85/1137369685.db2.gz KQFUHCNSZZNGOJ-NWDGAFQWSA-N 0 3 347.802 3.926 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCc3ccccc3OC2)c(Cl)c1 ZINC000509444569 1137467797 /nfs/dbraw/zinc/46/77/97/1137467797.db2.gz RUIYQDBIJOXMDA-AWEZNQCLSA-N 0 3 332.787 3.732 20 5 EHBDHN CSc1cc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])co1 ZINC000870454916 1137493259 /nfs/dbraw/zinc/49/32/59/1137493259.db2.gz RGKPUVSTARCBHX-YMTOWFKASA-N 0 3 339.344 3.704 20 5 EHBDHN C[C@@H](NCCCn1cnc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872018882 1137564867 /nfs/dbraw/zinc/56/48/67/1137564867.db2.gz QMDNJVBPNYAPJQ-CYBMUJFWSA-N 0 3 342.374 3.825 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCc1c(C)noc1C ZINC000872035550 1137566814 /nfs/dbraw/zinc/56/68/14/1137566814.db2.gz WXAREGONOJWKLI-SNVBAGLBSA-N 0 3 335.429 3.815 20 5 EHBDHN C[C@@H](NC1CCC(OC(F)F)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077244 1137570039 /nfs/dbraw/zinc/57/00/39/1137570039.db2.gz DGQLQKKVGAVGIE-KPPDAEKUSA-N 0 3 332.322 3.935 20 5 EHBDHN Cc1ccccc1NC(=O)C[C@H](C)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129777 1137573072 /nfs/dbraw/zinc/57/30/72/1137573072.db2.gz RXBVVVFJLLTSGN-LSDHHAIUSA-N 0 3 341.411 3.971 20 5 EHBDHN C[C@H](NC1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1Cl ZINC000877054918 1137668846 /nfs/dbraw/zinc/66/88/46/1137668846.db2.gz LMVIWKZUKVUTNB-GCVQQVDUSA-N 0 3 338.770 3.638 20 5 EHBDHN CCC(CC)(CCO)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000282911841 1137946361 /nfs/dbraw/zinc/94/63/61/1137946361.db2.gz GMKLSIJBVDGVCI-UHFFFAOYSA-N 0 3 349.456 3.749 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cccc(CN(C)C)c1 ZINC000093946224 1138243148 /nfs/dbraw/zinc/24/31/48/1138243148.db2.gz QGBYGHWUJANWAV-UHFFFAOYSA-N 0 3 341.411 3.834 20 5 EHBDHN C[C@@H](O)C1CCN(Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000264735095 1138621297 /nfs/dbraw/zinc/62/12/97/1138621297.db2.gz QHLYZUCTZANMBH-CQSZACIVSA-N 0 3 337.419 3.539 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000152569991 1139098145 /nfs/dbraw/zinc/09/81/45/1139098145.db2.gz DLYYNJPGUGGIDL-CJNGLKHVSA-N 0 3 347.415 3.540 20 5 EHBDHN C[C@@H](NC[C@@H]1COC2(CCCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777316145 1139577010 /nfs/dbraw/zinc/57/70/10/1139577010.db2.gz RSGAYGHEGXUSJG-RHSMWYFYSA-N 0 3 334.416 3.711 20 5 EHBDHN Cc1c(CN2CCC[C@@H]2C[C@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000268309598 1140918346 /nfs/dbraw/zinc/91/83/46/1140918346.db2.gz XAKOPLIAXABHPX-WBVHZDCISA-N 0 3 330.384 3.584 20 5 EHBDHN Cc1ccc([C@H](C)NC[C@H](O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000268776818 1140989079 /nfs/dbraw/zinc/98/90/79/1140989079.db2.gz WBSPZSVYHIVADF-GTNSWQLSSA-N 0 3 336.338 3.566 20 5 EHBDHN C[C@H]1C[C@@H](CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000271258093 1141335272 /nfs/dbraw/zinc/33/52/72/1141335272.db2.gz ACNPFXXMGUQUQT-STQMWFEESA-N 0 3 347.440 3.623 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H]1c1ccccc1 ZINC000348527562 1141546131 /nfs/dbraw/zinc/54/61/31/1141546131.db2.gz TWHSHQNAUOMCAU-SFHVURJKSA-N 0 3 339.395 3.679 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H]1c1ccccc1 ZINC000348541160 1141548606 /nfs/dbraw/zinc/54/86/06/1141548606.db2.gz QQLHZEYAMTZNLR-GOSISDBHSA-N 0 3 339.395 3.679 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN(C[C@@H]1CCCO1)C1CCCC1 ZINC000430215916 1015044531 /nfs/dbraw/zinc/04/45/31/1015044531.db2.gz DHZSZBAXZHFAAR-KRWDZBQOSA-N 0 3 334.416 3.527 20 5 EHBDHN Cc1ccc2c(c1)nc(CN[C@H](C)Cc1ccccc1[N+](=O)[O-])n2C ZINC000449247101 1032384115 /nfs/dbraw/zinc/38/41/15/1032384115.db2.gz FDNJBGYMOUDFOY-CQSZACIVSA-N 0 3 338.411 3.511 20 5 EHBDHN COC(=O)CC1(NCc2cc(Cl)ccc2[N+](=O)[O-])CCCCC1 ZINC000759732821 1032561735 /nfs/dbraw/zinc/56/17/35/1032561735.db2.gz JYEIVUKIRHHCQS-UHFFFAOYSA-N 0 3 340.807 3.604 20 5 EHBDHN COc1ccc(OC)c(CNC/C(C)=C\c2cccc([N+](=O)[O-])c2)c1 ZINC000468628322 1018524160 /nfs/dbraw/zinc/52/41/60/1018524160.db2.gz AWRYKXOPCPEMOE-ZROIWOOFSA-N 0 3 342.395 3.805 20 5 EHBDHN CCN(CC)[C@@H](CN[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000119109782 1019361419 /nfs/dbraw/zinc/36/14/19/1019361419.db2.gz BJBSHLLBVDYCGK-PBHICJAKSA-N 0 3 331.416 3.922 20 5 EHBDHN COc1cc(CN(C(C)C)C(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000182785148 1019744667 /nfs/dbraw/zinc/74/46/67/1019744667.db2.gz MXGNERASYVMOGX-UHFFFAOYSA-N 0 3 346.374 3.866 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](n2ncc3ccccc32)C1 ZINC000510403172 1020767680 /nfs/dbraw/zinc/76/76/80/1020767680.db2.gz UDIOURXSBPUGRQ-KSSFIOAISA-N 0 3 336.395 3.953 20 5 EHBDHN C[C@H](O)CC(C)(C)CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602549291 1032959058 /nfs/dbraw/zinc/95/90/58/1032959058.db2.gz AGTBVGRAMIIVPT-JTQLQIEISA-N 0 3 334.338 3.500 20 5 EHBDHN COc1ccc(CN2CC[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507667348 1021425515 /nfs/dbraw/zinc/42/55/15/1021425515.db2.gz URZYPFCWOPBDPA-QGZVFWFLSA-N 0 3 326.396 3.668 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@H](c2ccccc2OC)C1 ZINC000157922696 1021718010 /nfs/dbraw/zinc/71/80/10/1021718010.db2.gz UNBPSGMSOBISAB-AWEZNQCLSA-N 0 3 342.395 3.602 20 5 EHBDHN CC(C)N(CCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000506768239 1021969048 /nfs/dbraw/zinc/96/90/48/1021969048.db2.gz STSRTJVGQUMMHA-UHFFFAOYSA-N 0 3 348.374 3.729 20 5 EHBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])CCOc1ccccc1F ZINC000506140912 1022177286 /nfs/dbraw/zinc/17/72/86/1022177286.db2.gz LMSANYKSWDPYEN-VURMDHGXSA-N 0 3 330.359 3.758 20 5 EHBDHN Cc1cc(NC[C@H]2CCC[C@@H](CO)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000326488645 1022581918 /nfs/dbraw/zinc/58/19/18/1022581918.db2.gz FMJWYPZSBLWFGF-UONOGXRCSA-N 0 3 329.400 3.662 20 5 EHBDHN C[C@H]1CC2(CC(NCc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)CO1 ZINC000897776527 1033162370 /nfs/dbraw/zinc/16/23/70/1033162370.db2.gz SBLKVCYWIXMNPM-KKJMOOEGSA-N 0 3 344.333 3.661 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCCc1nc2c(s1)CCC2 ZINC000896841432 1023983857 /nfs/dbraw/zinc/98/38/57/1023983857.db2.gz KJOZTIZNTVMXIA-UHFFFAOYSA-N 0 3 337.832 3.526 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C1CC1)C1CCC(C)CC1 ZINC000434664232 1024276984 /nfs/dbraw/zinc/27/69/84/1024276984.db2.gz TZTCKUNYMYFGQO-UHFFFAOYSA-N 0 3 345.443 3.885 20 5 EHBDHN C[C@@H](c1ccccc1)N1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957240 1024525449 /nfs/dbraw/zinc/52/54/49/1024525449.db2.gz ZMKBBUVSXQAOEL-WFASDCNBSA-N 0 3 346.818 3.891 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](Oc2ccncc2)C1 ZINC000435055008 1024584580 /nfs/dbraw/zinc/58/45/80/1024584580.db2.gz GKGPVGSPMFWEJU-FERCGXDMSA-N 0 3 339.395 3.546 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC(c2ccn(C)n2)CC1 ZINC000896495175 1025499636 /nfs/dbraw/zinc/49/96/36/1025499636.db2.gz IKVAQTMRKBOHFU-QINSGFPZSA-N 0 3 340.427 3.611 20 5 EHBDHN C[C@H](C(=O)Nc1ccc(CN(C)C)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000563273445 1025504170 /nfs/dbraw/zinc/50/41/70/1025504170.db2.gz PIWDZMQQEFFBNS-LBPRGKRZSA-N 0 3 345.374 3.538 20 5 EHBDHN CC(C)c1ccc(CN2CCC[C@@H](c3cc[nH]n3)C2)cc1[N+](=O)[O-] ZINC000121234754 1025936859 /nfs/dbraw/zinc/93/68/59/1025936859.db2.gz SRWZPNABAVQJCL-OAHLLOKOSA-N 0 3 328.416 3.821 20 5 EHBDHN COCCN(CCc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000508517427 1028485360 /nfs/dbraw/zinc/48/53/60/1028485360.db2.gz GLMXHFJILSSZAS-UHFFFAOYSA-N 0 3 328.412 3.594 20 5 EHBDHN CCCCN1CCCC[C@@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000502903860 1028831907 /nfs/dbraw/zinc/83/19/07/1028831907.db2.gz TWJLSMGOTFYMHD-MRXNPFEDSA-N 0 3 333.432 3.864 20 5 EHBDHN CC(C)[C@H](COCc1ccccc1)NCc1ccccc1[N+](=O)[O-] ZINC000446922666 1029854835 /nfs/dbraw/zinc/85/48/35/1029854835.db2.gz NIEWFPZHVATVPO-SFHVURJKSA-N 0 3 328.412 3.926 20 5 EHBDHN CN(CC=Cc1ccccc1[N+](=O)[O-])Cc1cc(C(C)(C)C)[nH]n1 ZINC000447075156 1029922124 /nfs/dbraw/zinc/92/21/24/1029922124.db2.gz BNUCVAQRDRZPHC-CLFYSBASSA-N 0 3 328.416 3.761 20 5 EHBDHN Cc1cc(-c2noc([C@@H](C)N3[C@H](C)CC[C@@H]3C)n2)cc([N+](=O)[O-])c1 ZINC000453299253 1030049747 /nfs/dbraw/zinc/04/97/47/1030049747.db2.gz WZUKBQZBRLIXAJ-FRRDWIJNSA-N 0 3 330.388 3.887 20 5 EHBDHN CCC1(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)COC1 ZINC000453365933 1030179602 /nfs/dbraw/zinc/17/96/02/1030179602.db2.gz LWQHXGCJURDHGL-GOSISDBHSA-N 0 3 326.396 3.700 20 5 EHBDHN CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCCO1 ZINC000482282896 1030307508 /nfs/dbraw/zinc/30/75/08/1030307508.db2.gz IOBIMOFEFKUBAZ-ZDUSSCGKSA-N 0 3 332.425 3.934 20 5 EHBDHN CC(C)C[C@@]1(CO)CCCN1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000475721014 1031529204 /nfs/dbraw/zinc/52/92/04/1031529204.db2.gz ZQTCPRFYHHFFOQ-MRXNPFEDSA-N 0 3 326.824 3.621 20 5 EHBDHN CCC(CC)Nc1ccncc1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000584081170 1031673964 /nfs/dbraw/zinc/67/39/64/1031673964.db2.gz KERHKCOSEAEHCV-UHFFFAOYSA-N 0 3 342.399 3.573 20 5 EHBDHN CCS[C@@H]1CC[C@H](N(C)Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000173487836 1033369203 /nfs/dbraw/zinc/36/92/03/1033369203.db2.gz NYBDKGJUYQAWRW-DZGCQCFKSA-N 0 3 334.445 3.508 20 5 EHBDHN CCCc1ccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)s1 ZINC000598677543 1033376843 /nfs/dbraw/zinc/37/68/43/1033376843.db2.gz YIPDNPHUDWGCLT-UHFFFAOYSA-N 0 3 334.445 3.642 20 5 EHBDHN CC1(C)OC[C@H]2C[C@]21NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000598987841 1033614905 /nfs/dbraw/zinc/61/49/05/1033614905.db2.gz MFZPPOJMDURAGN-XIKOKIGWSA-N 0 3 328.368 3.512 20 5 EHBDHN CCO[C@@H]1C[C@@H](N[C@H](C)c2ccc([N+](=O)[O-])cc2OC)C12CCC2 ZINC000595027126 1033648483 /nfs/dbraw/zinc/64/84/83/1033648483.db2.gz PZEJMXUMYVIQNR-CSMYWGQOSA-N 0 3 334.416 3.602 20 5 EHBDHN Cc1noc(CN2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)c1[N+](=O)[O-] ZINC000595489381 1033811244 /nfs/dbraw/zinc/81/12/44/1033811244.db2.gz ABBHJUKMPPXTFV-ARFHVFGLSA-N 0 3 327.384 3.659 20 5 EHBDHN COc1ccc([C@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603843268 1033966459 /nfs/dbraw/zinc/96/64/59/1033966459.db2.gz LOIBNZDOXFXGMA-QGZVFWFLSA-N 0 3 342.395 3.819 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nnc(CN(CCC3CC3)CC3CC3)o2)cc1 ZINC000595870821 1034031356 /nfs/dbraw/zinc/03/13/56/1034031356.db2.gz GQDFDDLQRIJFNK-UHFFFAOYSA-N 0 3 342.399 3.657 20 5 EHBDHN COc1ccc([C@H]2CCN(Cc3cccc([N+](=O)[O-])c3)C2)cc1F ZINC000599679259 1034108162 /nfs/dbraw/zinc/10/81/62/1034108162.db2.gz LXWQWPSQRDXMII-HNNXBMFYSA-N 0 3 330.359 3.732 20 5 EHBDHN C[C@H](NC(=O)[C@H]1CCCCN1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413038 1034299842 /nfs/dbraw/zinc/29/98/42/1034299842.db2.gz SKMDWINSCADWGZ-KBXCAEBGSA-N 0 3 345.443 3.569 20 5 EHBDHN COCC1(C2CCC2)CN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000597195506 1034579208 /nfs/dbraw/zinc/57/92/08/1034579208.db2.gz JLGOTOMXYXMYAQ-DHDCSXOGSA-N 0 3 330.428 3.747 20 5 EHBDHN CN1CC[C@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000571573350 1035538374 /nfs/dbraw/zinc/53/83/74/1035538374.db2.gz RJBZRLUDQCVAFT-FUHWJXTLSA-N 0 3 345.830 3.783 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nc(CN3CCC[C@H](C4CC4)C3)co2)cc1 ZINC000588977545 1036208261 /nfs/dbraw/zinc/20/82/61/1036208261.db2.gz ASFASFAXHVCCHY-HNNXBMFYSA-N 0 3 327.384 3.872 20 5 EHBDHN CCN(CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1occc1C ZINC000412023677 1036729955 /nfs/dbraw/zinc/72/99/55/1036729955.db2.gz DAQWEPUSPGEONN-UHFFFAOYSA-N 0 3 345.399 3.655 20 5 EHBDHN CCC[C@@H](NCc1ccc([S@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000090220738 1036950971 /nfs/dbraw/zinc/95/09/71/1036950971.db2.gz QUERRIOMIHKXKL-HOYKHHGWSA-N 0 3 346.452 3.963 20 5 EHBDHN C[C@@]1(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO[C@@H]1C1CC1 ZINC000542316384 1037280548 /nfs/dbraw/zinc/28/05/48/1037280548.db2.gz UHBSMFFDGTYYBX-RTBURBONSA-N 0 3 342.395 3.902 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@]3(C)CCO[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000542316624 1037280705 /nfs/dbraw/zinc/28/07/05/1037280705.db2.gz WUQDVDGPPMAKMV-KPZWWZAWSA-N 0 3 346.383 3.521 20 5 EHBDHN CC(C)CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000031582029 1037721113 /nfs/dbraw/zinc/72/11/13/1037721113.db2.gz PBNHHOQEBCGUCX-UHFFFAOYSA-N 0 3 327.812 3.553 20 5 EHBDHN CC[C@@H](NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000341203938 1037755280 /nfs/dbraw/zinc/75/52/80/1037755280.db2.gz DEEIOVIOGVSHTP-MRXNPFEDSA-N 0 3 327.384 3.583 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H](c2ccccc2)C2(CO)CC=CC2)cc1 ZINC000592175285 1037916245 /nfs/dbraw/zinc/91/62/45/1037916245.db2.gz KDBSMQFLKZABBM-LJQANCHMSA-N 0 3 338.407 3.754 20 5 EHBDHN C[C@H](CNCc1c(Cl)nc(Cl)n1C)c1ccccc1[N+](=O)[O-] ZINC000897469082 1038054920 /nfs/dbraw/zinc/05/49/20/1038054920.db2.gz CUBWCVGYKXTOIZ-SECBINFHSA-N 0 3 343.214 3.528 20 5 EHBDHN CN(C)[C@@H]1CCOc2c(Nc3ncc([N+](=O)[O-])cc3Cl)cccc21 ZINC000432945414 1040228051 /nfs/dbraw/zinc/22/80/51/1040228051.db2.gz RCMBTDWUZOOKIF-CQSZACIVSA-N 0 3 348.790 3.772 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@H](Nc3ccccc3)C2)cc1 ZINC000490029779 1040299786 /nfs/dbraw/zinc/29/97/86/1040299786.db2.gz YABIYBTYDKJJQW-KRWDZBQOSA-N 0 3 341.411 3.550 20 5 EHBDHN CC1(C)CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCC[C@H]21 ZINC000555721465 1041060332 /nfs/dbraw/zinc/06/03/32/1041060332.db2.gz REJPPJATMIELLI-HUUCEWRRSA-N 0 3 342.399 3.655 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CCN([C@@H](C)c3ccccc3)C2)n1 ZINC000541935857 1042917225 /nfs/dbraw/zinc/91/72/25/1042917225.db2.gz NAETWWQEKLWUHA-RDJZCZTQSA-N 0 3 340.427 3.854 20 5 EHBDHN CN1CCC[C@@H](CNc2ncccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301443890 1127919611 /nfs/dbraw/zinc/91/96/11/1127919611.db2.gz VAJAUWOWVMEJHE-WFASDCNBSA-N 0 3 332.429 3.546 20 5 EHBDHN C[C@@H]1C[C@H](c2ccccc2)CN1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478247 1131242041 /nfs/dbraw/zinc/24/20/41/1131242041.db2.gz XXRKYODHZIPQDE-PBHICJAKSA-N 0 3 336.395 3.780 20 5 EHBDHN CC[C@@H](NCCOc1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC001168632975 1128506177 /nfs/dbraw/zinc/50/61/77/1128506177.db2.gz HAGCHJYIXSQBFE-QGZVFWFLSA-N 0 3 336.338 3.993 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCNC2(c3ccc(F)cc3F)CCC2)c1 ZINC001168644585 1128601065 /nfs/dbraw/zinc/60/10/65/1128601065.db2.gz OCORPQGTFZYFEW-UHFFFAOYSA-N 0 3 348.349 3.921 20 5 EHBDHN COc1cc(C[NH2+]CCC(C)(C)c2ccccc2)c([N+](=O)[O-])cc1[O-] ZINC001648911443 1120123456 /nfs/dbraw/zinc/12/34/56/1120123456.db2.gz RRSYZCAYKKCVQY-UHFFFAOYSA-N 0 3 344.411 3.767 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@H](O)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000153114096 1120691140 /nfs/dbraw/zinc/69/11/40/1120691140.db2.gz MDSPIIGBWVPNLZ-KDOFPFPSSA-N 0 3 344.411 3.686 20 5 EHBDHN CN1CC[C@H](NCc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000554957920 1128948857 /nfs/dbraw/zinc/94/88/57/1128948857.db2.gz GEXGWCMCZKGRGG-FUHWJXTLSA-N 0 3 345.830 3.783 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@H]2/C=C/c2ccccc2)cc1 ZINC000780400260 1121575188 /nfs/dbraw/zinc/57/51/88/1121575188.db2.gz UQZPVQNKRTVKJO-CSXIPAGWSA-N 0 3 338.407 3.806 20 5 EHBDHN Cc1nc2ccccc2n1CCNCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000734835298 1131284524 /nfs/dbraw/zinc/28/45/24/1131284524.db2.gz SWLWPYGJULJQCJ-UHFFFAOYSA-N 0 3 344.802 3.696 20 5 EHBDHN C[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCCC1 ZINC000182937423 1125407109 /nfs/dbraw/zinc/40/71/09/1125407109.db2.gz NOAPTCRONQZXQE-LBPRGKRZSA-N 0 3 330.388 3.703 20 5 EHBDHN C[C@@H]1CCC[C@H](C)N(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000131026817 1129376491 /nfs/dbraw/zinc/37/64/91/1129376491.db2.gz YSYQPZBNUGZPQI-OLZOCXBDSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@@H](NC[C@H](c1ccco1)N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000154964575 1129601814 /nfs/dbraw/zinc/60/18/14/1129601814.db2.gz WOADWVKXAQVIIQ-RHSMWYFYSA-N 0 3 329.400 3.676 20 5 EHBDHN C[C@H](NCc1cccc(Cn2ccnc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173314305 1130205627 /nfs/dbraw/zinc/20/56/27/1130205627.db2.gz XMEFPLSUFVUZGX-HNNXBMFYSA-N 0 3 336.395 3.690 20 5 EHBDHN COc1ccc(OCCN2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000173455547 1130234399 /nfs/dbraw/zinc/23/43/99/1130234399.db2.gz JWXDANVZGVWJKS-AWEZNQCLSA-N 0 3 348.424 3.881 20 5 EHBDHN CC[C@](C)(NCCCOc1ccc([N+](=O)[O-])cc1)c1nccs1 ZINC000173510362 1130239361 /nfs/dbraw/zinc/23/93/61/1130239361.db2.gz GHAWCBCWCCFFBK-INIZCTEOSA-N 0 3 335.429 3.735 20 5 EHBDHN CCN(CCn1cc([N+](=O)[O-])cn1)[C@@H](C)c1cc2ccccc2o1 ZINC000174832755 1130387100 /nfs/dbraw/zinc/38/71/00/1130387100.db2.gz MGOWVQHNRDITBK-ZDUSSCGKSA-N 0 3 328.372 3.621 20 5 EHBDHN CCC[C@@H]1[C@@H](C)CCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743381054 1131914972 /nfs/dbraw/zinc/91/49/72/1131914972.db2.gz SZYDYGVHTNKFKH-WMLDXEAASA-N 0 3 343.431 3.711 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC[C@@](C)(F)CC2)c1F ZINC001173178945 1131992549 /nfs/dbraw/zinc/99/25/49/1131992549.db2.gz CHZIUHQIWCWBSP-SJKOYZFVSA-N 0 3 342.386 3.888 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@H](C)c2cccc(C)n2)c1F ZINC001173188038 1131993922 /nfs/dbraw/zinc/99/39/22/1131993922.db2.gz HYLOYPCRNVIIBO-QWHCGFSZSA-N 0 3 347.390 3.728 20 5 EHBDHN CCN(Cc1cccnc1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173187615 1131994093 /nfs/dbraw/zinc/99/40/93/1131994093.db2.gz AVXXDVUQUZQZDR-CYBMUJFWSA-N 0 3 347.390 3.591 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N(C)Cc2cccs2)c1F ZINC001173188543 1131994188 /nfs/dbraw/zinc/99/41/88/1131994188.db2.gz GMRNPVRCDZFWKS-NSHDSACASA-N 0 3 338.404 3.867 20 5 EHBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCSC[C@@H]2c2cccc(Cl)c2)C1 ZINC001169037123 1132636741 /nfs/dbraw/zinc/63/67/41/1132636741.db2.gz JBPHTXISHRIDJD-DAXOMENPSA-N 0 3 340.876 3.875 20 5 EHBDHN CCCCC[C@@H]1CCCN1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767765455 1133050569 /nfs/dbraw/zinc/05/05/69/1133050569.db2.gz PJTWTYDOIGOYLT-CQSZACIVSA-N 0 3 331.420 3.650 20 5 EHBDHN CC(C)(CNCc1c(Br)cccc1[N+](=O)[O-])C1CC1 ZINC001179680820 1133273815 /nfs/dbraw/zinc/27/38/15/1133273815.db2.gz CSYIXLCADWQKAV-UHFFFAOYSA-N 0 3 327.222 3.883 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CNC[C@@H](O)c1cc(F)cc(Cl)c1 ZINC000785617298 1133732685 /nfs/dbraw/zinc/73/26/85/1133732685.db2.gz YKBGQKLCOIWYJO-MRXNPFEDSA-N 0 3 338.766 3.519 20 5 EHBDHN CC[C@H](Cc1ccccc1)N(C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774908572 1134116163 /nfs/dbraw/zinc/11/61/63/1134116163.db2.gz MEMMKLBYYVSNCK-MRXNPFEDSA-N 0 3 343.383 3.956 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(Cc2ccccc2)[C@@H](CO)C2CC2)cc1F ZINC000788486379 1134131431 /nfs/dbraw/zinc/13/14/31/1134131431.db2.gz UUOAODKQRXVKBR-IBGZPJMESA-N 0 3 344.386 3.507 20 5 EHBDHN CC(C)C[C@@]1(CO)CCCN1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000789593103 1134302774 /nfs/dbraw/zinc/30/27/74/1134302774.db2.gz LYNGSLVEDKMEBX-MRXNPFEDSA-N 0 3 326.824 3.621 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCc3ccc(C)cc3C2)c([N+](=O)[O-])c1 ZINC001170327190 1134748185 /nfs/dbraw/zinc/74/81/85/1134748185.db2.gz FMLUCGAMKMCSCZ-HNNXBMFYSA-N 0 3 340.423 3.901 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCC[C@@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346406 1134759836 /nfs/dbraw/zinc/75/98/36/1134759836.db2.gz NMMLDMXVCYYKEB-KBXCAEBGSA-N 0 3 341.411 3.767 20 5 EHBDHN Cc1ccc(CC(C)(C)NCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC001195280473 1135404597 /nfs/dbraw/zinc/40/45/97/1135404597.db2.gz UGURCVSSABAOFK-UHFFFAOYSA-N 0 3 343.383 3.922 20 5 EHBDHN CCN(C)Cc1cccc(CNc2cc([N+](=O)[O-])ccc2C(C)=O)c1 ZINC000807935457 1135587962 /nfs/dbraw/zinc/58/79/62/1135587962.db2.gz NQUJSIQXVUAIIH-UHFFFAOYSA-N 0 3 341.411 3.861 20 5 EHBDHN CC[C@@H](NCc1ccc(OCCOC)cc1)c1cccc([N+](=O)[O-])c1 ZINC001201491364 1136028201 /nfs/dbraw/zinc/02/82/01/1136028201.db2.gz IRJBXCILZWKPTK-LJQANCHMSA-N 0 3 344.411 3.861 20 5 EHBDHN CO[C@@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1(C)C ZINC000811483477 1136092179 /nfs/dbraw/zinc/09/21/79/1136092179.db2.gz JYKADJLSOLKYEW-NWDGAFQWSA-N 0 3 333.215 3.805 20 5 EHBDHN CC(COC(=O)[C@@H](Sc1ccccc1)c1ccccc1)[N+](=O)[O-] ZINC000813105235 1136294288 /nfs/dbraw/zinc/29/42/88/1136294288.db2.gz XBDQMQCCJZWMTF-BBRMVZONSA-N 0 3 331.393 3.728 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@@H](CO)C1CCCCC1 ZINC000815150438 1136563163 /nfs/dbraw/zinc/56/31/63/1136563163.db2.gz CLBQEFMMUSAIPN-AWEZNQCLSA-N 0 3 326.824 3.527 20 5 EHBDHN CCN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](C)C(C)C ZINC000112659431 1136644153 /nfs/dbraw/zinc/64/41/53/1136644153.db2.gz RMHVWJFCUJPNRJ-LLVKDONJSA-N 0 3 327.812 3.553 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@](O)(c2ccccc2)C1 ZINC000859586370 1137021613 /nfs/dbraw/zinc/02/16/13/1137021613.db2.gz NNUFMVNEJLHNMS-KXBFYZLASA-N 0 3 326.396 3.639 20 5 EHBDHN C[C@@H](CSc1ccccc1)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362093 1137215385 /nfs/dbraw/zinc/21/53/85/1137215385.db2.gz XSEZFLYHLCEVTM-KSSFIOAISA-N 0 3 346.452 3.741 20 5 EHBDHN O=c1oc2cccc([N+](=O)[O-])c2n1CN(CC1CC1)C1CCCCC1 ZINC000794626672 1137221677 /nfs/dbraw/zinc/22/16/77/1137221677.db2.gz KUPVMHHWMUSNLV-UHFFFAOYSA-N 0 3 345.399 3.505 20 5 EHBDHN Cc1ccc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cc1 ZINC000845872734 1137315956 /nfs/dbraw/zinc/31/59/56/1137315956.db2.gz MXYZEVSIUZDJHY-ACJLOTCBSA-N 0 3 331.343 3.626 20 5 EHBDHN Cc1ccc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])s1 ZINC000845875041 1137316505 /nfs/dbraw/zinc/31/65/05/1137316505.db2.gz KVCGONARCLANMG-BDJLRTHQSA-N 0 3 337.372 3.688 20 5 EHBDHN C[C@@H](NCc1ccc(C2(C)OCCO2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000866421712 1137353269 /nfs/dbraw/zinc/35/32/69/1137353269.db2.gz XSFDIQHXJWAHAD-CQSZACIVSA-N 0 3 342.395 3.665 20 5 EHBDHN Cc1c(CN[C@@H](c2ccccc2)[C@H](O)C(C)C)cccc1[N+](=O)[O-] ZINC000873138764 1137591233 /nfs/dbraw/zinc/59/12/33/1137591233.db2.gz MPVLWTWLLQXQRF-RBUKOAKNSA-N 0 3 328.412 3.751 20 5 EHBDHN Cc1c(Cl)cccc1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000877484219 1137677878 /nfs/dbraw/zinc/67/78/78/1137677878.db2.gz XVTOZCVNOILVAS-UHFFFAOYSA-N 0 3 334.807 3.590 20 5 EHBDHN CC(C)(C)OC1CCC(NCc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000877683188 1137685768 /nfs/dbraw/zinc/68/57/68/1137685768.db2.gz ZYLOSNKEUNZSJO-UHFFFAOYSA-N 0 3 347.415 3.952 20 5 EHBDHN CC[C@H](C)[C@H](C)NCc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878365897 1137712893 /nfs/dbraw/zinc/71/28/93/1137712893.db2.gz GBDINKNRDGSTPV-UWVGGRQHSA-N 0 3 338.795 3.822 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC[C@@H](C)C1 ZINC000878691185 1137725224 /nfs/dbraw/zinc/72/52/24/1137725224.db2.gz LCACKYPKEMQJTG-HZSPNIEDSA-N 0 3 344.415 3.949 20 5 EHBDHN Cc1ccc([C@@H](C)NCc2ccc(F)c(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000120890084 1137953318 /nfs/dbraw/zinc/95/33/18/1137953318.db2.gz AGIBQCTVKUHHJY-CQSZACIVSA-N 0 3 345.418 3.955 20 5 EHBDHN CCC[C@@H](NCC[S@](=O)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000127424625 1138357301 /nfs/dbraw/zinc/35/73/01/1138357301.db2.gz TZWCMGNELWAFEP-IVZQSRNASA-N 0 3 326.462 3.573 20 5 EHBDHN C[C@H](NCCN(C(=O)OC(C)(C)C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000301489400 1138566614 /nfs/dbraw/zinc/56/66/14/1138566614.db2.gz RKFAIELMNNVEKE-ZDUSSCGKSA-N 0 3 349.431 3.645 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000152570211 1139098458 /nfs/dbraw/zinc/09/84/58/1139098458.db2.gz DLYYNJPGUGGIDL-CZUORRHYSA-N 0 3 347.415 3.540 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(CN(C)C)ccc2C)c1 ZINC000177340319 1139614099 /nfs/dbraw/zinc/61/40/99/1139614099.db2.gz DHZWOWXEHUNHOQ-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN Cc1cnn([C@H]2CCCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000182760526 1139991013 /nfs/dbraw/zinc/99/10/13/1139991013.db2.gz CXSDBPBANURGEM-RDJZCZTQSA-N 0 3 328.416 3.806 20 5 EHBDHN COCc1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccsc1)N(C)C ZINC000266973708 1140745614 /nfs/dbraw/zinc/74/56/14/1140745614.db2.gz MUDFIWMOCZYOAH-INIZCTEOSA-N 0 3 335.429 3.518 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000269687371 1141135384 /nfs/dbraw/zinc/13/53/84/1141135384.db2.gz TVZMAYBXGOUAOA-MSOLQXFVSA-N 0 3 330.359 3.604 20 5 EHBDHN CN(C)[C@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccccc1 ZINC000097466711 219026399 /nfs/dbraw/zinc/02/63/99/219026399.db2.gz ZITYVUMSOWUFGH-GOSISDBHSA-N 0 3 336.395 3.858 20 5 EHBDHN CCC1(O)CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000536662168 1032078831 /nfs/dbraw/zinc/07/88/31/1032078831.db2.gz PDBZIXQLKKFAHC-UHFFFAOYSA-N 0 3 330.384 3.592 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCCN(C)[C@H]2c2cccs2)n1 ZINC000247132418 1016597583 /nfs/dbraw/zinc/59/75/83/1016597583.db2.gz VPEOTBVGWDMZPF-XJKSGUPXSA-N 0 3 346.456 3.855 20 5 EHBDHN COc1ccc([C@H](C)CN2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000538279536 1032267102 /nfs/dbraw/zinc/26/71/02/1032267102.db2.gz KEMYBECXNGQSGT-CQSZACIVSA-N 0 3 326.396 3.765 20 5 EHBDHN C[C@@H]1CCCC[C@@]1(C)NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000459609980 1032326680 /nfs/dbraw/zinc/32/66/80/1032326680.db2.gz KAEMWYLJRDKTIT-SJKOYZFVSA-N 0 3 330.388 3.703 20 5 EHBDHN C[C@@H]1CCCC[C@]1(C)NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000459622518 1032334370 /nfs/dbraw/zinc/33/43/70/1032334370.db2.gz YKHNGMOLPDLXTB-PXAZEXFGSA-N 0 3 330.388 3.703 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC2(CCC(O)CC2)CC1 ZINC000449367960 1032483091 /nfs/dbraw/zinc/48/30/91/1032483091.db2.gz AKXXTMGYWPMCGR-HYXAFXHYSA-N 0 3 330.428 3.625 20 5 EHBDHN COCc1ccc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000449502975 1032685098 /nfs/dbraw/zinc/68/50/98/1032685098.db2.gz SKXOIUCLSDJHTH-HNNXBMFYSA-N 0 3 330.384 3.714 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000177365919 1017646116 /nfs/dbraw/zinc/64/61/16/1017646116.db2.gz CJPBOGXAAATUHE-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN C[C@@H](O)C[C@@H]1CCCCCN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000388351921 1017971665 /nfs/dbraw/zinc/97/16/65/1017971665.db2.gz ADDQDXSPZZGJQF-OCCSQVGLSA-N 0 3 326.824 3.764 20 5 EHBDHN CN(C)c1ccccc1CN(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000574200716 1032738448 /nfs/dbraw/zinc/73/84/48/1032738448.db2.gz DWIHXFTUGXXKOY-DHZHZOJOSA-N 0 3 325.412 3.806 20 5 EHBDHN O=[N+]([O-])c1cc(CNC[C@H]2CCCO2)ccc1Oc1ccc(F)cc1 ZINC000119919070 1018208039 /nfs/dbraw/zinc/20/80/39/1018208039.db2.gz VVYIMGBAVXTSJB-MRXNPFEDSA-N 0 3 346.358 3.795 20 5 EHBDHN CC[C@H]1C[C@H](C)CN1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000610410597 1018933328 /nfs/dbraw/zinc/93/33/28/1018933328.db2.gz VJCAACNBIZWXAK-JQWIXIFHSA-N 0 3 344.358 3.825 20 5 EHBDHN C[C@H]1CCC[C@H](C)C1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000182955972 1019852805 /nfs/dbraw/zinc/85/28/05/1019852805.db2.gz NQERNQCGGRZCJV-RYUDHWBXSA-N 0 3 330.388 3.559 20 5 EHBDHN O=[N+]([O-])c1sc(CNCCc2cccs2)cc1Br ZINC000602503906 1032938889 /nfs/dbraw/zinc/93/88/89/1032938889.db2.gz OJLFYHAISAUHHC-UHFFFAOYSA-N 0 3 347.259 3.813 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c(Cl)c1 ZINC000322895819 1021372666 /nfs/dbraw/zinc/37/26/66/1021372666.db2.gz BSPBGKWGCYTILD-UAGQMJEPSA-N 0 3 338.835 3.764 20 5 EHBDHN COc1cccc([C@H](CNc2ccc([N+](=O)[O-])cc2C)N(C)C)c1 ZINC000097262012 1021637596 /nfs/dbraw/zinc/63/75/96/1021637596.db2.gz MDTJFJBZLOWBLK-SFHVURJKSA-N 0 3 329.400 3.627 20 5 EHBDHN Cc1ncc([C@@H](C)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684815 1033084727 /nfs/dbraw/zinc/08/47/27/1033084727.db2.gz IQIBPTJSJWHWRW-RHSMWYFYSA-N 0 3 340.427 3.942 20 5 EHBDHN Cc1ncc([C@@H](C)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684814 1033085157 /nfs/dbraw/zinc/08/51/57/1033085157.db2.gz IQIBPTJSJWHWRW-PBHICJAKSA-N 0 3 340.427 3.942 20 5 EHBDHN C[C@H](Cc1ccccn1)NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602705604 1033093415 /nfs/dbraw/zinc/09/34/15/1033093415.db2.gz NOCHQDPTUQDILF-LLVKDONJSA-N 0 3 339.317 3.729 20 5 EHBDHN O=[N+]([O-])c1sc(CN[C@H]2CCCC23CC3)cc1Br ZINC000602727569 1033114742 /nfs/dbraw/zinc/11/47/42/1033114742.db2.gz CXGBFVXPAGRRDW-JTQLQIEISA-N 0 3 331.235 3.841 20 5 EHBDHN CCOC(=O)CCC1CCN([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000610996949 1023993376 /nfs/dbraw/zinc/99/33/76/1023993376.db2.gz OLHBDIGMWGEXPY-CQSZACIVSA-N 0 3 334.416 3.711 20 5 EHBDHN CCN(Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H](C)CO ZINC000430081371 1024339333 /nfs/dbraw/zinc/33/93/33/1024339333.db2.gz DKRKLIWTQHOVDQ-CYBMUJFWSA-N 0 3 348.374 3.729 20 5 EHBDHN CCN(CC)[C@@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000434953034 1024523521 /nfs/dbraw/zinc/52/35/21/1024523521.db2.gz YHGOYIGCBSGTRN-ZDUSSCGKSA-N 0 3 338.795 3.731 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1CCC2(CCC2)O1 ZINC000895677913 1024710328 /nfs/dbraw/zinc/71/03/28/1024710328.db2.gz TXEYKAFEIQFBTK-ZDUSSCGKSA-N 0 3 344.333 3.805 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H](c2ccn(C)n2)C1 ZINC000896493848 1025497730 /nfs/dbraw/zinc/49/77/30/1025497730.db2.gz WOBMZGKROULLQA-JBXOJTMHSA-N 0 3 340.427 3.611 20 5 EHBDHN CC(C)OCCOC1CCN([C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000451955078 1026415027 /nfs/dbraw/zinc/41/50/27/1026415027.db2.gz ZDSBMXLMGAWUKL-HNNXBMFYSA-N 0 3 336.432 3.562 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ncccc3[O-])s2)cc1 ZINC000475331538 1026483170 /nfs/dbraw/zinc/48/31/70/1026483170.db2.gz GWKIMEPBWSICTM-UHFFFAOYSA-N 0 3 341.392 3.714 20 5 EHBDHN O=[N+]([O-])c1cc(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)cs1 ZINC000286194386 1028824706 /nfs/dbraw/zinc/82/47/06/1028824706.db2.gz XPXLXOAMKCQETG-BRWVUGGUSA-N 0 3 344.436 3.661 20 5 EHBDHN CC(C)C[C@@H]1OCCC[C@H]1NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481756600 1029906618 /nfs/dbraw/zinc/90/66/18/1029906618.db2.gz NBDYRMSMXFYLAL-ZBFHGGJFSA-N 0 3 326.824 3.932 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(Cc2ccccc2)CC2(O)CCCC2)c1 ZINC000531888792 1029983249 /nfs/dbraw/zinc/98/32/49/1029983249.db2.gz CQPRSIYTARRAIU-UHFFFAOYSA-N 0 3 340.423 3.902 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H](C)N2[C@H](C)CC[C@H]2C)n1 ZINC000526954270 1030504311 /nfs/dbraw/zinc/50/43/11/1030504311.db2.gz DPUKKFPPBRUGII-UPJWGTAASA-N 0 3 330.388 3.887 20 5 EHBDHN COc1ccc(CN2CC[C@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000532293453 1030527135 /nfs/dbraw/zinc/52/71/35/1030527135.db2.gz YJTYSAOZKAVYHG-IBGZPJMESA-N 0 3 326.396 3.767 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@H]2CCOC2)ccc1Oc1ccccc1Cl ZINC000178996020 1031057710 /nfs/dbraw/zinc/05/77/10/1031057710.db2.gz GRXPWEWJFOTMSU-ZDUSSCGKSA-N 0 3 348.786 3.919 20 5 EHBDHN Cc1cccc(NC(=O)C[C@H](C)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000584147720 1031811748 /nfs/dbraw/zinc/81/17/48/1031811748.db2.gz ZCPSCFFHVJPXBP-AWEZNQCLSA-N 0 3 341.411 3.719 20 5 EHBDHN C[C@@H]1CC[C@@H](NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000248540692 1031908835 /nfs/dbraw/zinc/90/88/35/1031908835.db2.gz BKIHHQNVFDFWMQ-TYNCELHUSA-N 0 3 330.388 3.559 20 5 EHBDHN CCS[C@H]1CC[C@H](N(C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485924 1033367336 /nfs/dbraw/zinc/36/73/36/1033367336.db2.gz TZRWEYUWGDVNRN-ZFWWWQNUSA-N 0 3 334.445 3.508 20 5 EHBDHN C[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000594490669 1033395045 /nfs/dbraw/zinc/39/50/45/1033395045.db2.gz PFCFJCIYYQESEE-ACJLOTCBSA-N 0 3 349.394 3.514 20 5 EHBDHN CCS[C@@H]1CC[C@@H](N(C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293223 1033574142 /nfs/dbraw/zinc/57/41/42/1033574142.db2.gz TUIYLQZGPKCQBV-UKRRQHHQSA-N 0 3 348.472 3.816 20 5 EHBDHN Cc1c(CN2CC[C@H](c3ccccc3)[C@H](CO)C2)cccc1[N+](=O)[O-] ZINC000595748881 1033979006 /nfs/dbraw/zinc/97/90/06/1033979006.db2.gz YQMFXYDHYOQFGP-RBUKOAKNSA-N 0 3 340.423 3.501 20 5 EHBDHN COc1ccc([C@@H]2CCN(Cc3cccc([N+](=O)[O-])c3)C2)cc1F ZINC000599679260 1034107086 /nfs/dbraw/zinc/10/70/86/1034107086.db2.gz LXWQWPSQRDXMII-OAHLLOKOSA-N 0 3 330.359 3.732 20 5 EHBDHN CCOc1ccc([C@H](C)N[C@H]2CCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000596649650 1034346155 /nfs/dbraw/zinc/34/61/55/1034346155.db2.gz DRMFZBROZBTYLG-SJCJKPOMSA-N 0 3 341.411 3.914 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612584140 1035077011 /nfs/dbraw/zinc/07/70/11/1035077011.db2.gz RSZVAGLVYHLWKK-SFHVURJKSA-N 0 3 330.359 3.696 20 5 EHBDHN CC[C@H](C)N(CC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000595592925 1035649079 /nfs/dbraw/zinc/64/90/79/1035649079.db2.gz KXJKTUIYUOBWSH-JTQLQIEISA-N 0 3 332.347 3.825 20 5 EHBDHN CCN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCO1 ZINC000511504781 1035905766 /nfs/dbraw/zinc/90/57/66/1035905766.db2.gz AMEBYCYLYMQKHH-INIZCTEOSA-N 0 3 330.384 3.856 20 5 EHBDHN CCOc1cc(CN(C)[C@H](C)CCSCC)ccc1[N+](=O)[O-] ZINC000492721853 1036230404 /nfs/dbraw/zinc/23/04/04/1036230404.db2.gz LQBHTZCCRJZGHQ-CYBMUJFWSA-N 0 3 326.462 3.957 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000589200175 1036306344 /nfs/dbraw/zinc/30/63/44/1036306344.db2.gz VQUVAWFZZFZSGV-RRWQFYAYSA-N 0 3 330.428 3.747 20 5 EHBDHN CN1CC[C@H](NCc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(Cl)cc1 ZINC000589284651 1036339247 /nfs/dbraw/zinc/33/92/47/1036339247.db2.gz NZQLJZIQCOKGDL-WMZOPIPTSA-N 0 3 345.830 3.783 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCc2nccs2)c2ccccc2)c1 ZINC000180341610 1036697154 /nfs/dbraw/zinc/69/71/54/1036697154.db2.gz IZQYZRRDFVRULJ-GOSISDBHSA-N 0 3 339.420 3.973 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nc(CN3CC[C@H](C4CCC4)C3)co2)cc1 ZINC000591063379 1037225542 /nfs/dbraw/zinc/22/55/42/1037225542.db2.gz SFICJGCAMYKMMA-HNNXBMFYSA-N 0 3 327.384 3.872 20 5 EHBDHN CC[C@@H](O)CCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494003999 1037762991 /nfs/dbraw/zinc/76/29/91/1037762991.db2.gz NJAOAEYCPAZWEV-MOPGFXCFSA-N 0 3 328.412 3.825 20 5 EHBDHN C[C@@H]1CC(C)(C)CC[C@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000481111347 1038106654 /nfs/dbraw/zinc/10/66/54/1038106654.db2.gz OUIJSUANTCOZSD-IUODEOHRSA-N 0 3 344.415 3.949 20 5 EHBDHN Cc1ccc(CN(C)CCCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000467555821 1038472453 /nfs/dbraw/zinc/47/24/53/1038472453.db2.gz WGYDZDRXDWJOPA-UHFFFAOYSA-N 0 3 328.412 3.942 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccccc1-n1cccn1 ZINC000539040340 1038649259 /nfs/dbraw/zinc/64/92/59/1038649259.db2.gz OQJHAZKVUJWXQT-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN CC[C@@]1(CO)CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000190214075 1038697352 /nfs/dbraw/zinc/69/73/52/1038697352.db2.gz QRXPFWSASVQAFD-LJQANCHMSA-N 0 3 344.411 3.839 20 5 EHBDHN Cc1cc(N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461959426 1038697388 /nfs/dbraw/zinc/69/73/88/1038697388.db2.gz PLTVMAQXRFUFKC-CRAIPNDOSA-N 0 3 329.375 3.900 20 5 EHBDHN CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])[n-]1 ZINC000488465427 1039205977 /nfs/dbraw/zinc/20/59/77/1039205977.db2.gz OHIZDSVDFHALTP-MJBXVCDLSA-N 0 3 345.447 3.898 20 5 EHBDHN Cn1ncc2ccc(CN[C@H]3CCCc4ccc([N+](=O)[O-])cc43)cc21 ZINC000567533246 1040088037 /nfs/dbraw/zinc/08/80/37/1040088037.db2.gz DAOLORKRMNKMLU-SFHVURJKSA-N 0 3 336.395 3.649 20 5 EHBDHN CC[C@@H]1[C@@H](C)CCN1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371468 1040791822 /nfs/dbraw/zinc/79/18/22/1040791822.db2.gz MXYURLXIVJSOIU-CMPLNLGQSA-N 0 3 344.358 3.825 20 5 EHBDHN CC[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CC1(C)C ZINC000419315164 1041276016 /nfs/dbraw/zinc/27/60/16/1041276016.db2.gz JIDMINXPSNGAFP-KBPBESRZSA-N 0 3 330.388 3.559 20 5 EHBDHN Cc1cc(C)cc([C@H](C)N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000107072394 1041814573 /nfs/dbraw/zinc/81/45/73/1041814573.db2.gz BZGFPRFSLOUBKH-LSDHHAIUSA-N 0 3 341.411 3.889 20 5 EHBDHN Cc1nc2c(s1)[C@H](N(C)CCOc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000111310249 1042261426 /nfs/dbraw/zinc/26/14/26/1042261426.db2.gz WBRVFBJVABDQKY-MRXNPFEDSA-N 0 3 347.440 3.748 20 5 EHBDHN CCC[C@@H]1[C@H](C)CCCN1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799438 1042700771 /nfs/dbraw/zinc/70/07/71/1042700771.db2.gz ZMGDHQPYHQJVRS-CZUORRHYSA-N 0 3 334.416 3.782 20 5 EHBDHN COCc1ccccc1/C=C(/C)CNCc1ccc([N+](=O)[O-])cc1 ZINC000512050874 1043043677 /nfs/dbraw/zinc/04/36/77/1043043677.db2.gz FGBMPQNCMKFKQD-PTNGSMBKSA-N 0 3 326.396 3.934 20 5 EHBDHN O=[N+]([O-])c1cnc(N[C@@H](CN2CCCC2)c2ccccc2)c(Cl)c1 ZINC000301285504 1127728689 /nfs/dbraw/zinc/72/86/89/1127728689.db2.gz QKIMPSGCYLJJEO-INIZCTEOSA-N 0 3 346.818 3.892 20 5 EHBDHN Cc1ccncc1CCCN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000347576119 1128112655 /nfs/dbraw/zinc/11/26/55/1128112655.db2.gz AGYNTOSOGJQRNQ-UHFFFAOYSA-N 0 3 325.412 3.895 20 5 EHBDHN Cc1cc(NC[C@H](c2ccc(Cl)cc2)N(C)C)ncc1[N+](=O)[O-] ZINC000301470379 1128468193 /nfs/dbraw/zinc/46/81/93/1128468193.db2.gz IUNCBBYXONFTSU-OAHLLOKOSA-N 0 3 334.807 3.666 20 5 EHBDHN CCN(CC(C)C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000153737679 1128661389 /nfs/dbraw/zinc/66/13/89/1128661389.db2.gz JAKKLFPIYPWRSH-NSHDSACASA-N 0 3 327.812 3.553 20 5 EHBDHN CCOC[C@H](C)NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000494226010 1120507357 /nfs/dbraw/zinc/50/73/57/1120507357.db2.gz DYCHRYALBVGZOQ-HNNXBMFYSA-N 0 3 343.427 3.877 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@@H]1CCCC[C@H]1n1cccn1 ZINC000128573754 1122628145 /nfs/dbraw/zinc/62/81/45/1122628145.db2.gz JNDSVNAWVBTNFR-HUUCEWRRSA-N 0 3 334.807 3.718 20 5 EHBDHN C[C@@H](CCc1ccccc1[N+](=O)[O-])N[C@@H](C)c1c(F)cncc1F ZINC000556916374 1123200761 /nfs/dbraw/zinc/20/07/61/1123200761.db2.gz IDLJTEXNDQOAPZ-RYUDHWBXSA-N 0 3 335.354 3.940 20 5 EHBDHN C[C@H](CNc1cccc(F)c1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000919963679 1123248652 /nfs/dbraw/zinc/24/86/52/1123248652.db2.gz SLQLWQXCSMGWPT-CYBMUJFWSA-N 0 3 329.375 3.593 20 5 EHBDHN COCCOc1cccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000163008123 1125022221 /nfs/dbraw/zinc/02/22/21/1125022221.db2.gz XAFUKKDTUZZGLJ-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN COc1cc(NC[C@@H](c2cccs2)N(C)C)c(F)cc1[N+](=O)[O-] ZINC000301870696 1129252084 /nfs/dbraw/zinc/25/20/84/1129252084.db2.gz PEFDJGXKFYZDLQ-ZDUSSCGKSA-N 0 3 339.392 3.519 20 5 EHBDHN COc1ccc([C@@H]2CCN(Cc3ccc(OC)c([N+](=O)[O-])c3)C2)cc1 ZINC000155214828 1129619613 /nfs/dbraw/zinc/61/96/13/1129619613.db2.gz HVUKIXAKCTWXNN-MRXNPFEDSA-N 0 3 342.395 3.602 20 5 EHBDHN C[C@@H]1CCC[C@@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]1C ZINC000163022466 1129916101 /nfs/dbraw/zinc/91/61/01/1129916101.db2.gz DSWMIKYBYNOFEG-LALPHHSUSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@H](N[C@H]1CCCC[C@@H]1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171414160 1130054983 /nfs/dbraw/zinc/05/49/83/1130054983.db2.gz QCLLMALIXMXFJB-HUBLWGQQSA-N 0 3 330.388 3.874 20 5 EHBDHN C[C@H](CN(C)C(=O)OC(C)(C)C)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000701878117 1130178039 /nfs/dbraw/zinc/17/80/39/1130178039.db2.gz JYAIVDKNIFZNSQ-CHWSQXEVSA-N 0 3 337.420 3.501 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(CN(C)C)c1 ZINC000173612113 1130259606 /nfs/dbraw/zinc/25/96/06/1130259606.db2.gz NZHZWIHWERJOSC-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN COc1cccc(OCCNC(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000429246538 1130321783 /nfs/dbraw/zinc/32/17/83/1130321783.db2.gz RZQSFVFSBRZXFF-UHFFFAOYSA-N 0 3 330.384 3.507 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NC[C@@H]2CCCC[C@H]2O)c2ccccc2)c1 ZINC000246045049 1130338255 /nfs/dbraw/zinc/33/82/55/1130338255.db2.gz XMNBZJCSZPKVEB-DFQSSKMNSA-N 0 3 340.423 3.825 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H](C)[C@H](C)C1 ZINC000246055893 1130339168 /nfs/dbraw/zinc/33/91/68/1130339168.db2.gz XWJJRVJVCAPJGK-JHJVBQTASA-N 0 3 330.388 3.684 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]1COCc1ccccc1 ZINC001173225939 1132007112 /nfs/dbraw/zinc/00/71/12/1132007112.db2.gz GTJQWEGJIAHDJY-OXQOHEQNSA-N 0 3 340.423 3.817 20 5 EHBDHN CC(C)C[C@H]1CCN(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000744437182 1132093285 /nfs/dbraw/zinc/09/32/85/1132093285.db2.gz JNGPPJGCDCFSEH-OAHLLOKOSA-N 0 3 328.416 3.784 20 5 EHBDHN O=[N+]([O-])C[C@H]1CC[C@H](N2CCc3cccc(C(F)(F)F)c3C2)C1 ZINC001169039022 1132638519 /nfs/dbraw/zinc/63/85/19/1132638519.db2.gz MPANHCCZJQYBLO-AAEUAGOBSA-N 0 3 328.334 3.509 20 5 EHBDHN COc1ccc2c(c1)[C@H](NCc1ccc(OC)c([N+](=O)[O-])c1)CCC2 ZINC001178370352 1133160212 /nfs/dbraw/zinc/16/02/12/1133160212.db2.gz YEJWJTRKEDTNRY-QGZVFWFLSA-N 0 3 342.395 3.779 20 5 EHBDHN CC(C)CC[C@@H](CO)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179154646 1133232354 /nfs/dbraw/zinc/23/23/54/1133232354.db2.gz ZTDZYDJUPUQYAD-AWEZNQCLSA-N 0 3 332.400 3.742 20 5 EHBDHN Cc1ccc(CN2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246256 1133250847 /nfs/dbraw/zinc/25/08/47/1133250847.db2.gz YOWMXNWIGUYFLE-QUCCMNQESA-N 0 3 340.423 3.991 20 5 EHBDHN Cc1nn(CN2CC[C@H](C)C3(CCC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000770670938 1133457936 /nfs/dbraw/zinc/45/79/36/1133457936.db2.gz UUMJLEBWSMXHCG-ZDUSSCGKSA-N 0 3 328.416 3.723 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1cccc2c1OCCO2 ZINC000786815417 1133909987 /nfs/dbraw/zinc/90/99/87/1133909987.db2.gz SJQMVCNKDDOMBM-UVTDQMKNSA-N 0 3 340.379 3.559 20 5 EHBDHN Cc1cc(N2CCCN(Cc3ccc(C)cc3)CC2)c([N+](=O)[O-])s1 ZINC001184681128 1133981020 /nfs/dbraw/zinc/98/10/20/1133981020.db2.gz KQWSRLBKFOTBRO-UHFFFAOYSA-N 0 3 345.468 3.985 20 5 EHBDHN C[C@@H]1C[C@@H](Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])CN1C1CC1 ZINC001185775487 1134131607 /nfs/dbraw/zinc/13/16/07/1134131607.db2.gz QERDDIRMVBMERO-MWLCHTKSSA-N 0 3 329.322 3.651 20 5 EHBDHN CO[C@H](c1ccccc1F)[C@@H](C)N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788688721 1134157664 /nfs/dbraw/zinc/15/76/64/1134157664.db2.gz GTQQPQPTWQVQQF-FMTVUPSXSA-N 0 3 347.390 3.743 20 5 EHBDHN CC[C@@](C)(NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000775389787 1134703317 /nfs/dbraw/zinc/70/33/17/1134703317.db2.gz HBEHNSPECMIUGB-LJQANCHMSA-N 0 3 341.411 3.757 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCc3c(C)cccc3C2)c([N+](=O)[O-])c1 ZINC001170330109 1134749028 /nfs/dbraw/zinc/74/90/28/1134749028.db2.gz YVPDKJGSVZBVNA-OAHLLOKOSA-N 0 3 340.423 3.901 20 5 EHBDHN CO[C@@H]1[C@@H](C)[C@H](NCc2cc([N+](=O)[O-])ccc2OC(C)C)C1(C)C ZINC001170397970 1134764664 /nfs/dbraw/zinc/76/46/64/1134764664.db2.gz BWVPFEYDSAIGLM-AFAVFJNCSA-N 0 3 336.432 3.531 20 5 EHBDHN CC(C)C[C@H]1OCCC[C@@H]1NCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775870916 1135833638 /nfs/dbraw/zinc/83/36/38/1135833638.db2.gz OWKKFTWLKSKOBC-GOEBONIOSA-N 0 3 326.824 3.932 20 5 EHBDHN CC(C)c1ccc2c(c1)CCN(C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC001198845362 1135860191 /nfs/dbraw/zinc/86/01/91/1135860191.db2.gz ZKYHRQHJZABMAR-FQEVSTJZSA-N 0 3 340.423 3.810 20 5 EHBDHN O=[N+]([O-])c1cc([O-])cc(Nc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC001201222695 1135999590 /nfs/dbraw/zinc/99/95/90/1135999590.db2.gz PIXNMOKNPYXPTH-UHFFFAOYSA-N 0 3 343.383 3.519 20 5 EHBDHN O=[N+]([O-])c1ccccc1CCNCc1ccnc(Cl)c1Cl ZINC000811481958 1136091543 /nfs/dbraw/zinc/09/15/43/1136091543.db2.gz PXXLPFYJEFSTFI-UHFFFAOYSA-N 0 3 326.183 3.629 20 5 EHBDHN Cc1csc(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])n1 ZINC000811473846 1136096027 /nfs/dbraw/zinc/09/60/27/1136096027.db2.gz OHRRIKXNPZQYDM-UHFFFAOYSA-N 0 3 346.239 3.999 20 5 EHBDHN CC(COC(=O)C[C@H](Cc1ccccc1)c1ccccc1)[N+](=O)[O-] ZINC000813106931 1136294180 /nfs/dbraw/zinc/29/41/80/1136294180.db2.gz ICWWVSUIAKLHDR-QAPCUYQASA-N 0 3 327.380 3.611 20 5 EHBDHN CC(COC(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1)[N+](=O)[O-] ZINC000813110846 1136294213 /nfs/dbraw/zinc/29/42/13/1136294213.db2.gz KPVUWDCAOLUNFG-VIFPVBQESA-N 0 3 332.183 3.624 20 5 EHBDHN CC(COC(=O)[C@H](C)Sc1cc(Cl)ccc1Cl)[N+](=O)[O-] ZINC000813109779 1136294247 /nfs/dbraw/zinc/29/42/47/1136294247.db2.gz OKJBRONJRWXFSC-SFYZADRCSA-N 0 3 338.212 3.682 20 5 EHBDHN CCc1ccccc1O[C@H](C(=O)OCC(C)[N+](=O)[O-])c1ccccc1 ZINC000813110248 1136294729 /nfs/dbraw/zinc/29/47/29/1136294729.db2.gz VQWCXIBLQKOLOW-KDOFPFPSSA-N 0 3 343.379 3.578 20 5 EHBDHN CCc1ccccc1O[C@@H](C(=O)OCC(C)[N+](=O)[O-])c1ccccc1 ZINC000813110250 1136294837 /nfs/dbraw/zinc/29/48/37/1136294837.db2.gz VQWCXIBLQKOLOW-RDTXWAMCSA-N 0 3 343.379 3.578 20 5 EHBDHN CC(COC(=O)c1cc2cc(C(F)(F)F)ccc2s1)[N+](=O)[O-] ZINC000851036732 1136330814 /nfs/dbraw/zinc/33/08/14/1136330814.db2.gz MCBHSWIVHFSGCN-ZETCQYMHSA-N 0 3 333.287 3.742 20 5 EHBDHN C[C@@H]1CCC[C@]1(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816660470 1136746142 /nfs/dbraw/zinc/74/61/42/1136746142.db2.gz FURJEYKQAJZKCY-OTYXRUKQSA-N 0 3 333.215 3.542 20 5 EHBDHN Cc1c(CNC[C@H](O)c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-] ZINC000819262128 1136929509 /nfs/dbraw/zinc/92/95/09/1136929509.db2.gz RNTWRDMXAYOSDN-INIZCTEOSA-N 0 3 338.766 3.519 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@](O)(c2ccccc2)C1 ZINC000859585271 1137021490 /nfs/dbraw/zinc/02/14/90/1137021490.db2.gz MMZIJTMMDVNQFC-BEFAXECRSA-N 0 3 326.396 3.639 20 5 EHBDHN CCc1nc(CN[C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])co1 ZINC000825057480 1137163715 /nfs/dbraw/zinc/16/37/15/1137163715.db2.gz PFEDLNFGUIUIQL-CZUORRHYSA-N 0 3 329.400 3.646 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCC[C@H]1CCOC1 ZINC000825144147 1137167167 /nfs/dbraw/zinc/16/71/67/1137167167.db2.gz LUYZFUDFWAPOOG-JTQLQIEISA-N 0 3 333.215 3.808 20 5 EHBDHN CC([C@@H](OC(=O)CCc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845874223 1137316082 /nfs/dbraw/zinc/31/60/82/1137316082.db2.gz YJZIRLBEZGCSOV-SCLBCKFNSA-N 0 3 331.343 3.708 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H]1CCCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845883733 1137317064 /nfs/dbraw/zinc/31/70/64/1137317064.db2.gz VHQATZLYHNBWLQ-JTNHKYCSSA-N 0 3 345.317 3.901 20 5 EHBDHN C[C@@H](N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000121153978 1137369643 /nfs/dbraw/zinc/36/96/43/1137369643.db2.gz KQFUHCNSZZNGOJ-NEPJUHHUSA-N 0 3 347.802 3.926 20 5 EHBDHN C[C@H](CC(=O)Nc1cccc(F)c1)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129596 1137573063 /nfs/dbraw/zinc/57/30/63/1137573063.db2.gz REMXLQIKFZEWMM-OLZOCXBDSA-N 0 3 345.374 3.802 20 5 EHBDHN O=[N+]([O-])c1cccc(CNC[C@H](O)c2c(Cl)cccc2Cl)c1 ZINC000124239545 1137583551 /nfs/dbraw/zinc/58/35/51/1137583551.db2.gz OUQGMTXYCZQJHC-AWEZNQCLSA-N 0 3 341.194 3.725 20 5 EHBDHN Cc1ccc([C@@H](C)NC[C@@H](O)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000124746571 1137608253 /nfs/dbraw/zinc/60/82/53/1137608253.db2.gz HJDYQJLKPRJTHQ-PIGZYNQJSA-N 0 3 336.338 3.566 20 5 EHBDHN C[C@H](Cc1ccco1)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000876917362 1137665361 /nfs/dbraw/zinc/66/53/61/1137665361.db2.gz ROLVQHJZPKMSCU-MRVPVSSYSA-N 0 3 345.218 3.733 20 5 EHBDHN CSCC[C@@H](C)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000877054829 1137668821 /nfs/dbraw/zinc/66/88/21/1137668821.db2.gz IAJSMLQYRGUBLA-SSDOTTSWSA-N 0 3 339.280 3.650 20 5 EHBDHN O=[N+]([O-])c1cc(CNC[C@H]2CC2(Cl)Cl)cc(C(F)(F)F)c1 ZINC000877482585 1137677872 /nfs/dbraw/zinc/67/78/72/1137677872.db2.gz DAOZGKFCOHUVHF-SECBINFHSA-N 0 3 343.132 3.897 20 5 EHBDHN CC(C)(C)[C@@H]1CCCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878054896 1137700851 /nfs/dbraw/zinc/70/08/51/1137700851.db2.gz NAHCIYHOLCLRLE-AWEZNQCLSA-N 0 3 330.388 3.655 20 5 EHBDHN CCC(C)(C)N(C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878245748 1137708562 /nfs/dbraw/zinc/70/85/62/1137708562.db2.gz FZXQLYGCBUYVNU-UHFFFAOYSA-N 0 3 338.795 3.919 20 5 EHBDHN C[C@H]1CCC[C@@H]1NCc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878507751 1137718321 /nfs/dbraw/zinc/71/83/21/1137718321.db2.gz JPBFLDWDBDHSSH-CABZTGNLSA-N 0 3 336.779 3.576 20 5 EHBDHN CC(C)[C@H]1CCCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000117432289 1137930211 /nfs/dbraw/zinc/93/02/11/1137930211.db2.gz GGIQPPGTYDMNQX-OAHLLOKOSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@@H](C1CCCCC1)N(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000332195440 1137935225 /nfs/dbraw/zinc/93/52/25/1137935225.db2.gz YXKBCJDDGSZQTA-ZDUSSCGKSA-N 0 3 334.416 3.862 20 5 EHBDHN CO[C@]1(C)CCCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000332208716 1137935674 /nfs/dbraw/zinc/93/56/74/1137935674.db2.gz FRHQGQKCWPCWQJ-GOSISDBHSA-N 0 3 336.432 3.773 20 5 EHBDHN C[C@@H]1CC(C)(C)CC[C@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120775385 1137952456 /nfs/dbraw/zinc/95/24/56/1137952456.db2.gz NBQBXQLKNNLRII-IUODEOHRSA-N 0 3 344.415 3.949 20 5 EHBDHN COCCC1(CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000151168524 1139014432 /nfs/dbraw/zinc/01/44/32/1139014432.db2.gz UVQQCCBDSHSYPO-UHFFFAOYSA-N 0 3 347.440 3.625 20 5 EHBDHN Cc1nc(C[C@H]2CCCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000182744534 1139989585 /nfs/dbraw/zinc/98/95/85/1139989585.db2.gz BWLNLPPWYBNUAD-DZGCQCFKSA-N 0 3 344.415 3.610 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(O)(c2ccccc2)CC1 ZINC000185466091 1140151454 /nfs/dbraw/zinc/15/14/54/1140151454.db2.gz ZNODVLBQGPZHQX-MRXNPFEDSA-N 0 3 340.423 3.948 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ccccc1-n1cccn1)CCC2 ZINC000192776029 1140550760 /nfs/dbraw/zinc/55/07/60/1140550760.db2.gz NHEVFABUKILYRK-LJQANCHMSA-N 0 3 348.406 3.948 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc2c(c1)CC(=O)N2C)c1ccc([N+](=O)[O-])cc1 ZINC000267460860 1140793778 /nfs/dbraw/zinc/79/37/78/1140793778.db2.gz VBFIZNNVCDHYPJ-OLZOCXBDSA-N 0 3 339.395 3.526 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000270377923 1141214912 /nfs/dbraw/zinc/21/49/12/1141214912.db2.gz MLNQSXXYNVMLGQ-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891853 1141280871 /nfs/dbraw/zinc/28/08/71/1141280871.db2.gz PGJQAJVQSXMVLO-OCCSQVGLSA-N 0 3 341.415 3.531 20 5 EHBDHN COc1cc(CN(C)[C@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575521 1141521049 /nfs/dbraw/zinc/52/10/49/1141521049.db2.gz VOGCUFNGAHPJMZ-JQWIXIFHSA-N 0 3 344.358 3.825 20 5 EHBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](C)c1nc2c(s1)CCC2 ZINC000459645382 1032367144 /nfs/dbraw/zinc/36/71/44/1032367144.db2.gz GKDWITWLUBHBKE-NEPJUHHUSA-N 0 3 331.441 3.822 20 5 EHBDHN COc1ccc(-c2ccc(CNCCC(C)(F)F)o2)c([N+](=O)[O-])c1 ZINC000449355412 1032494325 /nfs/dbraw/zinc/49/43/25/1032494325.db2.gz ZAOHCBDOLQADBO-UHFFFAOYSA-N 0 3 340.326 3.998 20 5 EHBDHN Cc1cc(C)cc([C@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000537115608 1032526998 /nfs/dbraw/zinc/52/69/98/1032526998.db2.gz JJLYBMYQDDQGJM-GJZGRUSLSA-N 0 3 341.411 3.889 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(Cc3cnn4ccccc34)C2)cc1 ZINC000449501190 1032681782 /nfs/dbraw/zinc/68/17/82/1032681782.db2.gz PGAWOHGJYQDMGZ-MRXNPFEDSA-N 0 3 336.395 3.622 20 5 EHBDHN C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cnn(C)c1 ZINC000610272988 1017160322 /nfs/dbraw/zinc/16/03/22/1017160322.db2.gz AAWMXZPJIMWJIG-LBPRGKRZSA-N 0 3 342.424 3.908 20 5 EHBDHN CC(C)n1ccc(C[C@@H](C)NCc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000468033498 1017526566 /nfs/dbraw/zinc/52/65/66/1017526566.db2.gz LFRLHAYFFYHUJE-GFCCVEGCSA-N 0 3 336.823 3.746 20 5 EHBDHN C[C@@H]1CCN(c2ccc([N+](=O)[O-])s2)CCN1Cc1ccccc1 ZINC000610284396 1017685598 /nfs/dbraw/zinc/68/55/98/1017685598.db2.gz YCRPVESVRYBZPC-CQSZACIVSA-N 0 3 331.441 3.757 20 5 EHBDHN COc1cc(F)cc(CNC/C(C)=C\c2cccc([N+](=O)[O-])c2)c1 ZINC000468615717 1018220218 /nfs/dbraw/zinc/22/02/18/1018220218.db2.gz QWURKSHBXWYRHV-MLPAPPSSSA-N 0 3 330.359 3.936 20 5 EHBDHN C[C@@H]1CCCC[C@H]1N(C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548075194 1018999310 /nfs/dbraw/zinc/99/93/10/1018999310.db2.gz XGALUINHRBIZIA-BXUZGUMPSA-N 0 3 339.823 3.697 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN(C[C@H]1CCOC1)C1CC1 ZINC000602439514 1032888549 /nfs/dbraw/zinc/88/85/49/1032888549.db2.gz HJAZHRCYOYJJIN-LLVKDONJSA-N 0 3 344.333 3.615 20 5 EHBDHN CCC(C)(C)[C@H]1CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000156732768 1020295231 /nfs/dbraw/zinc/29/52/31/1020295231.db2.gz MLFOGKKNULEIAK-MRXNPFEDSA-N 0 3 334.416 3.862 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1ccccc1Cn1cccn1 ZINC000581141733 1020471588 /nfs/dbraw/zinc/47/15/88/1020471588.db2.gz BBPPKVXKXWXBFH-IBGZPJMESA-N 0 3 348.406 3.617 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN(CCCCCn1cccn1)C1CC1 ZINC000135219440 1020903699 /nfs/dbraw/zinc/90/36/99/1020903699.db2.gz SURYNDPLLKFCQT-UHFFFAOYSA-N 0 3 328.416 3.626 20 5 EHBDHN CCS[C@@H]1CCC[C@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602567746 1032977380 /nfs/dbraw/zinc/97/73/80/1032977380.db2.gz KUHCFNCHZQNZDN-WCQYABFASA-N 0 3 335.429 3.890 20 5 EHBDHN CCC1CCC(N(C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000506180297 1022405702 /nfs/dbraw/zinc/40/57/02/1022405702.db2.gz UAUOBXAVHHEUTA-UHFFFAOYSA-N 0 3 334.416 3.862 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000058933016 1033085839 /nfs/dbraw/zinc/08/58/39/1033085839.db2.gz ONAJWPBSGHYVJG-GOSISDBHSA-N 0 3 330.359 3.950 20 5 EHBDHN C[C@@H](CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 ZINC000602707369 1033095757 /nfs/dbraw/zinc/09/57/57/1033095757.db2.gz UOAQMHQGZZTLHE-NSHDSACASA-N 0 3 339.317 3.902 20 5 EHBDHN COc1cc(CN(C)[C@H](C)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000341807626 1023354284 /nfs/dbraw/zinc/35/42/84/1023354284.db2.gz KESQCHOXCXWSDU-SNVBAGLBSA-N 0 3 332.347 3.681 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC(n2cc(Cl)cn2)CC1 ZINC000611561337 1024312310 /nfs/dbraw/zinc/31/23/10/1024312310.db2.gz RDLCOCPNSPEHNW-HYXAFXHYSA-N 0 3 346.818 3.795 20 5 EHBDHN CC(=O)Nc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000178486288 1024324824 /nfs/dbraw/zinc/32/48/24/1024324824.db2.gz LCWOLDXQYVEULQ-CYBMUJFWSA-N 0 3 327.384 3.712 20 5 EHBDHN C[C@@H]1CCC[C@@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478213 1025659373 /nfs/dbraw/zinc/65/93/73/1025659373.db2.gz HEEKVOKEPUDIPW-TZMCWYRMSA-N 0 3 330.388 3.655 20 5 EHBDHN COCCNc1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000127106296 1026276096 /nfs/dbraw/zinc/27/60/96/1026276096.db2.gz RPUUPARSWPUYLX-OAHLLOKOSA-N 0 3 343.427 3.812 20 5 EHBDHN CC[C@@H]1CC[C@H](C)N(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000451973682 1026430123 /nfs/dbraw/zinc/43/01/23/1026430123.db2.gz XPULYPDFMMWVPD-QWHCGFSZSA-N 0 3 330.388 3.655 20 5 EHBDHN CC[C@@H](C)[C@H](C)N(CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288261 1029581051 /nfs/dbraw/zinc/58/10/51/1029581051.db2.gz WUFPQVPSYZPABD-OCCSQVGLSA-N 0 3 333.432 3.741 20 5 EHBDHN CC[C@@H](C)N[C@@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000343248213 1029883722 /nfs/dbraw/zinc/88/37/22/1029883722.db2.gz IVWJELPYHMRMLP-WBMJQRKESA-N 0 3 345.399 3.932 20 5 EHBDHN CCN(CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1cccs1 ZINC000441249809 1030132328 /nfs/dbraw/zinc/13/23/28/1030132328.db2.gz PEBLJRJWVVTFKZ-UHFFFAOYSA-N 0 3 336.413 3.566 20 5 EHBDHN CC[C@@H]1CCCC[C@@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000163239741 1030219221 /nfs/dbraw/zinc/21/92/21/1030219221.db2.gz GKSFSNBNEKGUKY-DOMZBBRYSA-N 0 3 330.388 3.703 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC(C)(C)OC1(C)C ZINC000482157695 1030235227 /nfs/dbraw/zinc/23/52/27/1030235227.db2.gz NBXKFPJVEXNMRK-MRXNPFEDSA-N 0 3 336.432 3.818 20 5 EHBDHN COCC1(NCc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000532213222 1030483052 /nfs/dbraw/zinc/48/30/52/1030483052.db2.gz ZQFCQDVZCOUZBG-UHFFFAOYSA-N 0 3 341.411 3.631 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](c2ccc(F)cc2)C1 ZINC000483104657 1030961321 /nfs/dbraw/zinc/96/13/21/1030961321.db2.gz WFNIHZOTBLRRRZ-CQSZACIVSA-N 0 3 330.359 3.732 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCC2(O)CCC2)c2ccccc2)c1 ZINC000551570958 1031464377 /nfs/dbraw/zinc/46/43/77/1031464377.db2.gz JWKSXWPGXWLIDN-GOSISDBHSA-N 0 3 326.396 3.579 20 5 EHBDHN C[C@H](NCCOc1ccc([N+](=O)[O-])cc1)c1cc(F)c(F)c(F)c1 ZINC000537975694 1032054115 /nfs/dbraw/zinc/05/41/15/1032054115.db2.gz YPVSBIHWODHNHC-JTQLQIEISA-N 0 3 340.301 3.742 20 5 EHBDHN Cc1ccc(CNC[C@@H](c2ccco2)N2CCCCC2)cc1[N+](=O)[O-] ZINC000061013492 1033436397 /nfs/dbraw/zinc/43/63/97/1033436397.db2.gz PRCSRDZNEOAQCR-SFHVURJKSA-N 0 3 343.427 3.813 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](c1cccs1)N(C)C ZINC000595002904 1033628618 /nfs/dbraw/zinc/62/86/18/1033628618.db2.gz BEKHWQSRNHYPAX-IUODEOHRSA-N 0 3 349.456 3.618 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CO[C@@H](C4CC4)C3)o2)cc1 ZINC000599007612 1033640802 /nfs/dbraw/zinc/64/08/02/1033640802.db2.gz QPLRZCUXFOCPRO-RDTXWAMCSA-N 0 3 328.368 3.512 20 5 EHBDHN Cc1noc(CN[C@@H]2CCCC[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000595441565 1033806688 /nfs/dbraw/zinc/80/66/88/1033806688.db2.gz WTMIGHUIDWQKQX-HZPDHXFCSA-N 0 3 329.400 3.782 20 5 EHBDHN Cc1noc(CN2CCC[C@@]2(C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000595552526 1033859280 /nfs/dbraw/zinc/85/92/80/1033859280.db2.gz MKHKUVMUYIXOSW-KRWDZBQOSA-N 0 3 333.363 3.628 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595748158 1033979091 /nfs/dbraw/zinc/97/90/91/1033979091.db2.gz QDVUYDDMEIMJJK-HHXXYDBFSA-N 0 3 340.423 3.754 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1 ZINC000604427980 1034376170 /nfs/dbraw/zinc/37/61/70/1034376170.db2.gz MVWJWWGIEUPJTK-KRWDZBQOSA-N 0 3 342.395 3.645 20 5 EHBDHN CCC[C@H](C)NC(=O)[C@H]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000250425153 1034848005 /nfs/dbraw/zinc/84/80/05/1034848005.db2.gz FQUKDQQPUXBILH-UXLLHSPISA-N 0 3 347.459 3.673 20 5 EHBDHN COc1ccc([C@H](CN2CCCC2)Nc2ccc([N+](=O)[O-])s2)cc1 ZINC000612449918 1034946663 /nfs/dbraw/zinc/94/66/63/1034946663.db2.gz KDCKBWMICORTQN-HNNXBMFYSA-N 0 3 347.440 3.914 20 5 EHBDHN CCCN(Cc1ccc([N+](=O)[O-])c(OCC)c1)C[C@@H]1CCCCO1 ZINC000492531541 1035933380 /nfs/dbraw/zinc/93/33/80/1035933380.db2.gz FZLVYITZVFEUIC-INIZCTEOSA-N 0 3 336.432 3.775 20 5 EHBDHN CCc1ccc(C(=O)Nc2cc(C)cc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000535418392 1036457469 /nfs/dbraw/zinc/45/74/69/1036457469.db2.gz BWFGZCJKDZOWJH-UHFFFAOYSA-N 0 3 341.411 3.780 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN[C@H](C)[C@H]1Oc2ccccc2[C@H]1C ZINC000541691067 1036563694 /nfs/dbraw/zinc/56/36/94/1036563694.db2.gz URABNAIBUJMKBI-VPZZIHKRSA-N 0 3 342.395 3.646 20 5 EHBDHN Cc1ccc([C@H](C)NC[C@H](O)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000271800026 1037295744 /nfs/dbraw/zinc/29/57/44/1037295744.db2.gz PESJYSWBMYYIKQ-GTNSWQLSSA-N 0 3 336.338 3.566 20 5 EHBDHN CCC[C@H](C)NC(=O)[C@@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000051053805 1037531138 /nfs/dbraw/zinc/53/11/38/1037531138.db2.gz FQUKDQQPUXBILH-YQQAZPJKSA-N 0 3 347.459 3.673 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1ccc(OC(C)C)nc1 ZINC000468645104 1037938233 /nfs/dbraw/zinc/93/82/33/1037938233.db2.gz KHWZDCMMOBEBBF-DHDCSXOGSA-N 0 3 341.411 3.970 20 5 EHBDHN C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCc2occc21 ZINC000341439284 1038318972 /nfs/dbraw/zinc/31/89/72/1038318972.db2.gz HPNQJNXOZOUWKA-BLLLJJGKSA-N 0 3 343.383 3.572 20 5 EHBDHN COc1cc(CN2CC[C@H](Cc3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000485574442 1039265100 /nfs/dbraw/zinc/26/51/00/1039265100.db2.gz YGFBWZCWWISFPM-MRXNPFEDSA-N 0 3 344.386 3.807 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC(c3ccsc3)CC2)c1 ZINC000485892905 1039663230 /nfs/dbraw/zinc/66/32/30/1039663230.db2.gz ZNGXAEKOYLYLLA-UHFFFAOYSA-N 0 3 332.425 3.915 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@@H]1CCCC[C@@H]1n1cccn1 ZINC000128573982 1041143527 /nfs/dbraw/zinc/14/35/27/1041143527.db2.gz JNDSVNAWVBTNFR-CABCVRRESA-N 0 3 334.807 3.718 20 5 EHBDHN C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000181640796 1041162732 /nfs/dbraw/zinc/16/27/32/1041162732.db2.gz YSZIYQCISRUMFY-LLVKDONJSA-N 0 3 349.337 3.552 20 5 EHBDHN Cc1cc(N[C@@H]2CCN(C3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549507302 1041395200 /nfs/dbraw/zinc/39/52/00/1041395200.db2.gz BDSDDNUMFNHJTO-SNVBAGLBSA-N 0 3 329.322 3.571 20 5 EHBDHN Cc1nc2c(s1)[C@@H](N(C)CCOc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000111310251 1042259536 /nfs/dbraw/zinc/25/95/36/1042259536.db2.gz WBRVFBJVABDQKY-INIZCTEOSA-N 0 3 347.440 3.748 20 5 EHBDHN Cc1c(CNCc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000048818738 1042419650 /nfs/dbraw/zinc/41/96/50/1042419650.db2.gz RBQHPRZRVYFHGA-UHFFFAOYSA-N 0 3 335.201 3.956 20 5 EHBDHN CC[C@@H]1CCC[C@H]1N[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000279239361 1043639093 /nfs/dbraw/zinc/63/90/93/1043639093.db2.gz JWOLGSLRJKRMCZ-LALPHHSUSA-N 0 3 330.388 3.874 20 5 EHBDHN COCC[C@@H](Cc1ccco1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000344321937 1043661193 /nfs/dbraw/zinc/66/11/93/1043661193.db2.gz GDSISAWILKIQDB-ZDUSSCGKSA-N 0 3 338.791 3.579 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2cnn(CN3CC[C@@H](c4ccccc4)C3)c2)cc1 ZINC000728899651 1043716089 /nfs/dbraw/zinc/71/60/89/1043716089.db2.gz KJHDMFZDWITBAS-GOSISDBHSA-N 0 3 348.406 3.905 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(C[S@](C)=O)cc1 ZINC000552317878 1127749109 /nfs/dbraw/zinc/74/91/09/1127749109.db2.gz JWEQKVYLLIKZAQ-SHACYNPGSA-N 0 3 346.452 3.633 20 5 EHBDHN Cc1cnc(NC[C@H](c2ccccc2)N2CCCC2)c([N+](=O)[O-])c1 ZINC000301458496 1128344586 /nfs/dbraw/zinc/34/45/86/1128344586.db2.gz SWDNJQQDXFLCME-QGZVFWFLSA-N 0 3 326.400 3.547 20 5 EHBDHN C[C@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CN1C1CC1 ZINC000301554966 1128497127 /nfs/dbraw/zinc/49/71/27/1128497127.db2.gz ICXPBAWNVXSAHO-ONGXEEELSA-N 0 3 329.322 3.651 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCSc3ccc(F)cc32)cc1 ZINC000765844705 1128547150 /nfs/dbraw/zinc/54/71/50/1128547150.db2.gz HXFKTPKBPJGEMF-JKSUJKDBSA-N 0 3 348.399 3.594 20 5 EHBDHN COC(=O)Nc1cccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000495690200 1121359036 /nfs/dbraw/zinc/35/90/36/1121359036.db2.gz LHVNGPVBXDOFKJ-CYBMUJFWSA-N 0 3 343.383 3.932 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccccc1F ZINC000064350040 1123574465 /nfs/dbraw/zinc/57/44/65/1123574465.db2.gz ULCAZPCTBDPLJK-GOSISDBHSA-N 0 3 332.375 3.678 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1C[C@@H](c2ccccc2)C[C@H]1C ZINC000609672673 1123641723 /nfs/dbraw/zinc/64/17/23/1123641723.db2.gz WAOXMCXHAVGYLV-ZBFHGGJFSA-N 0 3 326.396 3.981 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)[C@H]1CCCc2c1cnn2C ZINC000615835120 1123884506 /nfs/dbraw/zinc/88/45/06/1123884506.db2.gz PURRORKVIFRPAP-MDNBWPLSSA-N 0 3 340.427 3.741 20 5 EHBDHN CCC[C@]1(COC)CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000618550629 1125106304 /nfs/dbraw/zinc/10/63/04/1125106304.db2.gz LPNFHXVSOTUMAN-QGZVFWFLSA-N 0 3 333.388 3.517 20 5 EHBDHN C[C@@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCC1 ZINC000182933175 1125397119 /nfs/dbraw/zinc/39/71/19/1125397119.db2.gz WCHZJMQDDGBQHU-GFCCVEGCSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)[C@H](C)c1ccco1 ZINC000069070384 1129420652 /nfs/dbraw/zinc/42/06/52/1129420652.db2.gz LRCPGGBATQZETI-CYBMUJFWSA-N 0 3 331.372 3.518 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000331280990 1129658848 /nfs/dbraw/zinc/65/88/48/1129658848.db2.gz UPNMSOQLMODUQD-GJZGRUSLSA-N 0 3 347.459 3.530 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCCN2CCC(C(F)(F)F)CC2)cc1 ZINC000174190439 1130340450 /nfs/dbraw/zinc/34/04/50/1130340450.db2.gz MJQLGBYFLXZFDN-UHFFFAOYSA-N 0 3 332.322 3.638 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@@H](N1CCCC(F)(F)[C@H](F)C1)CC2 ZINC001172905332 1131886067 /nfs/dbraw/zinc/88/60/67/1131886067.db2.gz RFKALELCSMBZLM-GOEBONIOSA-N 0 3 342.361 3.911 20 5 EHBDHN Cc1cc([C@@H]2CCCN2[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910416 1131916374 /nfs/dbraw/zinc/91/63/74/1131916374.db2.gz ZFIDFAGNRXRWQF-APWZRJJASA-N 0 3 341.411 3.976 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@@H]3CCC[C@H]3C2)c1F ZINC001173178276 1131991953 /nfs/dbraw/zinc/99/19/53/1131991953.db2.gz ACFXDYLKKMQTEN-IHRRRGAJSA-N 0 3 336.407 3.796 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(Br)o1 ZINC001173219330 1132003532 /nfs/dbraw/zinc/00/35/32/1132003532.db2.gz AXOVZLBDAVIZLS-SNVBAGLBSA-N 0 3 339.189 3.671 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CCOc2cc(F)cc(F)c21 ZINC001173220256 1132004564 /nfs/dbraw/zinc/00/45/64/1132004564.db2.gz WSXKNVDYUIYDLT-BZNIZROVSA-N 0 3 348.349 3.917 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(C)[C@@H](c2ccccc2)C1 ZINC001173227931 1132007687 /nfs/dbraw/zinc/00/76/87/1132007687.db2.gz SPMVACWSVHGVDQ-OXJNMPFZSA-N 0 3 339.439 3.515 20 5 EHBDHN CC(C)Oc1cccc(CN(C)CCOc2ccccc2[N+](=O)[O-])c1 ZINC001168884826 1132596599 /nfs/dbraw/zinc/59/65/99/1132596599.db2.gz GMPZKCRQYPZMPG-UHFFFAOYSA-N 0 3 344.411 3.893 20 5 EHBDHN COc1ccc(CN[C@@H](C)COc2c(C)cccc2C)cc1[N+](=O)[O-] ZINC001177463524 1133065280 /nfs/dbraw/zinc/06/52/80/1133065280.db2.gz BJORVFPWXUMRDR-HNNXBMFYSA-N 0 3 344.411 3.777 20 5 EHBDHN C[C@H]1CCC[C@H]1CNCc1c(Br)cccc1[N+](=O)[O-] ZINC001178558035 1133181223 /nfs/dbraw/zinc/18/12/23/1133181223.db2.gz WZZVXNVXEDJJGQ-QWRGUYRKSA-N 0 3 327.222 3.883 20 5 EHBDHN CCN(C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H](O)c1ccc(C)cc1 ZINC000769483385 1133289514 /nfs/dbraw/zinc/28/95/14/1133289514.db2.gz MNSYVIMCBYMZKI-LQOHYYORSA-N 0 3 340.423 3.972 20 5 EHBDHN C[C@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cc[nH]c(=O)c1 ZINC000788797044 1134170484 /nfs/dbraw/zinc/17/04/84/1134170484.db2.gz VHXRGADGBVOTAA-VIFPVBQESA-N 0 3 341.289 3.565 20 5 EHBDHN COc1ccc(C[C@H](C)N2C[C@H]3CC[C@@H](C2)C3(F)F)c([N+](=O)[O-])c1 ZINC001170335423 1134752414 /nfs/dbraw/zinc/75/24/14/1134752414.db2.gz NJLDVJRMBWOYMQ-FPMFFAJLSA-N 0 3 340.370 3.512 20 5 EHBDHN CC(C)(C)OC(=O)CC[C@@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC001195233619 1135389454 /nfs/dbraw/zinc/38/94/54/1135389454.db2.gz KDHWGDORZBMWJR-HNNXBMFYSA-N 0 3 348.443 3.929 20 5 EHBDHN C[NH+]1CCC(Oc2ccc(Nc3cc([O-])cc([N+](=O)[O-])c3)cc2)CC1 ZINC001201224425 1136000140 /nfs/dbraw/zinc/00/01/40/1136000140.db2.gz NLMVPWBHDPMWQT-UHFFFAOYSA-N 0 3 343.383 3.517 20 5 EHBDHN CCC(CC)[C@@H](O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811480732 1136097548 /nfs/dbraw/zinc/09/75/48/1136097548.db2.gz DMQQJJHVHFRMJQ-ZDUSSCGKSA-N 0 3 335.231 3.788 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C)C[C@H](O)c1ccccc1 ZINC000850442018 1136259242 /nfs/dbraw/zinc/25/92/42/1136259242.db2.gz JRAKJLXVSXCYGZ-GLJUWKHASA-N 0 3 344.411 3.766 20 5 EHBDHN CC(COC(=O)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1)[N+](=O)[O-] ZINC000813104019 1136288358 /nfs/dbraw/zinc/28/83/58/1136288358.db2.gz WHKYUKHIAJPRJF-UPJWGTAASA-N 0 3 346.408 3.555 20 5 EHBDHN CC(COC(=O)[C@H](Oc1ccc(Cl)cc1)c1ccccc1)[N+](=O)[O-] ZINC000813102524 1136288551 /nfs/dbraw/zinc/28/85/51/1136288551.db2.gz HQZDZEGUAXTKGC-BLLLJJGKSA-N 0 3 349.770 3.669 20 5 EHBDHN CC(COC(=O)c1ccc(O[C@H](C)c2ccccc2)cc1)[N+](=O)[O-] ZINC000813111975 1136294762 /nfs/dbraw/zinc/29/47/62/1136294762.db2.gz YHKJIXOYPKQLQU-ZIAGYGMSSA-N 0 3 329.352 3.649 20 5 EHBDHN Cc1cc(C(=O)OCC(C)[N+](=O)[O-])c(C)n1[C@@H](C)c1ccccc1 ZINC000813111318 1136294990 /nfs/dbraw/zinc/29/49/90/1136294990.db2.gz GLDHHZMRTIPRDT-KBPBESRZSA-N 0 3 330.384 3.536 20 5 EHBDHN CCc1nc(C)c([C@@H](C)N(C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585597 1136448392 /nfs/dbraw/zinc/44/83/92/1136448392.db2.gz XLQDYMPCSRELSD-IUODEOHRSA-N 0 3 349.456 3.649 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@H](C)[C@H]1NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000859830159 1137033611 /nfs/dbraw/zinc/03/36/11/1137033611.db2.gz NECOVKJHNUFIMG-NMSKTSORSA-N 0 3 333.215 3.803 20 5 EHBDHN C[C@@H](CSc1ccccc1)N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362091 1137215425 /nfs/dbraw/zinc/21/54/25/1137215425.db2.gz XSEZFLYHLCEVTM-KBXCAEBGSA-N 0 3 346.452 3.741 20 5 EHBDHN CC([C@@H](OC(=O)CSC(C)(C)C)c1ccccc1F)[N+](=O)[O-] ZINC000845872289 1137315863 /nfs/dbraw/zinc/31/58/63/1137315863.db2.gz GCGZBTGKVQIYSJ-IINYFYTJSA-N 0 3 329.393 3.607 20 5 EHBDHN COCc1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cc1 ZINC000845874181 1137316126 /nfs/dbraw/zinc/31/61/26/1137316126.db2.gz YARHHTROVQWPTO-SJCJKPOMSA-N 0 3 347.342 3.535 20 5 EHBDHN CCCCSCC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845873227 1137316305 /nfs/dbraw/zinc/31/63/05/1137316305.db2.gz CBJCNWNINJMKEJ-ABAIWWIYSA-N 0 3 329.393 3.609 20 5 EHBDHN CC(C)c1cccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845879649 1137316562 /nfs/dbraw/zinc/31/65/62/1137316562.db2.gz WBSZVSSFSBVCJZ-PXAZEXFGSA-N 0 3 346.358 3.907 20 5 EHBDHN CC([C@H](OC(=O)[C@H]1CCCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845883734 1137317234 /nfs/dbraw/zinc/31/72/34/1137317234.db2.gz VHQATZLYHNBWLQ-SUNKGSAMSA-N 0 3 345.317 3.901 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCC1SCCS1 ZINC000872087694 1137570653 /nfs/dbraw/zinc/57/06/53/1137570653.db2.gz GXFFXJBYJPQLIT-VIFPVBQESA-N 0 3 330.500 3.773 20 5 EHBDHN O=[N+]([O-])c1cccc(CNC[C@@H](O)c2c(Cl)cccc2Cl)c1 ZINC000124239760 1137583647 /nfs/dbraw/zinc/58/36/47/1137583647.db2.gz OUQGMTXYCZQJHC-CQSZACIVSA-N 0 3 341.194 3.725 20 5 EHBDHN Cc1ncc(CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000877115282 1137670480 /nfs/dbraw/zinc/67/04/80/1137670480.db2.gz KJTHCMNRFXCFHO-UHFFFAOYSA-N 0 3 345.346 3.711 20 5 EHBDHN CC(C)(C)CC(C)(C)NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878043961 1137700583 /nfs/dbraw/zinc/70/05/83/1137700583.db2.gz GLRAVLKGQKOFCT-UHFFFAOYSA-N 0 3 332.404 3.949 20 5 EHBDHN COC[C@H]1C[C@@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000883320094 1137854653 /nfs/dbraw/zinc/85/46/53/1137854653.db2.gz ARHPVMOLUINKSY-DKSSEZFCSA-N 0 3 326.396 3.699 20 5 EHBDHN O=[N+]([O-])c1cccc(Br)c1CNC[C@H]1CCCSC1 ZINC001202618677 1137887495 /nfs/dbraw/zinc/88/74/95/1137887495.db2.gz KYDDRIBJTCJNKP-SNVBAGLBSA-N 0 3 345.262 3.590 20 5 EHBDHN CCOCCCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113324349 1137912666 /nfs/dbraw/zinc/91/26/66/1137912666.db2.gz LIUVMVDPIXRRHS-UHFFFAOYSA-N 0 3 335.429 3.625 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCCC[C@H](C)C1 ZINC000187991362 1140279636 /nfs/dbraw/zinc/27/96/36/1140279636.db2.gz LJGJAQVSCLQIHB-STQMWFEESA-N 0 3 330.388 3.828 20 5 EHBDHN CC(=O)Nc1ccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192628792 1140541004 /nfs/dbraw/zinc/54/10/04/1140541004.db2.gz DVXOGHSAEZTIPQ-LJQANCHMSA-N 0 3 339.395 3.720 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000267441944 1140791952 /nfs/dbraw/zinc/79/19/52/1140791952.db2.gz IDZVVRPXWQOADD-GDBMZVCRSA-N 0 3 332.425 3.744 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CCCc3cn[nH]c32)o1 ZINC000268844529 1141006662 /nfs/dbraw/zinc/00/66/62/1141006662.db2.gz OJFSSHVTPVUQDJ-OAHLLOKOSA-N 0 3 338.367 3.745 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCCCC[C@@H]2c2ccco2)c1 ZINC000269633868 1141129643 /nfs/dbraw/zinc/12/96/43/1141129643.db2.gz GNBCBKDESGSINQ-IAGOWNOFSA-N 0 3 330.384 3.839 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN1CC[C@@H](c2ccc(F)cc2)C1 ZINC000430211395 1014992036 /nfs/dbraw/zinc/99/20/36/1014992036.db2.gz IXSFNSREXVINNZ-CQSZACIVSA-N 0 3 330.359 3.732 20 5 EHBDHN CCC[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCC1 ZINC000459803689 1032482051 /nfs/dbraw/zinc/48/20/51/1032482051.db2.gz NXAGBNWPQCQUQR-OAHLLOKOSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1cc(NC2CCN([C@H](C)c3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000092687372 1032813578 /nfs/dbraw/zinc/81/35/78/1032813578.db2.gz JTVYJOZBYRUZQC-OAHLLOKOSA-N 0 3 340.427 3.936 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCC1(c2ccccn2)CCC1 ZINC000894426062 1022270228 /nfs/dbraw/zinc/27/02/28/1022270228.db2.gz BFVZJXMBVQVDHH-UHFFFAOYSA-N 0 3 331.803 3.855 20 5 EHBDHN O=[N+]([O-])c1sc(CNC2CC3(CCC3)C2)cc1Br ZINC000602704807 1033092132 /nfs/dbraw/zinc/09/21/32/1033092132.db2.gz JTLPFIJEAPRTQN-UHFFFAOYSA-N 0 3 331.235 3.841 20 5 EHBDHN C[C@@H]1CN(C2CC2)C[C@@H]1Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000514176398 1024200284 /nfs/dbraw/zinc/20/02/84/1024200284.db2.gz PBOYEFHPLSBSDC-RNCFNFMXSA-N 0 3 329.322 3.508 20 5 EHBDHN Cc1ccc([C@H](C)NCCOCCOc2ccccc2)cc1[N+](=O)[O-] ZINC000538277013 1024279749 /nfs/dbraw/zinc/27/97/49/1024279749.db2.gz WUJGRVSMYGWRGH-INIZCTEOSA-N 0 3 344.411 3.649 20 5 EHBDHN C[C@@H](CNc1ccc(F)cc1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000521402551 1025371468 /nfs/dbraw/zinc/37/14/68/1025371468.db2.gz POBDRATUUDVHJT-ZDUSSCGKSA-N 0 3 329.375 3.593 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@H](c2ccn(C)n2)C1 ZINC000896493849 1025496785 /nfs/dbraw/zinc/49/67/85/1025496785.db2.gz WOBMZGKROULLQA-JMPLCFMRSA-N 0 3 340.427 3.611 20 5 EHBDHN C[C@H](NCc1ccccc1Cn1cccn1)c1ccc([N+](=O)[O-])cc1 ZINC000178640622 1026989294 /nfs/dbraw/zinc/98/92/94/1026989294.db2.gz WPWCMACWMDKNLB-HNNXBMFYSA-N 0 3 336.395 3.690 20 5 EHBDHN C[C@@H](NC(=O)OC(C)(C)C)[C@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000310435249 1027004767 /nfs/dbraw/zinc/00/47/67/1027004767.db2.gz OFOAGBQALWHMSP-XQQFMLRXSA-N 0 3 337.420 3.547 20 5 EHBDHN CCC[C@H](C)NC(=O)[C@@H]1CCCN([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000075676537 1027192627 /nfs/dbraw/zinc/19/26/27/1027192627.db2.gz AHCIWVCVONQCCL-HRCADAONSA-N 0 3 347.459 3.673 20 5 EHBDHN CN(Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCC(C)(C)CC1 ZINC000531781982 1027372412 /nfs/dbraw/zinc/37/24/12/1027372412.db2.gz FATXMAFVMVIFPF-UHFFFAOYSA-N 0 3 334.416 3.862 20 5 EHBDHN C[C@@H]1CCCC[C@H]1OCCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783597567 1027599921 /nfs/dbraw/zinc/59/99/21/1027599921.db2.gz TWHRJGOLANLOIW-MLGOLLRUSA-N 0 3 326.824 3.933 20 5 EHBDHN Cc1cnc(NC[C@H](c2cccs2)N2CCCC2)c([N+](=O)[O-])c1 ZINC000078625694 1028045084 /nfs/dbraw/zinc/04/50/84/1028045084.db2.gz NJUUNXDRHCJUGS-CQSZACIVSA-N 0 3 332.429 3.609 20 5 EHBDHN CCN(CC)Cc1ccc(C(=O)Oc2c(C)cccc2[N+](=O)[O-])o1 ZINC000760018467 1028268131 /nfs/dbraw/zinc/26/81/31/1028268131.db2.gz QQCWGVFNVQYFKJ-UHFFFAOYSA-N 0 3 332.356 3.557 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(CN(C)C)cc1F ZINC000421900054 1028916157 /nfs/dbraw/zinc/91/61/57/1028916157.db2.gz NKGMBDDMHKRLAP-UHFFFAOYSA-N 0 3 345.374 3.665 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](c1ccccc1)C1CC1 ZINC000192501293 1029714798 /nfs/dbraw/zinc/71/47/98/1029714798.db2.gz XUHDVFXPOZBDCB-LJQANCHMSA-N 0 3 339.395 3.583 20 5 EHBDHN CN(C)c1cccc([C@H]2CCCN2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000525271803 1029768299 /nfs/dbraw/zinc/76/82/99/1029768299.db2.gz RUVNFWYNTYLZFP-LJQANCHMSA-N 0 3 325.412 3.998 20 5 EHBDHN CN(C)C[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000583574590 1030169830 /nfs/dbraw/zinc/16/98/30/1030169830.db2.gz DPBUGARPYHYUIA-QZTJIDSGSA-N 0 3 343.402 3.614 20 5 EHBDHN COc1ccc(OCCN(C)[C@H](C)c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000441268172 1030212438 /nfs/dbraw/zinc/21/24/38/1030212438.db2.gz YADADBSJLUBKHC-CYBMUJFWSA-N 0 3 348.374 3.814 20 5 EHBDHN CC[C@H]1CCCC[C@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000163240033 1030218880 /nfs/dbraw/zinc/21/88/80/1030218880.db2.gz GKSFSNBNEKGUKY-SWLSCSKDSA-N 0 3 330.388 3.703 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CCC(c2ccc(O)cc2)CC1 ZINC000052468070 1030281225 /nfs/dbraw/zinc/28/12/25/1030281225.db2.gz GJPWHWJVWHFGMJ-UHFFFAOYSA-N 0 3 342.395 3.559 20 5 EHBDHN CC(C)c1ccc(CN[C@H]2CCO[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000343409855 1030740337 /nfs/dbraw/zinc/74/03/37/1030740337.db2.gz SVSCQPVYFFNTKP-HKUYNNGSSA-N 0 3 341.411 3.733 20 5 EHBDHN CC(C)c1ccc(CN[C@@H]2CCO[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000343409856 1030740557 /nfs/dbraw/zinc/74/05/57/1030740557.db2.gz SVSCQPVYFFNTKP-IEBWSBKVSA-N 0 3 341.411 3.733 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc1 ZINC000237998261 1030807321 /nfs/dbraw/zinc/80/73/21/1030807321.db2.gz RAYICCUTZMGKKD-IBGZPJMESA-N 0 3 340.379 3.607 20 5 EHBDHN CCc1cnc(CN[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000130425120 1031169822 /nfs/dbraw/zinc/16/98/22/1031169822.db2.gz RBRGPCFVHIFYJZ-HNNXBMFYSA-N 0 3 331.441 3.725 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)n1cc(CNC2CCCCC2)nn1 ZINC000603251667 1033476942 /nfs/dbraw/zinc/47/69/42/1033476942.db2.gz IYMYCJKJLPWSJA-CQSZACIVSA-N 0 3 343.431 3.526 20 5 EHBDHN C[C@@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCCCO1 ZINC000599044669 1033672042 /nfs/dbraw/zinc/67/20/42/1033672042.db2.gz RYDJUNZYWTUKPW-QMTHXVAHSA-N 0 3 332.322 3.661 20 5 EHBDHN COc1cccc([C@H](CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)OC)c1 ZINC000599061200 1033701602 /nfs/dbraw/zinc/70/16/02/1033701602.db2.gz LDFZZNHRJRCCIY-UGSOOPFHSA-N 0 3 330.384 3.642 20 5 EHBDHN Cc1noc(CNC2(Cc3ccccc3)CCCCC2)c1[N+](=O)[O-] ZINC000595438266 1033804059 /nfs/dbraw/zinc/80/40/59/1033804059.db2.gz FLIFXDBRGRDYCV-UHFFFAOYSA-N 0 3 329.400 3.926 20 5 EHBDHN Cc1noc(CN[C@H]2CCCC[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000595441563 1033805512 /nfs/dbraw/zinc/80/55/12/1033805512.db2.gz WTMIGHUIDWQKQX-HOTGVXAUSA-N 0 3 329.400 3.782 20 5 EHBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000595467663 1033821911 /nfs/dbraw/zinc/82/19/11/1033821911.db2.gz SPTZADJTEBLXAR-JFIYKMOQSA-N 0 3 336.407 3.640 20 5 EHBDHN CC1CCN([C@H](CNc2cccnc2[N+](=O)[O-])c2cccs2)CC1 ZINC000603839149 1033951828 /nfs/dbraw/zinc/95/18/28/1033951828.db2.gz YALBIQKYPHTVRO-OAHLLOKOSA-N 0 3 346.456 3.936 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@@H]1CC1(C)C ZINC000595909472 1034025245 /nfs/dbraw/zinc/02/52/45/1034025245.db2.gz OLRVGBRNXHMSRK-AAEUAGOBSA-N 0 3 330.388 3.684 20 5 EHBDHN Cc1noc(CS[C@@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596020527 1034060183 /nfs/dbraw/zinc/06/01/83/1034060183.db2.gz LFBZDOVVEUTLMM-OAHLLOKOSA-N 0 3 347.440 3.789 20 5 EHBDHN COc1cc(N[C@H]2CCN(C(C)(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596336136 1034178937 /nfs/dbraw/zinc/17/89/37/1034178937.db2.gz NAYWQKQIFSODNZ-JTQLQIEISA-N 0 3 327.812 3.542 20 5 EHBDHN Cc1cc(NCC2CCN(Cc3ccncc3)CC2)c([N+](=O)[O-])s1 ZINC000596436703 1034245226 /nfs/dbraw/zinc/24/52/26/1034245226.db2.gz OZQYKVCECASIDL-UHFFFAOYSA-N 0 3 346.456 3.684 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000604472614 1034386581 /nfs/dbraw/zinc/38/65/81/1034386581.db2.gz GXGSJZBOIVCUJQ-OAHLLOKOSA-N 0 3 331.441 3.980 20 5 EHBDHN Cc1ccnc(NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000078338233 1035526678 /nfs/dbraw/zinc/52/66/78/1035526678.db2.gz LUXLRCNWWDHECX-BBRMVZONSA-N 0 3 346.456 3.855 20 5 EHBDHN Cc1ccc(CN2CCCN(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000511478036 1035544753 /nfs/dbraw/zinc/54/47/53/1035544753.db2.gz NFDWQWZJDLYMBM-UHFFFAOYSA-N 0 3 325.412 3.616 20 5 EHBDHN CC(C)[C@H]1CCCC[C@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000460347102 1035927973 /nfs/dbraw/zinc/92/79/73/1035927973.db2.gz IKFXEFGSWKAAAK-HZPDHXFCSA-N 0 3 344.415 3.949 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCc2nccs2)c2ccccc2)c1 ZINC000180341589 1036698190 /nfs/dbraw/zinc/69/81/90/1036698190.db2.gz IZQYZRRDFVRULJ-SFHVURJKSA-N 0 3 339.420 3.973 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCc2cscn2)c2ccccc2)c1 ZINC000180790839 1037188942 /nfs/dbraw/zinc/18/89/42/1037188942.db2.gz ZDYAGHLFCHXPQP-GOSISDBHSA-N 0 3 339.420 3.973 20 5 EHBDHN CCC[C@@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000193042390 1037300213 /nfs/dbraw/zinc/30/02/13/1037300213.db2.gz VUUBRQOPDPFNOA-GOSISDBHSA-N 0 3 341.411 3.689 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC2(C[C@@H]1C)CCOCC2 ZINC000592181457 1037909383 /nfs/dbraw/zinc/90/93/83/1037909383.db2.gz DLFZCJVOKWRBFE-HNNXBMFYSA-N 0 3 348.443 3.773 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H](c1ccccc1)C1CC1 ZINC000540589773 1038117042 /nfs/dbraw/zinc/11/70/42/1038117042.db2.gz KHZTWIRIZCOFCT-IBGZPJMESA-N 0 3 339.395 3.583 20 5 EHBDHN COc1ccc(CNC/C(C)=C/c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000468654886 1038346704 /nfs/dbraw/zinc/34/67/04/1038346704.db2.gz CZUPLDULZXPQIB-NTEUORMPSA-N 0 3 342.395 3.805 20 5 EHBDHN Cc1ccc([C@H](C)NCCNC(=O)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000539088786 1038677341 /nfs/dbraw/zinc/67/73/41/1038677341.db2.gz ZIEZUOCBXLDHJY-HNNXBMFYSA-N 0 3 347.459 3.640 20 5 EHBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1F)[C@H]1Oc2ccccc2[C@@H]1C ZINC000478209355 1039290014 /nfs/dbraw/zinc/29/00/14/1039290014.db2.gz QJXRUOQAJHUSFM-PZROIBLQSA-N 0 3 330.359 3.777 20 5 EHBDHN CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000027284839 1040158529 /nfs/dbraw/zinc/15/85/29/1040158529.db2.gz OIRKKXQVLBCPMW-UHFFFAOYSA-N 0 3 339.823 3.841 20 5 EHBDHN CC(C)C[C@@H]1OCCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1Cl ZINC000479581128 1040402863 /nfs/dbraw/zinc/40/28/63/1040402863.db2.gz RGBALOZMLPGJPE-HOTGVXAUSA-N 0 3 326.824 3.932 20 5 EHBDHN COc1ccc(CNCc2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] ZINC000490775150 1040729535 /nfs/dbraw/zinc/72/95/35/1040729535.db2.gz WPPRTKIJNJCXHN-UHFFFAOYSA-N 0 3 326.396 3.772 20 5 EHBDHN CC1(C)CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCC[C@H]21 ZINC000555721020 1041042821 /nfs/dbraw/zinc/04/28/21/1041042821.db2.gz FJQLBDLEXLWSPX-CABCVRRESA-N 0 3 342.399 3.655 20 5 EHBDHN Cc1nc(C)c([C@H](C)N(C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000106874915 1041788462 /nfs/dbraw/zinc/78/84/62/1041788462.db2.gz MKILCEHEACYJLG-LBPRGKRZSA-N 0 3 335.429 3.740 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000107070110 1041813115 /nfs/dbraw/zinc/81/31/15/1041813115.db2.gz UVIVOMFVYMNLDJ-NWDGAFQWSA-N 0 3 347.802 3.926 20 5 EHBDHN Cc1c([C@@H](C)NCCC(=O)Nc2ccccc2)cccc1[N+](=O)[O-] ZINC000164986437 1042584804 /nfs/dbraw/zinc/58/48/04/1042584804.db2.gz FPLFIEVOEKAFII-CQSZACIVSA-N 0 3 327.384 3.583 20 5 EHBDHN CN(C)[C@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1ccsc1 ZINC000432328561 1042911561 /nfs/dbraw/zinc/91/15/61/1042911561.db2.gz KUTIHXSCQDXRSZ-MRXNPFEDSA-N 0 3 342.424 3.919 20 5 EHBDHN COCCNc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000343985120 1043062627 /nfs/dbraw/zinc/06/26/27/1043062627.db2.gz VQNCEPPAFHXXJF-AWEZNQCLSA-N 0 3 329.400 3.504 20 5 EHBDHN Cc1nn(CN(C)C[C@H](C)c2ccccc2)c2ccc([N+](=O)[O-])cc12 ZINC000764965542 1127559881 /nfs/dbraw/zinc/55/98/81/1127559881.db2.gz YBPJLEBKLLPBNC-AWEZNQCLSA-N 0 3 338.411 3.946 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000765844692 1128547406 /nfs/dbraw/zinc/54/74/06/1128547406.db2.gz HXFKTPKBPJGEMF-CVEARBPZSA-N 0 3 348.399 3.594 20 5 EHBDHN Cc1nc(NC[C@H](c2ccc(Cl)cc2)N(C)C)ccc1[N+](=O)[O-] ZINC000301633305 1128779875 /nfs/dbraw/zinc/77/98/75/1128779875.db2.gz DHDBCYHDJKPFOH-OAHLLOKOSA-N 0 3 334.807 3.666 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)C1Cc2ccccc2C1 ZINC000609193764 1120543067 /nfs/dbraw/zinc/54/30/67/1120543067.db2.gz CGCCVFXKRCZMAA-UHFFFAOYSA-N 0 3 340.423 3.981 20 5 EHBDHN C[C@H]1CC2(CCC2)CN1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000762145106 1121125388 /nfs/dbraw/zinc/12/53/88/1121125388.db2.gz SYHRRDHGJLWWOI-AWEZNQCLSA-N 0 3 326.400 3.680 20 5 EHBDHN CN(CCSc1nc2sccn2c1[N+](=O)[O-])Cc1ccccc1 ZINC000193744480 1121602779 /nfs/dbraw/zinc/60/27/79/1121602779.db2.gz LFBPDEOADSTHJV-UHFFFAOYSA-N 0 3 348.453 3.528 20 5 EHBDHN C[C@@H]1CCC[C@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180124 1121798151 /nfs/dbraw/zinc/79/81/51/1121798151.db2.gz GNNJYBDKEINUEP-DOMZBBRYSA-N 0 3 330.388 3.655 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@H](C)CSC)o2)c([N+](=O)[O-])c1 ZINC000130702847 1123255974 /nfs/dbraw/zinc/25/59/74/1123255974.db2.gz AEFPCGQUVHZHKG-LLVKDONJSA-N 0 3 336.413 3.705 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000327948569 1129539737 /nfs/dbraw/zinc/53/97/37/1129539737.db2.gz BLZQUFXLEHCQSE-KZNAEPCWSA-N 0 3 348.443 3.509 20 5 EHBDHN O=[N+]([O-])c1cc(CNCCc2nc(-c3ccccn3)cs2)cs1 ZINC000123936632 1129567232 /nfs/dbraw/zinc/56/72/32/1129567232.db2.gz LRHDTWNJPUOIGI-UHFFFAOYSA-N 0 3 346.437 3.507 20 5 EHBDHN O=[N+]([O-])c1ccc(F)cc1CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000281116682 1129703664 /nfs/dbraw/zinc/70/36/64/1129703664.db2.gz XFGUYLVWYCAWSQ-NXHRZFHOSA-N 0 3 336.407 3.640 20 5 EHBDHN Cc1cc(N[C@@H]2CCN(c3ccccn3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302092075 1129767765 /nfs/dbraw/zinc/76/77/65/1129767765.db2.gz QAAYOFWGKYLXGO-CQSZACIVSA-N 0 3 349.394 3.537 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H](CO)CC2CCCC2)o1 ZINC000509447826 1130649854 /nfs/dbraw/zinc/64/98/54/1130649854.db2.gz LGZREPFBIWEQNQ-OAHLLOKOSA-N 0 3 344.411 3.886 20 5 EHBDHN Cc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)c(CN(C)C)c1 ZINC000733750838 1131075903 /nfs/dbraw/zinc/07/59/03/1131075903.db2.gz CDKKFZOKKGFUGF-UHFFFAOYSA-N 0 3 344.440 3.774 20 5 EHBDHN C[C@@H]1CC(C)(C)C[C@](CO)(NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000740008104 1131516211 /nfs/dbraw/zinc/51/62/11/1131516211.db2.gz WSJLIYZEHPRLSQ-SJKOYZFVSA-N 0 3 340.851 3.915 20 5 EHBDHN CCCN(Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000740881779 1131552321 /nfs/dbraw/zinc/55/23/21/1131552321.db2.gz CWSQXBYFLXWXKI-OIISXLGYSA-N 0 3 336.407 3.759 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(C)[C@H](c2ccccc2)C1 ZINC001173227938 1132008143 /nfs/dbraw/zinc/00/81/43/1132008143.db2.gz SPMVACWSVHGVDQ-UZLBHIALSA-N 0 3 339.439 3.515 20 5 EHBDHN COC(=O)[C@@H]1CCCC[C@H]1CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860260 1132582979 /nfs/dbraw/zinc/58/29/79/1132582979.db2.gz VYKFJNJSGUQUPC-MAUKXSAKSA-N 0 3 346.427 3.539 20 5 EHBDHN CC(C)(C)c1ccc(N2CCCc3ccc(CN)nc32)c([N+](=O)[O-])c1 ZINC001169592457 1132791083 /nfs/dbraw/zinc/79/10/83/1132791083.db2.gz TXIDYTLVZJXAHF-UHFFFAOYSA-N 0 3 340.427 3.830 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@H](c3nc4c(s3)CCC4)C2)c1 ZINC001176234818 1132883549 /nfs/dbraw/zinc/88/35/49/1132883549.db2.gz IOYLJBAHHHHOKK-AWEZNQCLSA-N 0 3 343.452 3.920 20 5 EHBDHN CC[C@H](C)C[C@H](CO)NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001182519792 1133692409 /nfs/dbraw/zinc/69/24/09/1133692409.db2.gz BQHLDDXUVRMXNI-GXFFZTMASA-N 0 3 334.338 3.500 20 5 EHBDHN C[C@@H]1C[C@@H](c2ccccc2)CN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886607 1134099998 /nfs/dbraw/zinc/09/99/98/1134099998.db2.gz WGAZCGAXJHFDSH-CZUORRHYSA-N 0 3 341.367 3.881 20 5 EHBDHN C[C@@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cc[nH]c(=O)c1 ZINC000788797042 1134170357 /nfs/dbraw/zinc/17/03/57/1134170357.db2.gz VHXRGADGBVOTAA-SECBINFHSA-N 0 3 341.289 3.565 20 5 EHBDHN CC(C)C[C@H]1OCCC[C@H]1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000775371661 1134675127 /nfs/dbraw/zinc/67/51/27/1134675127.db2.gz OUNKCLWCLPPAAA-HZPDHXFCSA-N 0 3 326.824 3.932 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170328776 1134749459 /nfs/dbraw/zinc/74/94/59/1134749459.db2.gz MHWFYAAUODDHSD-GFCCVEGCSA-N 0 3 328.359 3.656 20 5 EHBDHN CCCCC[C@@H]1CCCCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001196329083 1135546144 /nfs/dbraw/zinc/54/61/44/1135546144.db2.gz KZTXKRFUMCOYPX-MRXNPFEDSA-N 0 3 333.432 3.629 20 5 EHBDHN CCC[C@H](N[C@@H]1COc2ccccc2[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000808728427 1135723636 /nfs/dbraw/zinc/72/36/36/1135723636.db2.gz DUCARYJTAXLGNT-SCTDSRPQSA-N 0 3 342.395 3.520 20 5 EHBDHN COCc1c(C)cc(C)c(CNCc2ccc([N+](=O)[O-])cc2)c1C ZINC001199580810 1135912485 /nfs/dbraw/zinc/91/24/85/1135912485.db2.gz ATJWORDHPABUOP-UHFFFAOYSA-N 0 3 328.412 3.956 20 5 EHBDHN CN1CC[C@@H](NCc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000810006294 1135912890 /nfs/dbraw/zinc/91/28/90/1135912890.db2.gz IONOOZLGSUXEGB-SJLPKXTDSA-N 0 3 345.830 3.783 20 5 EHBDHN C[C@]1(CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCCC[C@H]1O ZINC000811483108 1136091286 /nfs/dbraw/zinc/09/12/86/1136091286.db2.gz BWNCBPXZKNGYLH-UKRRQHHQSA-N 0 3 347.242 3.932 20 5 EHBDHN CCC[C@H](CCO)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811481854 1136091484 /nfs/dbraw/zinc/09/14/84/1136091484.db2.gz OMPYTPXBSUOJET-SNVBAGLBSA-N 0 3 335.231 3.790 20 5 EHBDHN Cc1c(F)cc([N+](=O)[O-])cc1-n1c(-c2ccccc2)cnc1[C@H](C)N ZINC001170687052 1136248626 /nfs/dbraw/zinc/24/86/26/1136248626.db2.gz BXMRXRGEOOWEAD-LBPRGKRZSA-N 0 3 340.358 3.915 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H]1COc2ccccc2C1 ZINC000850428998 1136257085 /nfs/dbraw/zinc/25/70/85/1136257085.db2.gz WNHDYTVWHTWLRC-KGLIPLIRSA-N 0 3 342.395 3.505 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C)[C@@](C)(O)c1ccccc1 ZINC000850477245 1136266973 /nfs/dbraw/zinc/26/69/73/1136266973.db2.gz RVHFBJJGKQXJLT-CKFHNAJUSA-N 0 3 344.411 3.550 20 5 EHBDHN CC(C)Oc1ccccc1[C@@H](C)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776606606 1136470558 /nfs/dbraw/zinc/47/05/58/1136470558.db2.gz YJSCDWIOZNNSBX-KDOFPFPSSA-N 0 3 344.411 3.766 20 5 EHBDHN Cc1nn(CN2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000776774781 1136661286 /nfs/dbraw/zinc/66/12/86/1136661286.db2.gz OKJBUSBDADPSKT-KSZLIROESA-N 0 3 340.427 3.715 20 5 EHBDHN CC([C@H](OC(=O)c1ccc(C(F)F)o1)c1ccccc1F)[N+](=O)[O-] ZINC000860854805 1137081362 /nfs/dbraw/zinc/08/13/62/1137081362.db2.gz JQLLRYYMKPDYIM-OQPBUACISA-N 0 3 343.257 3.920 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCC[C@@H]3CCSC3)cs2)c1 ZINC000865654739 1137302223 /nfs/dbraw/zinc/30/22/23/1137302223.db2.gz UHTGBNQOPOAPKW-GFCCVEGCSA-N 0 3 349.481 3.951 20 5 EHBDHN CC([C@H](OC(=O)c1ccoc1C1CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845882990 1137316978 /nfs/dbraw/zinc/31/69/78/1137316978.db2.gz QQGQHAZTJWZXBG-BONVTDFDSA-N 0 3 333.315 3.859 20 5 EHBDHN Cc1oc(C2CC2)nc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845883772 1137317160 /nfs/dbraw/zinc/31/71/60/1137317160.db2.gz VXEFJGPQQUKXHM-VFZGTOFNSA-N 0 3 348.330 3.563 20 5 EHBDHN CCCC[C@@](CC)(Nc1cc2c(cc1[N+](=O)[O-])CNC2)C(=O)OCC ZINC001171230864 1137355107 /nfs/dbraw/zinc/35/51/07/1137355107.db2.gz IGHOSZCHNXZSHN-GOSISDBHSA-N 0 3 349.431 3.512 20 5 EHBDHN C[C@H](N[C@@H](C)c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000121153820 1137369701 /nfs/dbraw/zinc/36/97/01/1137369701.db2.gz KQFUHCNSZZNGOJ-RYUDHWBXSA-N 0 3 347.802 3.926 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](O)c1ccccc1 ZINC000872015991 1137564631 /nfs/dbraw/zinc/56/46/31/1137564631.db2.gz AXVJNURBWLPKFO-LRDDRELGSA-N 0 3 332.425 3.701 20 5 EHBDHN Cc1ccc([C@H](C)NC[C@@H](O)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000124746817 1137608324 /nfs/dbraw/zinc/60/83/24/1137608324.db2.gz HJDYQJLKPRJTHQ-APPDUMDISA-N 0 3 336.338 3.566 20 5 EHBDHN C[C@@H]1CCC[C@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966239 1137697362 /nfs/dbraw/zinc/69/73/62/1137697362.db2.gz DXQYDBVYFMXNAO-OLZOCXBDSA-N 0 3 330.388 3.655 20 5 EHBDHN CCC(CC)N(Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000878037398 1137700237 /nfs/dbraw/zinc/70/02/37/1137700237.db2.gz UIMRGSUBAONDNI-UHFFFAOYSA-N 0 3 330.388 3.798 20 5 EHBDHN CC(C)[C@@H]1CCCC[C@@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878419435 1137715044 /nfs/dbraw/zinc/71/50/44/1137715044.db2.gz FDTGRPKWLDKNLW-ZFWWWQNUSA-N 0 3 344.415 3.949 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC[C@@H](C)C1 ZINC000878691191 1137725277 /nfs/dbraw/zinc/72/52/77/1137725277.db2.gz LCACKYPKEMQJTG-RDBSUJKOSA-N 0 3 344.415 3.949 20 5 EHBDHN CO[C@@]1(C)CCCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000332208718 1137935808 /nfs/dbraw/zinc/93/58/08/1137935808.db2.gz FRHQGQKCWPCWQJ-SFHVURJKSA-N 0 3 336.432 3.773 20 5 EHBDHN CCC[C@H](NCc1ccc(CO)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000178564082 1139704523 /nfs/dbraw/zinc/70/45/23/1139704523.db2.gz RKPLBUGCWWTDTD-SFHVURJKSA-N 0 3 332.375 3.857 20 5 EHBDHN Cc1cnn([C@H]2CCCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000182760509 1139990886 /nfs/dbraw/zinc/99/08/86/1139990886.db2.gz CXSDBPBANURGEM-WBVHZDCISA-N 0 3 328.416 3.806 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c1 ZINC000270376851 1141214704 /nfs/dbraw/zinc/21/47/04/1141214704.db2.gz LZTYQTHQKXRLEM-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H]1Cc1ccc(F)cc1 ZINC001167122481 1016177267 /nfs/dbraw/zinc/17/72/67/1016177267.db2.gz IPOXKASFUYCFFY-QGZVFWFLSA-N 0 3 344.386 3.950 20 5 EHBDHN COc1cccc2c1C[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000459693042 1032417978 /nfs/dbraw/zinc/41/79/78/1032417978.db2.gz HFPIKBIHEJWGSF-ZDUSSCGKSA-N 0 3 332.787 3.514 20 5 EHBDHN CC(C)(C)n1cc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449501158 1032680661 /nfs/dbraw/zinc/68/06/61/1032680661.db2.gz PARZJEHSTJVMKI-KRWDZBQOSA-N 0 3 342.443 3.926 20 5 EHBDHN C[C@H]1CCN(c2ccsc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000610284381 1017656060 /nfs/dbraw/zinc/65/60/60/1017656060.db2.gz QGTQGPAUBOPQOQ-AWEZNQCLSA-N 0 3 331.441 3.757 20 5 EHBDHN C[C@@H](NCc1ccccc1Cn1cccn1)c1cccc([N+](=O)[O-])c1 ZINC000120188337 1017996395 /nfs/dbraw/zinc/99/63/95/1017996395.db2.gz YPSVTCXAMCSWNU-OAHLLOKOSA-N 0 3 336.395 3.690 20 5 EHBDHN C[C@@]1(CNc2ncc([N+](=O)[O-])s2)CCCN1Cc1ccccc1 ZINC000336943108 1018007094 /nfs/dbraw/zinc/00/70/94/1018007094.db2.gz ZYFIVQNCDMLZCD-INIZCTEOSA-N 0 3 332.429 3.518 20 5 EHBDHN CN(C)Cc1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000110210905 1018357461 /nfs/dbraw/zinc/35/74/61/1018357461.db2.gz OVLPYNHUZJJMEG-UHFFFAOYSA-N 0 3 333.775 3.562 20 5 EHBDHN CC[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000594017504 1032788380 /nfs/dbraw/zinc/78/83/80/1032788380.db2.gz GLUILJNWCSXNHH-OAHLLOKOSA-N 0 3 345.374 3.803 20 5 EHBDHN CCC[C@@H](C)N(C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000048070681 1020058900 /nfs/dbraw/zinc/05/89/00/1020058900.db2.gz NERQALGUEKEALP-SNVBAGLBSA-N 0 3 332.347 3.825 20 5 EHBDHN CO[C@@H]1CCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602601389 1032995775 /nfs/dbraw/zinc/99/57/75/1032995775.db2.gz KSACGIJXUOUYTI-CYBMUJFWSA-N 0 3 332.322 3.615 20 5 EHBDHN CC(C)(C)c1ccc(C(=O)Nc2ccc3c(c2)CNC3)cc1[N+](=O)[O-] ZINC000449667199 1033005970 /nfs/dbraw/zinc/00/59/70/1033005970.db2.gz QSERCOBORVLXDY-UHFFFAOYSA-N 0 3 339.395 3.748 20 5 EHBDHN CC(C)(C)C[C@H]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000449769839 1033182975 /nfs/dbraw/zinc/18/29/75/1033182975.db2.gz COYCVBHBQCCXKR-CYBMUJFWSA-N 0 3 334.416 3.719 20 5 EHBDHN Cc1cccc(C)c1[C@@H](C)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000544893819 1024501129 /nfs/dbraw/zinc/50/11/29/1024501129.db2.gz MUWINFAPGHEBSM-CABCVRRESA-N 0 3 341.411 3.889 20 5 EHBDHN Cc1c(CN(C)CCCOc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000520784024 1024770352 /nfs/dbraw/zinc/77/03/52/1024770352.db2.gz JTRWYUBSGZZAOA-UHFFFAOYSA-N 0 3 332.375 3.943 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CN(C)C)cc2F)c1C ZINC000897972536 1033248809 /nfs/dbraw/zinc/24/88/09/1033248809.db2.gz RLNPEBIRQHXNDS-UHFFFAOYSA-N 0 3 345.374 3.665 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1ccccc1Cn1ccnc1 ZINC000574530522 1033274384 /nfs/dbraw/zinc/27/43/84/1033274384.db2.gz BORYFPCPGXLAQG-LJQANCHMSA-N 0 3 348.406 3.617 20 5 EHBDHN O=[N+]([O-])c1ccc(N2CCN(C3CCCC3)CC2)c(C(F)(F)F)c1 ZINC000108930959 1026119557 /nfs/dbraw/zinc/11/95/57/1026119557.db2.gz IGKBBLFYFWPXEM-UHFFFAOYSA-N 0 3 343.349 3.678 20 5 EHBDHN Cc1cc(-c2nc(-c3ccc(CN(C)C)cc3)no2)ccc1[N+](=O)[O-] ZINC000530872375 1026373937 /nfs/dbraw/zinc/37/39/37/1026373937.db2.gz OVHRPKJDBJQBCB-UHFFFAOYSA-N 0 3 338.367 3.682 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(CCCO)[C@H]2CCCc3ccccc32)c1 ZINC000531164424 1026639138 /nfs/dbraw/zinc/63/91/38/1026639138.db2.gz NZMKIVXXADUGGY-FQEVSTJZSA-N 0 3 340.423 3.857 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN[C@H](CC(F)F)c2ccccc2)c1 ZINC000421000854 1027980311 /nfs/dbraw/zinc/98/03/11/1027980311.db2.gz WOCSYYYPPLEVJL-MRXNPFEDSA-N 0 3 336.338 3.960 20 5 EHBDHN COCc1ccccc1/C=C(/C)CNCc1ccccc1[N+](=O)[O-] ZINC000509972475 1028137894 /nfs/dbraw/zinc/13/78/94/1028137894.db2.gz QLTNZFGCNJJCSO-PTNGSMBKSA-N 0 3 326.396 3.934 20 5 EHBDHN C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cnn(C)c1 ZINC000525183403 1029733064 /nfs/dbraw/zinc/73/30/64/1029733064.db2.gz IQFGEVVGWBAJGD-LBPRGKRZSA-N 0 3 342.424 3.908 20 5 EHBDHN Cc1ccc(C2CC(NCc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)cc1 ZINC000446829631 1029813422 /nfs/dbraw/zinc/81/34/22/1029813422.db2.gz JZGQICMPBLRQSN-UHFFFAOYSA-N 0 3 336.395 3.815 20 5 EHBDHN CC[C@@H](C)N[C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000343272894 1030039162 /nfs/dbraw/zinc/03/91/62/1030039162.db2.gz VXJHWFBFDQRZTJ-MFKMUULPSA-N 0 3 338.795 3.778 20 5 EHBDHN CC(=O)Nc1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000531941470 1030109859 /nfs/dbraw/zinc/10/98/59/1030109859.db2.gz OPSREFARAYTPFC-CYBMUJFWSA-N 0 3 327.384 3.712 20 5 EHBDHN C[C@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000159865112 1030399540 /nfs/dbraw/zinc/39/95/40/1030399540.db2.gz LXZZZZREEDBHIW-KBPBESRZSA-N 0 3 337.383 3.587 20 5 EHBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])NCc1noc2ccccc21 ZINC000520428109 1030499692 /nfs/dbraw/zinc/49/96/92/1030499692.db2.gz KXXGAQUGLQZWQR-CYBMUJFWSA-N 0 3 325.368 3.847 20 5 EHBDHN CC[C@@H](C)CN(CC)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000482881636 1030787795 /nfs/dbraw/zinc/78/77/95/1030787795.db2.gz DQYMNIKSRBDWAP-LLVKDONJSA-N 0 3 327.812 3.555 20 5 EHBDHN C[C@@H](NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cn2ccccc2n1 ZINC000550918196 1030799221 /nfs/dbraw/zinc/79/92/21/1030799221.db2.gz YYWTXKXHCWOUNJ-GFCCVEGCSA-N 0 3 344.802 3.789 20 5 EHBDHN C[C@@H]1[C@H](NC(=O)c2cc3ccccc3c3cccnc23)CCCN1C ZINC000343436000 1030868071 /nfs/dbraw/zinc/86/80/71/1030868071.db2.gz LJGSGCBFLROKBB-AUUYWEPGSA-N 0 3 333.435 3.601 20 5 EHBDHN CC(C)C[C@]1(CO)CCCN1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000475721012 1031529971 /nfs/dbraw/zinc/52/99/71/1031529971.db2.gz ZQTCPRFYHHFFOQ-INIZCTEOSA-N 0 3 326.824 3.621 20 5 EHBDHN CCN(CCc1cccs1)Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761289203 1033500108 /nfs/dbraw/zinc/50/01/08/1033500108.db2.gz DHUDKSQQBDRODN-UHFFFAOYSA-N 0 3 344.440 3.837 20 5 EHBDHN C[C@@H](NCc1ccc(O[C@@H]2CCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000594923929 1033546513 /nfs/dbraw/zinc/54/65/13/1033546513.db2.gz HADRBSBWYULAQS-AUUYWEPGSA-N 0 3 342.395 3.613 20 5 EHBDHN COC[C@@H](C)Oc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000594925205 1033547045 /nfs/dbraw/zinc/54/70/45/1033547045.db2.gz MQHKISIOULAGEG-CABCVRRESA-N 0 3 344.411 3.859 20 5 EHBDHN COc1cccc([C@H](CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)OC)c1 ZINC000599061970 1033701132 /nfs/dbraw/zinc/70/11/32/1033701132.db2.gz MXIKLEZSXSQVJS-KUHUBIRLSA-N 0 3 344.411 3.950 20 5 EHBDHN Cc1noc(CN[C@@H]2CCCC[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000595441567 1033805394 /nfs/dbraw/zinc/80/53/94/1033805394.db2.gz WTMIGHUIDWQKQX-JKSUJKDBSA-N 0 3 329.400 3.782 20 5 EHBDHN Cc1nccc([C@H]2CCCN([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834320 1033958886 /nfs/dbraw/zinc/95/88/86/1033958886.db2.gz QNUWPUOEJHIVET-CJNGLKHVSA-N 0 3 326.400 3.634 20 5 EHBDHN C[C@@H]1CCCC[N@@H+]1Cc1ccc(Nc2cc[n-]c(=O)c2[N+](=O)[O-])cc1 ZINC000596080909 1034073563 /nfs/dbraw/zinc/07/35/63/1034073563.db2.gz PMGOPXZSZYGHPK-CYBMUJFWSA-N 0 3 342.399 3.813 20 5 EHBDHN C[C@@H]1CCCC[N@H+]1Cc1ccc(Nc2cc[n-]c(=O)c2[N+](=O)[O-])cc1 ZINC000596080909 1034073569 /nfs/dbraw/zinc/07/35/69/1034073569.db2.gz PMGOPXZSZYGHPK-CYBMUJFWSA-N 0 3 342.399 3.813 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@@H]3CCC=CO3)o2)c([N+](=O)[O-])c1 ZINC000780569754 1034125121 /nfs/dbraw/zinc/12/51/21/1034125121.db2.gz IQMCQQBATOEFGP-AWEZNQCLSA-N 0 3 344.367 3.646 20 5 EHBDHN C[C@@H](NC(=O)[C@H]1CCCCN1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413041 1034298965 /nfs/dbraw/zinc/29/89/65/1034298965.db2.gz SKMDWINSCADWGZ-RDTXWAMCSA-N 0 3 345.443 3.569 20 5 EHBDHN CCOC1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000179500357 1034340036 /nfs/dbraw/zinc/34/00/36/1034340036.db2.gz GHRUXTXVDAALGI-UHFFFAOYSA-N 0 3 330.384 3.856 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CCC[C@H]1c1ccc(O)cc1 ZINC000604484499 1034387758 /nfs/dbraw/zinc/38/77/58/1034387758.db2.gz XTIZHPBZDJBEGL-INIZCTEOSA-N 0 3 328.368 3.516 20 5 EHBDHN CCOc1cc(CN2CCC[C@]3(CCSC3)C2)ccc1[N+](=O)[O-] ZINC000451961646 1034634098 /nfs/dbraw/zinc/63/40/98/1034634098.db2.gz DUUZEKKEGVTDSL-KRWDZBQOSA-N 0 3 336.457 3.713 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](N[C@@H]2C[C@@H]3OCCC[C@@H]23)c2ccccc2)c1 ZINC000251436082 1034646751 /nfs/dbraw/zinc/64/67/51/1034646751.db2.gz AVFBLVKAOMQSFP-ZGXWSNOMSA-N 0 3 338.407 3.841 20 5 EHBDHN Cc1ccnc(NC[C@H]2CCCN(C)[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000078338235 1035523761 /nfs/dbraw/zinc/52/37/61/1035523761.db2.gz LUXLRCNWWDHECX-CJNGLKHVSA-N 0 3 346.456 3.855 20 5 EHBDHN CC(=O)c1cc(N[C@H](C)[C@H](c2ccccc2)N(C)C)ccc1[N+](=O)[O-] ZINC000572898100 1036531880 /nfs/dbraw/zinc/53/18/80/1036531880.db2.gz LFBMXHPQLLNHKW-BFUOFWGJSA-N 0 3 341.411 3.901 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCc2ccncc2)c2ccccc2)c1 ZINC000493074924 1036640771 /nfs/dbraw/zinc/64/07/71/1036640771.db2.gz AJDAXAIHVORJBE-HXUWFJFHSA-N 0 3 333.391 3.912 20 5 EHBDHN CC[C@@H](O)CN(C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850729 1037280791 /nfs/dbraw/zinc/28/07/91/1037280791.db2.gz OVBWTWHPUMFJCJ-YRVHBARZSA-N 0 3 340.423 3.881 20 5 EHBDHN CC(C)N(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCOC1 ZINC000462879861 1037510060 /nfs/dbraw/zinc/51/00/60/1037510060.db2.gz ZXISFSIMGZXSBO-AWEZNQCLSA-N 0 3 330.384 3.854 20 5 EHBDHN CC[C@@H](O)CCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494004002 1037766825 /nfs/dbraw/zinc/76/68/25/1037766825.db2.gz NJAOAEYCPAZWEV-RTBURBONSA-N 0 3 328.412 3.825 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H](c2ccccc2)C2(CO)CC=CC2)cc1 ZINC000592175284 1037916404 /nfs/dbraw/zinc/91/64/04/1037916404.db2.gz KDBSMQFLKZABBM-IBGZPJMESA-N 0 3 338.407 3.754 20 5 EHBDHN CC[C@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCCO1 ZINC000467553706 1038365032 /nfs/dbraw/zinc/36/50/32/1038365032.db2.gz KHEJSCKKFSNPGU-INIZCTEOSA-N 0 3 330.384 3.856 20 5 EHBDHN Cc1ccc([C@@H](C)NC(=O)[C@H](C(C)C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000488052307 1038809579 /nfs/dbraw/zinc/80/95/79/1038809579.db2.gz CAAVDNCDDZIRIV-QAPCUYQASA-N 0 3 347.459 3.591 20 5 EHBDHN COc1cccc(C2=CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000479929175 1038906667 /nfs/dbraw/zinc/90/66/67/1038906667.db2.gz UKROUWJSVBBEET-UHFFFAOYSA-N 0 3 338.407 3.935 20 5 EHBDHN C[C@H](C[C@@H](O)c1cccs1)NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893268736 1038910829 /nfs/dbraw/zinc/91/08/29/1038910829.db2.gz YMZXDHSOBBCZGY-QMTHXVAHSA-N 0 3 340.832 3.912 20 5 EHBDHN CN(C)[C@@H]1CCOc2c(Nc3ncc(Cl)cc3[N+](=O)[O-])cccc21 ZINC000432927120 1040195493 /nfs/dbraw/zinc/19/54/93/1040195493.db2.gz GASUSMYISVCPIF-CYBMUJFWSA-N 0 3 348.790 3.772 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])c(Nc2cccc3c2OCC[C@@H]3N(C)C)n1 ZINC000432926895 1040196414 /nfs/dbraw/zinc/19/64/14/1040196414.db2.gz DRGIWJWHWCUESW-HNNXBMFYSA-N 0 3 342.399 3.735 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CCC[C@@H](Nc2ccccc2)C1 ZINC000490064887 1040330215 /nfs/dbraw/zinc/33/02/15/1040330215.db2.gz IWGNVUAITJYTMZ-QGZVFWFLSA-N 0 3 341.411 3.550 20 5 EHBDHN COc1cccc(C2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000479578216 1040401286 /nfs/dbraw/zinc/40/12/86/1040401286.db2.gz LHECTNYAYGBTRR-UHFFFAOYSA-N 0 3 326.396 3.983 20 5 EHBDHN CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCCC[C@@H]1O ZINC000555420387 1040556885 /nfs/dbraw/zinc/55/68/85/1040556885.db2.gz GXVWRWVKWOIUED-NHYWBVRUSA-N 0 3 346.349 3.597 20 5 EHBDHN O=[N+]([O-])c1ccc(S[C@H]2CCCN(Cc3ccccc3)C2)cn1 ZINC000425289225 1041098113 /nfs/dbraw/zinc/09/81/13/1041098113.db2.gz ZCYUOCBMWBBVOP-INIZCTEOSA-N 0 3 329.425 3.747 20 5 EHBDHN Cc1cc(C)cc([C@@H](C)N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000107072393 1041815095 /nfs/dbraw/zinc/81/50/95/1041815095.db2.gz BZGFPRFSLOUBKH-HUUCEWRRSA-N 0 3 341.411 3.889 20 5 EHBDHN C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2ccnn2)cc1 ZINC000090879385 1127081978 /nfs/dbraw/zinc/08/19/78/1127081978.db2.gz MQYGOFPBLUKSJB-ZIAGYGMSSA-N 0 3 337.383 3.587 20 5 EHBDHN Cc1oc(C(C)(C)C)cc1CNCCOc1ccc([N+](=O)[O-])cc1 ZINC001649111728 1128290087 /nfs/dbraw/zinc/29/00/87/1128290087.db2.gz BBJVTTDVVXWQAQ-UHFFFAOYSA-N 0 3 332.400 3.962 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCNCc2cc3cc(Cl)cnc3o2)cc1 ZINC001649111932 1128291113 /nfs/dbraw/zinc/29/11/13/1128291113.db2.gz GKMCIWWILJAAPI-UHFFFAOYSA-N 0 3 347.758 3.558 20 5 EHBDHN COc1cc(NC[C@@H](c2cccs2)N(C)C)c([N+](=O)[O-])cc1F ZINC000301623145 1128763705 /nfs/dbraw/zinc/76/37/05/1128763705.db2.gz OMXJVYJYVSEULO-ZDUSSCGKSA-N 0 3 339.392 3.519 20 5 EHBDHN CCCn1c2ccccc2nc1CNCCc1ccc([N+](=O)[O-])cc1 ZINC000194416369 1121884329 /nfs/dbraw/zinc/88/43/29/1121884329.db2.gz WXBLOVDAFIGOGK-UHFFFAOYSA-N 0 3 338.411 3.687 20 5 EHBDHN Cc1cccc(NC(=O)C[C@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000556162143 1122849974 /nfs/dbraw/zinc/84/99/74/1122849974.db2.gz IOYLJKHELNBHNU-GJZGRUSLSA-N 0 3 341.411 3.971 20 5 EHBDHN CCN(CC)[C@H](CNc1ncc([N+](=O)[O-])s1)c1ccsc1 ZINC000195508676 1123494642 /nfs/dbraw/zinc/49/46/42/1123494642.db2.gz MNOLYUWELUCEJI-LLVKDONJSA-N 0 3 326.447 3.608 20 5 EHBDHN Cc1cc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n[nH]1 ZINC000610009929 1123712652 /nfs/dbraw/zinc/71/26/52/1123712652.db2.gz FPFLLYXVXVFQRQ-UHFFFAOYSA-N 0 3 328.397 3.645 20 5 EHBDHN C[C@H](C(=O)Nc1cccc(CN(C)C)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182644333 1125348824 /nfs/dbraw/zinc/34/88/24/1125348824.db2.gz CLHKKHHYGPSZDA-LBPRGKRZSA-N 0 3 345.374 3.538 20 5 EHBDHN CCOc1ccc([C@@H](C)NCCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000154108370 1129533001 /nfs/dbraw/zinc/53/30/01/1129533001.db2.gz UWYIQTSPHZSTGJ-OAHLLOKOSA-N 0 3 344.411 3.861 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000327948564 1129539709 /nfs/dbraw/zinc/53/97/09/1129539709.db2.gz BLZQUFXLEHCQSE-KSZLIROESA-N 0 3 348.443 3.509 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000327948567 1129539947 /nfs/dbraw/zinc/53/99/47/1129539947.db2.gz BLZQUFXLEHCQSE-KURKYZTESA-N 0 3 348.443 3.509 20 5 EHBDHN COc1cc(CN2CC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000155064392 1129610232 /nfs/dbraw/zinc/61/02/32/1129610232.db2.gz DKXCNFMJRDSZBC-OAHLLOKOSA-N 0 3 342.395 3.602 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@H](C)c2ccc(C)cn2)c1F ZINC001173187670 1131993748 /nfs/dbraw/zinc/99/37/48/1131993748.db2.gz FFDZESAXMUPUPD-QWHCGFSZSA-N 0 3 347.390 3.728 20 5 EHBDHN O=[N+]([O-])C[C@H]1CC[C@@H](N2CCc3cccc(C(F)(F)F)c3C2)C1 ZINC001169039025 1132638629 /nfs/dbraw/zinc/63/86/29/1132638629.db2.gz MPANHCCZJQYBLO-WCQYABFASA-N 0 3 328.334 3.509 20 5 EHBDHN CCCCN(CCn1c(C)ncc1[N+](=O)[O-])Cc1c(C)oc(C)c1C ZINC001176365773 1132923563 /nfs/dbraw/zinc/92/35/63/1132923563.db2.gz VFEUOZOWQBZBID-UHFFFAOYSA-N 0 3 348.447 3.920 20 5 EHBDHN COc1cc(C[NH2+]CCc2ccc(C(C)C)cc2)c([N+](=O)[O-])cc1[O-] ZINC001177117053 1133029148 /nfs/dbraw/zinc/02/91/48/1133029148.db2.gz GSENDUDBNCDRNC-UHFFFAOYSA-N 0 3 344.411 3.765 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H](C)c1ccc(NC(N)=O)cc1 ZINC001177803794 1133104493 /nfs/dbraw/zinc/10/44/93/1133104493.db2.gz GZXAZIIKMPMXRO-ZDUSSCGKSA-N 0 3 342.399 3.553 20 5 EHBDHN COc1c([O-])ccc(C[N@@H+]2CC[C@H](C3CCCCC3)C2)c1[N+](=O)[O-] ZINC001182771590 1133732055 /nfs/dbraw/zinc/73/20/55/1133732055.db2.gz AUELQTBUZBAGRF-AWEZNQCLSA-N 0 3 334.416 3.711 20 5 EHBDHN COc1c([O-])ccc(C[N@H+]2CC[C@H](C3CCCCC3)C2)c1[N+](=O)[O-] ZINC001182771590 1133732060 /nfs/dbraw/zinc/73/20/60/1133732060.db2.gz AUELQTBUZBAGRF-AWEZNQCLSA-N 0 3 334.416 3.711 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1ccccc1[N+](=O)[O-] ZINC000786811115 1133909270 /nfs/dbraw/zinc/90/92/70/1133909270.db2.gz IVWCLOOLGHFLLF-LCYFTJDESA-N 0 3 327.340 3.696 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@H]1CCCc2nc(C)ncc21 ZINC000786810890 1133909752 /nfs/dbraw/zinc/90/97/52/1133909752.db2.gz BPVIFJGZFDXWCO-FUNAXGEOSA-N 0 3 338.411 3.764 20 5 EHBDHN CC1(C)C[C@@H](NC[C@H](O)c2ccccc2F)c2cc([N+](=O)[O-])ccc21 ZINC000788580590 1134147213 /nfs/dbraw/zinc/14/72/13/1134147213.db2.gz NRNJOBPQKMEBDJ-MSOLQXFVSA-N 0 3 344.386 3.780 20 5 EHBDHN CC[C@H](C)N1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])CC1 ZINC001186452190 1134214399 /nfs/dbraw/zinc/21/43/99/1134214399.db2.gz OLWIPPNXOMDCLS-LBPRGKRZSA-N 0 3 348.834 3.717 20 5 EHBDHN C[C@@H](O)C[C@@H]1CCCCCN1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700320 1135869092 /nfs/dbraw/zinc/86/90/92/1135869092.db2.gz CPTYFTGQFHIUPE-OCCSQVGLSA-N 0 3 326.824 3.764 20 5 EHBDHN CCN(Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812849005 1136260813 /nfs/dbraw/zinc/26/08/13/1136260813.db2.gz NSPWHADXAJSQLL-AUUYWEPGSA-N 0 3 344.411 3.547 20 5 EHBDHN CCc1ccc([C@H](O)CN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850470242 1136265413 /nfs/dbraw/zinc/26/54/13/1136265413.db2.gz ZVKFZCPSWDFQDQ-FZKQIMNGSA-N 0 3 344.411 3.550 20 5 EHBDHN CC(COC(=O)c1ccccc1OCc1ccc(Cl)cc1)[N+](=O)[O-] ZINC000813101464 1136287517 /nfs/dbraw/zinc/28/75/17/1136287517.db2.gz AVPKVQURFDIOGR-LBPRGKRZSA-N 0 3 349.770 3.741 20 5 EHBDHN CC(COC(=O)c1cc(C2CC2)nc2ccc(Cl)cc21)[N+](=O)[O-] ZINC000813104545 1136288311 /nfs/dbraw/zinc/28/83/11/1136288311.db2.gz OHXCZDZXQOPTBK-SECBINFHSA-N 0 3 334.759 3.588 20 5 EHBDHN CC(COC(=O)[C@H](Sc1ccccc1F)c1ccccc1)[N+](=O)[O-] ZINC000813103252 1136288522 /nfs/dbraw/zinc/28/85/22/1136288522.db2.gz ZIGHQLPDWRCTBJ-MLGOLLRUSA-N 0 3 349.383 3.868 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCN(c3ccccc3F)C2)cc1Cl ZINC000814178678 1136412353 /nfs/dbraw/zinc/41/23/53/1136412353.db2.gz ZHWLJEPMPXZVIH-CYBMUJFWSA-N 0 3 349.793 3.756 20 5 EHBDHN CCOc1ccccc1[C@H](CC)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776605469 1136473480 /nfs/dbraw/zinc/47/34/80/1136473480.db2.gz KXPJUJBOXLGKSM-ROUUACIJSA-N 0 3 344.411 3.768 20 5 EHBDHN CC(C)n1cccc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845873965 1137316202 /nfs/dbraw/zinc/31/62/02/1137316202.db2.gz FPCAKRQJNQYRFR-BLLLJJGKSA-N 0 3 334.347 3.771 20 5 EHBDHN COCc1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cc1 ZINC000845874182 1137316221 /nfs/dbraw/zinc/31/62/21/1137316221.db2.gz YARHHTROVQWPTO-SJKOYZFVSA-N 0 3 347.342 3.535 20 5 EHBDHN Cc1cccc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845873084 1137316321 /nfs/dbraw/zinc/31/63/21/1137316321.db2.gz BAUBRCMJSQPIKV-SCLBCKFNSA-N 0 3 331.343 3.626 20 5 EHBDHN C[C@H](NCCCn1cnc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872018883 1137564924 /nfs/dbraw/zinc/56/49/24/1137564924.db2.gz QMDNJVBPNYAPJQ-ZDUSSCGKSA-N 0 3 342.374 3.825 20 5 EHBDHN C[C@@H](NC[C@@H]1CCN(c2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020787 1137565026 /nfs/dbraw/zinc/56/50/26/1137565026.db2.gz KKPINGGUGNTMOU-CABCVRRESA-N 0 3 343.402 3.911 20 5 EHBDHN C[C@H](NCCc1cn(C)c2ncccc12)c1c(F)cccc1[N+](=O)[O-] ZINC000872090806 1137570690 /nfs/dbraw/zinc/57/06/90/1137570690.db2.gz DMXBJKOBDBNACL-LBPRGKRZSA-N 0 3 342.374 3.514 20 5 EHBDHN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c(CN(C)C)c1 ZINC000137083237 1138046015 /nfs/dbraw/zinc/04/60/15/1138046015.db2.gz BZYMFQBGNNJAJZ-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN Cc1c(CN[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000192120638 1140503862 /nfs/dbraw/zinc/50/38/62/1140503862.db2.gz GCZYCLLWXAZZHM-AEFFLSMTSA-N 0 3 348.349 3.801 20 5 EHBDHN C[C@H]1C[C@@H](N(C)c2ncc([N+](=O)[O-])s2)CCN1Cc1ccccc1 ZINC000192460164 1140534296 /nfs/dbraw/zinc/53/42/96/1140534296.db2.gz BFEMBQSIUVIRLB-ZFWWWQNUSA-N 0 3 346.456 3.541 20 5 EHBDHN COCc1cccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000192678547 1140544617 /nfs/dbraw/zinc/54/46/17/1140544617.db2.gz LXWPLRADDPXRPJ-LJQANCHMSA-N 0 3 326.396 3.908 20 5 EHBDHN C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C ZINC000266899164 1140735328 /nfs/dbraw/zinc/73/53/28/1140735328.db2.gz TUAYBGRJDUQEGE-QWHCGFSZSA-N 0 3 339.395 3.526 20 5 EHBDHN CC(C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(F)(F)F ZINC000013649218 211598871 /nfs/dbraw/zinc/59/88/71/211598871.db2.gz UFAVNMXPBBUQAE-RXMQYKEDSA-N 0 3 330.184 3.751 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCSCC(F)(F)F ZINC000595027279 1033648180 /nfs/dbraw/zinc/64/81/80/1033648180.db2.gz QTGWBLPGAQCDRA-VIFPVBQESA-N 0 3 338.351 3.550 20 5 EHBDHN CC[C@@H](NCCOc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000538188646 1032207187 /nfs/dbraw/zinc/20/71/87/1032207187.db2.gz UHZBDPBBBMGCBO-OAHLLOKOSA-N 0 3 336.338 3.993 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CC3(C2)CCOCC3)s1 ZINC000459619201 1032333240 /nfs/dbraw/zinc/33/32/40/1032333240.db2.gz LOZKNMZWKZJABA-UHFFFAOYSA-N 0 3 344.436 3.936 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000536860765 1032358573 /nfs/dbraw/zinc/35/85/73/1032358573.db2.gz AKUCOFQGPJSOKN-MRXNPFEDSA-N 0 3 348.399 3.939 20 5 EHBDHN COc1cc(C)ccc1[C@@H](C)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000536861850 1032360818 /nfs/dbraw/zinc/36/08/18/1032360818.db2.gz DSCGGCMCAZBWOA-CQSZACIVSA-N 0 3 330.384 3.641 20 5 EHBDHN CC[C@H](C)CN(C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000341022473 1017779268 /nfs/dbraw/zinc/77/92/68/1017779268.db2.gz ZXMMVFXIQQVCLL-JTQLQIEISA-N 0 3 332.347 3.683 20 5 EHBDHN C[C@]1(CNc2ncc([N+](=O)[O-])s2)CCCN1Cc1ccccc1 ZINC000336943109 1018000219 /nfs/dbraw/zinc/00/02/19/1018000219.db2.gz ZYFIVQNCDMLZCD-MRXNPFEDSA-N 0 3 332.429 3.518 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC[C@@H](CCO)c1ccccc1 ZINC000893012395 1018156216 /nfs/dbraw/zinc/15/62/16/1018156216.db2.gz FTTFGACUMAUDME-CQSZACIVSA-N 0 3 334.803 3.504 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(OC[C@@H]2CCCO2)CC1 ZINC000182836726 1019766418 /nfs/dbraw/zinc/76/64/18/1019766418.db2.gz KXJFCBPAKCLCPR-YJBOKZPZSA-N 0 3 348.443 3.624 20 5 EHBDHN CC(C)N(C)c1ccc(CN(C)CCc2ccccc2[N+](=O)[O-])cn1 ZINC000348670263 1021046568 /nfs/dbraw/zinc/04/65/68/1021046568.db2.gz INCJICMSFPCOPW-UHFFFAOYSA-N 0 3 342.443 3.509 20 5 EHBDHN CN1C[C@@H]2CCN(C(=O)c3ccc4cc5ccccc5cc4c3)[C@@H]2C1 ZINC001270141102 1021382456 /nfs/dbraw/zinc/38/24/56/1021382456.db2.gz QWEMMZBZECXKAZ-PZJWPPBQSA-N 0 3 330.431 3.769 20 5 EHBDHN O=[N+]([O-])c1cccc(CCN[C@@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000519197267 1021927484 /nfs/dbraw/zinc/92/74/84/1021927484.db2.gz AHFFVKJBPQCCOM-QGZVFWFLSA-N 0 3 328.416 3.772 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)C1CCC(C)(C)CC1 ZINC000438486182 1022025695 /nfs/dbraw/zinc/02/56/95/1022025695.db2.gz OPWWYXHLHMXQEB-UHFFFAOYSA-N 0 3 333.432 3.742 20 5 EHBDHN CCc1cccc(Cl)c1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000425967595 1022503626 /nfs/dbraw/zinc/50/36/26/1022503626.db2.gz OTLDOHAMIXOQAR-UHFFFAOYSA-N 0 3 348.834 3.844 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@H]2c2ccc(F)cc2)c1 ZINC000058933018 1033086253 /nfs/dbraw/zinc/08/62/53/1033086253.db2.gz ONAJWPBSGHYVJG-SFHVURJKSA-N 0 3 330.359 3.950 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000075740995 1033093322 /nfs/dbraw/zinc/09/33/22/1033093322.db2.gz UPNMSOQLMODUQD-HUUCEWRRSA-N 0 3 347.459 3.530 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCc1cccc(Cl)c1 ZINC000509568811 1023057049 /nfs/dbraw/zinc/05/70/49/1023057049.db2.gz KCLPEZLRNVFLLB-UHFFFAOYSA-N 0 3 334.803 3.979 20 5 EHBDHN COCCN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000507158412 1023153539 /nfs/dbraw/zinc/15/35/39/1023153539.db2.gz DSFBVEDEOPQHMG-UHFFFAOYSA-N 0 3 332.425 3.934 20 5 EHBDHN CCOc1ccccc1CCNCc1cc([N+](=O)[O-])ccc1OCC ZINC000518275324 1023186784 /nfs/dbraw/zinc/18/67/84/1023186784.db2.gz FBKCKHJEYBTIIP-UHFFFAOYSA-N 0 3 344.411 3.725 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@@H]3C[C@H]3C3CC3)cs2)c1 ZINC000449739411 1033141154 /nfs/dbraw/zinc/14/11/54/1033141154.db2.gz ABJCLXWXPGKZAW-BBRMVZONSA-N 0 3 329.425 3.854 20 5 EHBDHN CCO[C@@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000610930449 1023877521 /nfs/dbraw/zinc/87/75/21/1023877521.db2.gz HRVWIZYAIPLIKF-MRXNPFEDSA-N 0 3 330.384 3.856 20 5 EHBDHN CC1=NO[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000895311362 1024269304 /nfs/dbraw/zinc/26/93/04/1024269304.db2.gz PPBMEMBZOGWEDB-AWEZNQCLSA-N 0 3 331.397 3.578 20 5 EHBDHN C/C(=C/c1ccccc1)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737319 1024499542 /nfs/dbraw/zinc/49/95/42/1024499542.db2.gz VVQCPKXQVUSWFV-JBXOJTMHSA-N 0 3 338.411 3.580 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC(OCC3CCCC3)CC2)cc1 ZINC000434908096 1024500057 /nfs/dbraw/zinc/50/00/57/1024500057.db2.gz WVWKWXVCZKSWAD-UHFFFAOYSA-N 0 3 348.443 3.645 20 5 EHBDHN CC(C)(C)CC(C)(C)NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000053123825 1024515399 /nfs/dbraw/zinc/51/53/99/1024515399.db2.gz TWZGKTSHXPWLRC-UHFFFAOYSA-N 0 3 332.404 3.949 20 5 EHBDHN C[C@H](c1ccccc1)N1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957237 1024526082 /nfs/dbraw/zinc/52/60/82/1024526082.db2.gz ZMKBBUVSXQAOEL-DOMZBBRYSA-N 0 3 346.818 3.891 20 5 EHBDHN CCC(C)(C)N1CCN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC1 ZINC000594097490 1033252664 /nfs/dbraw/zinc/25/26/64/1033252664.db2.gz OCERZEONHCOTMW-UHFFFAOYSA-N 0 3 348.447 3.550 20 5 EHBDHN CC(C)C[C@@]1(CO)CCCN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000475375800 1026540581 /nfs/dbraw/zinc/54/05/81/1026540581.db2.gz UYKRTHWMFDLMEE-MRXNPFEDSA-N 0 3 326.824 3.621 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000520058782 1026712591 /nfs/dbraw/zinc/71/25/91/1026712591.db2.gz YYTAKNUEFDFEIT-GOSISDBHSA-N 0 3 330.359 3.950 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(Cc2ccccc2)CC2(O)CCCC2)cc1 ZINC000531634826 1027127985 /nfs/dbraw/zinc/12/79/85/1027127985.db2.gz VNKITZASCVRKPJ-UHFFFAOYSA-N 0 3 340.423 3.902 20 5 EHBDHN COCCNc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000127184649 1027410432 /nfs/dbraw/zinc/41/04/32/1027410432.db2.gz PQFAGUJBIFAYQB-CQSZACIVSA-N 0 3 329.400 3.504 20 5 EHBDHN C[C@H]1CCCC[C@@H]1OCCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783597566 1027591705 /nfs/dbraw/zinc/59/17/05/1027591705.db2.gz TWHRJGOLANLOIW-LRDDRELGSA-N 0 3 326.824 3.933 20 5 EHBDHN CCOc1ccc([C@@H](C)NCCOc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000504899702 1029041813 /nfs/dbraw/zinc/04/18/13/1029041813.db2.gz KREMBSNONXPZEH-CYBMUJFWSA-N 0 3 348.374 3.862 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC1(C2(O)CCC2)CC1 ZINC000897527416 1029062314 /nfs/dbraw/zinc/06/23/14/1029062314.db2.gz LUGZXSDNVZBHLN-UHFFFAOYSA-N 0 3 345.226 3.686 20 5 EHBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2NCc2ccccc2Cl)n1 ZINC000447522966 1030244477 /nfs/dbraw/zinc/24/44/77/1030244477.db2.gz ROJVTWQVKILMPV-GJZGRUSLSA-N 0 3 334.807 3.718 20 5 EHBDHN CCN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCCC1 ZINC000026154221 1030630784 /nfs/dbraw/zinc/63/07/84/1030630784.db2.gz LHIHIRKXOXGEGW-UHFFFAOYSA-N 0 3 330.388 3.799 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@@H]3CCCS3)cs2)c1 ZINC000152610711 1031117029 /nfs/dbraw/zinc/11/70/29/1031117029.db2.gz YORYIQAYIFXVFF-AWEZNQCLSA-N 0 3 335.454 3.704 20 5 EHBDHN C[C@H](NC[C@H]1CCC[C@@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC000926916529 1031275053 /nfs/dbraw/zinc/27/50/53/1031275053.db2.gz QDUBSAUDZWPPOT-WDMOLILDSA-N 0 3 332.322 3.745 20 5 EHBDHN COc1cc(CN[C@@]2(C)CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000483752879 1031319704 /nfs/dbraw/zinc/31/97/04/1031319704.db2.gz FDQVXSKSXWYELI-IBGZPJMESA-N 0 3 326.396 3.945 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@H](CCCO)c1ccccc1 ZINC000594495264 1033397295 /nfs/dbraw/zinc/39/72/95/1033397295.db2.gz PGAZEJVJZSRJQS-QZTJIDSGSA-N 0 3 326.396 3.686 20 5 EHBDHN CC1(C)OC[C@@H]2C[C@@]21NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000598986600 1033611464 /nfs/dbraw/zinc/61/14/64/1033611464.db2.gz DFMBOEGIRWIPJH-SCLBCKFNSA-N 0 3 328.368 3.512 20 5 EHBDHN C[C@H](c1ccccc1)[C@H](O)CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000595000225 1033626556 /nfs/dbraw/zinc/62/65/56/1033626556.db2.gz HWDXZNAIIIXRLV-SJKOYZFVSA-N 0 3 334.803 3.502 20 5 EHBDHN CCc1nc(CCN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)cs1 ZINC000595045350 1033662811 /nfs/dbraw/zinc/66/28/11/1033662811.db2.gz YWJPSRJAAAXJSL-LLVKDONJSA-N 0 3 335.429 3.516 20 5 EHBDHN Cc1noc(CN[C@H]2CCCC[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000595441555 1033803490 /nfs/dbraw/zinc/80/34/90/1033803490.db2.gz WTMIGHUIDWQKQX-CVEARBPZSA-N 0 3 329.400 3.782 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCC2(CO)CCC2)c2ccccc2)c1 ZINC000593719059 1033835731 /nfs/dbraw/zinc/83/57/31/1033835731.db2.gz UPQHFFXESWOYJL-IBGZPJMESA-N 0 3 340.423 3.827 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@H]1CCC[C@H]1OCc1ccccc1 ZINC000450975430 1034977273 /nfs/dbraw/zinc/97/72/73/1034977273.db2.gz XMDWBJDPGIUIPV-PKOBYXMFSA-N 0 3 326.396 3.822 20 5 EHBDHN CN(CCc1nccs1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000180179889 1036062925 /nfs/dbraw/zinc/06/29/25/1036062925.db2.gz MNSDOJCAQYOFIN-UHFFFAOYSA-N 0 3 343.408 3.986 20 5 EHBDHN Cn1cc(CN2CCC3(CCC3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000589188186 1036298197 /nfs/dbraw/zinc/29/81/97/1036298197.db2.gz GQSKGFYGJZSLET-UHFFFAOYSA-N 0 3 340.427 3.761 20 5 EHBDHN COC(=O)c1ccc([N+](=O)[O-])c(CN2CCC3(C2)CCCCC3)c1 ZINC000589503624 1036440795 /nfs/dbraw/zinc/44/07/95/1036440795.db2.gz XDFILJUTPHJTJP-UHFFFAOYSA-N 0 3 332.400 3.538 20 5 EHBDHN CC[C@@H]1CCCC[C@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000163396070 1037089072 /nfs/dbraw/zinc/08/90/72/1037089072.db2.gz OIDDBNWMHYVZHX-IUODEOHRSA-N 0 3 330.388 3.703 20 5 EHBDHN C[C@@H](COc1cccc(F)c1)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761521375 1037090312 /nfs/dbraw/zinc/09/03/12/1037090312.db2.gz GGNIOCIQLJYXOY-NSHDSACASA-N 0 3 338.766 3.944 20 5 EHBDHN CC[C@@H](CCO)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180738870 1037133862 /nfs/dbraw/zinc/13/38/62/1037133862.db2.gz MHZBLGFFSLEZNF-KXBFYZLASA-N 0 3 328.412 3.682 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@@]3(C)CCO[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000542316626 1037280910 /nfs/dbraw/zinc/28/09/10/1037280910.db2.gz WUQDVDGPPMAKMV-SGTLLEGYSA-N 0 3 346.383 3.521 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](C)Oc1cccc(F)c1 ZINC000462733816 1037334201 /nfs/dbraw/zinc/33/42/01/1037334201.db2.gz KSHFJFHQKUYORD-CYBMUJFWSA-N 0 3 348.374 3.690 20 5 EHBDHN Cc1cc(C)nc(NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000122332131 1037358466 /nfs/dbraw/zinc/35/84/66/1037358466.db2.gz KHVKPNUDPAGACG-UHFFFAOYSA-N 0 3 337.383 3.619 20 5 EHBDHN Cc1ccc(Sc2ccc(CN(C)C[C@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000462825983 1037449225 /nfs/dbraw/zinc/44/92/25/1037449225.db2.gz BMBLDALHLYUYJE-AWEZNQCLSA-N 0 3 346.452 3.867 20 5 EHBDHN Cc1ccc(CN(CCCO)[C@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000538731434 1038497760 /nfs/dbraw/zinc/49/77/60/1038497760.db2.gz KKOWYLPPPZNHNW-IBGZPJMESA-N 0 3 340.423 3.775 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CN3CC[C@@H](C4CC4)C3)cs2)c1 ZINC000538752999 1038517871 /nfs/dbraw/zinc/51/78/71/1038517871.db2.gz BXWZMEFSVFSRCO-CQSZACIVSA-N 0 3 329.425 3.950 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1cccc2c1CCOC2 ZINC000601303055 1038921441 /nfs/dbraw/zinc/92/14/41/1038921441.db2.gz BREFEFJKLMYCLC-AWEZNQCLSA-N 0 3 326.396 3.827 20 5 EHBDHN CCN(CC)[C@H](CNc1ccc([N+](=O)[O-])cc1COC)c1ccco1 ZINC000175059917 1039150857 /nfs/dbraw/zinc/15/08/57/1039150857.db2.gz LAPLKDMOGFFIFM-QGZVFWFLSA-N 0 3 347.415 3.829 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CNCCSCc1ccccc1 ZINC000552802311 1039538573 /nfs/dbraw/zinc/53/85/73/1039538573.db2.gz JYWJBFRYEDXVKG-UHFFFAOYSA-N 0 3 332.425 3.626 20 5 EHBDHN CCOC(=O)CC1CCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000485797559 1039569874 /nfs/dbraw/zinc/56/98/74/1039569874.db2.gz YMRYJNNHRSFLCG-AWEZNQCLSA-N 0 3 334.416 3.629 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](N[C@H]2CCN(C3CC3)C2)c2ccccc2)c1 ZINC000491022888 1040869231 /nfs/dbraw/zinc/86/92/31/1040869231.db2.gz QDAMCVZUECETNM-PXNSSMCTSA-N 0 3 337.423 3.511 20 5 EHBDHN CC1CCN([C@H](CNc2ncccc2[N+](=O)[O-])c2cccs2)CC1 ZINC000015128656 1041304790 /nfs/dbraw/zinc/30/47/90/1041304790.db2.gz WPDNRPZRZFVFAT-OAHLLOKOSA-N 0 3 346.456 3.936 20 5 EHBDHN COc1ccc(CN2CC[C@H](c3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC000544185700 1041377913 /nfs/dbraw/zinc/37/79/13/1041377913.db2.gz HQSDAPJWDSECDG-KRWDZBQOSA-N 0 3 326.396 3.901 20 5 EHBDHN Cc1ccc([C@H](C)NC[C@H](c2ccco2)N2CCCC2)cc1[N+](=O)[O-] ZINC000120316223 1042392269 /nfs/dbraw/zinc/39/22/69/1042392269.db2.gz HXSFQSJUXLYBPP-MAUKXSAKSA-N 0 3 343.427 3.984 20 5 EHBDHN Cc1ccc([C@@H](O)CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000279029797 1043219619 /nfs/dbraw/zinc/21/96/19/1043219619.db2.gz IHPPRCYEJUXYNH-HOTGVXAUSA-N 0 3 330.384 3.542 20 5 EHBDHN C[C@@H](NC[C@@H](O)c1cc(F)cc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000279411127 1044061785 /nfs/dbraw/zinc/06/17/85/1044061785.db2.gz DUGBDYNNZULVPX-QLJPJBMISA-N 0 3 338.766 3.772 20 5 EHBDHN C[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000572422528 1044874963 /nfs/dbraw/zinc/87/49/63/1044874963.db2.gz BANDVKYTMFTCCD-IAQYHMDHSA-N 0 3 326.352 3.662 20 5 EHBDHN Cc1ccnc(NC[C@H]2CCCN(Cc3cccs3)C2)c1[N+](=O)[O-] ZINC000301302499 1127735962 /nfs/dbraw/zinc/73/59/62/1127735962.db2.gz RWQOYZXBWFEFJM-CQSZACIVSA-N 0 3 346.456 3.684 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cs1 ZINC000273377232 1128517092 /nfs/dbraw/zinc/51/70/92/1128517092.db2.gz GBNQZVRYAARVNC-HUUCEWRRSA-N 0 3 336.388 3.805 20 5 EHBDHN CCC[C@H](NCc1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000130941885 1129007296 /nfs/dbraw/zinc/00/72/96/1129007296.db2.gz SCRZCZNSPCWDQL-KRWDZBQOSA-N 0 3 342.399 3.716 20 5 EHBDHN CN(C(=O)c1cc2ccccc2c2cccnc12)C1CCN(C)CC1 ZINC000194273691 1121830172 /nfs/dbraw/zinc/83/01/72/1121830172.db2.gz QGNJICAQHBXDPH-UHFFFAOYSA-N 0 3 333.435 3.554 20 5 EHBDHN CN(C)[C@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1cccc(F)c1 ZINC000301806511 1129098346 /nfs/dbraw/zinc/09/83/46/1129098346.db2.gz WCZNTIMUEUKOIG-OAHLLOKOSA-N 0 3 339.317 3.727 20 5 EHBDHN COCCN(CCCc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000065958732 1129115381 /nfs/dbraw/zinc/11/53/81/1129115381.db2.gz LMFMDJMLTJTHJS-UHFFFAOYSA-N 0 3 328.412 3.676 20 5 EHBDHN C[C@H]1CCC[C@@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000078539666 1129160379 /nfs/dbraw/zinc/16/03/79/1129160379.db2.gz DNJUPBFKECSJOH-SWLSCSKDSA-N 0 3 330.388 3.655 20 5 EHBDHN COCCOc1cccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000163008210 1125022345 /nfs/dbraw/zinc/02/23/45/1125022345.db2.gz XAFUKKDTUZZGLJ-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN Cc1csc(C2(NCCOc3cccc([N+](=O)[O-])c3)CCCC2)n1 ZINC000081595664 1129430960 /nfs/dbraw/zinc/43/09/60/1129430960.db2.gz JRCYJILMUBFNFG-UHFFFAOYSA-N 0 3 347.440 3.798 20 5 EHBDHN O=[N+]([O-])c1cc(F)c(CN[C@H](Cc2ccccc2)C2CC2)c(F)c1 ZINC000509020814 1129656783 /nfs/dbraw/zinc/65/67/83/1129656783.db2.gz GRDCDMRLUZQMQK-GOSISDBHSA-N 0 3 332.350 3.984 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@@H]2[C@@H](c3ccccc3)C2(F)F)c(F)c1 ZINC000922776902 1129658006 /nfs/dbraw/zinc/65/80/06/1129658006.db2.gz VGRXLSDUTBYXFH-GDBMZVCRSA-N 0 3 336.313 3.872 20 5 EHBDHN CC(C)Cn1ccnc1CN[C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000164757416 1129991290 /nfs/dbraw/zinc/99/12/90/1129991290.db2.gz WKAZAIHGGVTHHX-KRWDZBQOSA-N 0 3 342.443 3.558 20 5 EHBDHN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c(CN(C)C)c1 ZINC000733807165 1131080723 /nfs/dbraw/zinc/08/07/23/1131080723.db2.gz SKHGGJLWOGWISO-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN C[C@H](N[C@@H](C)c1cccc(-n2ccnn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000348082828 1131149834 /nfs/dbraw/zinc/14/98/34/1131149834.db2.gz TZTHCZVPPGSGMK-KBPBESRZSA-N 0 3 337.383 3.587 20 5 EHBDHN Cc1nc([C@H](C)N[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cs1 ZINC001172899037 1131883109 /nfs/dbraw/zinc/88/31/09/1131883109.db2.gz LBNVLCVHHMRUCS-NHYWBVRUSA-N 0 3 331.441 3.958 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N(C)CCC(=O)c1cccs1 ZINC001173230805 1132009644 /nfs/dbraw/zinc/00/96/44/1132009644.db2.gz GQEFQAZTXISVET-ZDUSSCGKSA-N 0 3 332.425 3.792 20 5 EHBDHN CCc1ccccc1-c1nc(CN[C@H]2CC[C@H](C[N+](=O)[O-])C2)cs1 ZINC001169006395 1132629774 /nfs/dbraw/zinc/62/97/74/1132629774.db2.gz HPBKZQHOBZSZBO-ZFWWWQNUSA-N 0 3 345.468 3.908 20 5 EHBDHN CC(C)(NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC001176177212 1132857912 /nfs/dbraw/zinc/85/79/12/1132857912.db2.gz UEVOILCDVJYDCF-UHFFFAOYSA-N 0 3 336.338 3.777 20 5 EHBDHN CCOc1cc(N2CCN(CCC3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC001169909041 1132895849 /nfs/dbraw/zinc/89/58/49/1132895849.db2.gz WJGQQDVMRBCXIK-UHFFFAOYSA-N 0 3 347.459 3.696 20 5 EHBDHN CO[C@H](CN[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000788670162 1134159722 /nfs/dbraw/zinc/15/97/22/1134159722.db2.gz SQFUMQBDUUGQIR-APPDUMDISA-N 0 3 349.818 3.869 20 5 EHBDHN COc1cc2c(cc1F)CC[C@H]2N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788815719 1134176699 /nfs/dbraw/zinc/17/66/99/1134176699.db2.gz DPAYQIPTXJRSAC-MGPLVRAMSA-N 0 3 345.374 3.663 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCC[C@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344946 1134758582 /nfs/dbraw/zinc/75/85/82/1134758582.db2.gz FSOCCLMTBDCXFX-YPMHNXCESA-N 0 3 328.359 3.512 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCC[C@@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346421 1134760017 /nfs/dbraw/zinc/76/00/17/1134760017.db2.gz NMMLDMXVCYYKEB-RDTXWAMCSA-N 0 3 341.411 3.767 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350552 1134760427 /nfs/dbraw/zinc/76/04/27/1134760427.db2.gz BCKOBKZPJAPXAH-KDOFPFPSSA-N 0 3 326.396 3.981 20 5 EHBDHN CC[C@@H](c1ccccc1OC)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834350 1135332359 /nfs/dbraw/zinc/33/23/59/1135332359.db2.gz FXIKGSHGOYLJKN-ROUUACIJSA-N 0 3 344.411 3.720 20 5 EHBDHN C[C@@H](CN(Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000805820337 1135336367 /nfs/dbraw/zinc/33/63/67/1135336367.db2.gz KXSWGQJAYVUOAY-GJZGRUSLSA-N 0 3 346.402 3.720 20 5 EHBDHN CC[C@@H](NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000809975717 1135907577 /nfs/dbraw/zinc/90/75/77/1135907577.db2.gz SIPIMPVNJOVDJP-OLZOCXBDSA-N 0 3 333.215 3.949 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCc1ccccn1 ZINC000811471806 1136095010 /nfs/dbraw/zinc/09/50/10/1136095010.db2.gz KVBBORXGZDFAPN-UHFFFAOYSA-N 0 3 326.183 3.629 20 5 EHBDHN O=[N+]([O-])c1ccc(CCNCc2ccnc(Cl)c2Cl)cc1 ZINC000811479149 1136096782 /nfs/dbraw/zinc/09/67/82/1136096782.db2.gz YZWSQPMEXSMKTP-UHFFFAOYSA-N 0 3 326.183 3.629 20 5 EHBDHN CC[C@@H](C)[C@](C)(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811479553 1136097495 /nfs/dbraw/zinc/09/74/95/1136097495.db2.gz HVRXDBQZIDHSQR-YMTOWFKASA-N 0 3 335.231 3.788 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21 ZINC000850408732 1136252294 /nfs/dbraw/zinc/25/22/94/1136252294.db2.gz DKDUECWWROSBLJ-HYVNUMGLSA-N 0 3 332.762 3.815 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C)C[C@@H](O)c1ccccc1 ZINC000850442019 1136259331 /nfs/dbraw/zinc/25/93/31/1136259331.db2.gz JRAKJLXVSXCYGZ-QWQRMKEZSA-N 0 3 344.411 3.766 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@]1(C)CC1(Cl)Cl ZINC000850472519 1136265761 /nfs/dbraw/zinc/26/57/61/1136265761.db2.gz JCLSFXVHPCWKSN-NOZJJQNGSA-N 0 3 333.215 3.838 20 5 EHBDHN CC(COC(=O)C(C)(C)c1ccc(-c2ccccc2)cc1)[N+](=O)[O-] ZINC000813104483 1136288103 /nfs/dbraw/zinc/28/81/03/1136288103.db2.gz NEGGIGXODZRVKC-AWEZNQCLSA-N 0 3 327.380 3.840 20 5 EHBDHN CC(COC(=O)c1cc(-c2cccs2)nc2ccccc21)[N+](=O)[O-] ZINC000813104490 1136288199 /nfs/dbraw/zinc/28/81/99/1136288199.db2.gz NGHOBQRFQMTQFM-LLVKDONJSA-N 0 3 342.376 3.785 20 5 EHBDHN CCc1ccccc1O[C@@H](C(=O)OCC(C)[N+](=O)[O-])c1ccccc1 ZINC000813110247 1136294604 /nfs/dbraw/zinc/29/46/04/1136294604.db2.gz VQWCXIBLQKOLOW-KBXCAEBGSA-N 0 3 343.379 3.578 20 5 EHBDHN C[C@@H]1CCC[C@@]1(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816660472 1136746065 /nfs/dbraw/zinc/74/60/65/1136746065.db2.gz FURJEYKQAJZKCY-YMTOWFKASA-N 0 3 333.215 3.542 20 5 EHBDHN Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818961852 1136891117 /nfs/dbraw/zinc/89/11/17/1136891117.db2.gz VVOIPONRXYOYGE-DLBZAZTESA-N 0 3 344.411 3.833 20 5 EHBDHN CC(C)[C@H](NCc1c(F)cc([N+](=O)[O-])cc1F)C1(CO)CCCC1 ZINC001170929856 1136950368 /nfs/dbraw/zinc/95/03/68/1136950368.db2.gz NWIZSMIMPQJLQW-INIZCTEOSA-N 0 3 342.386 3.540 20 5 EHBDHN COCc1cc([N+](=O)[O-])ccc1NC[C@H](c1cccs1)N(C)C ZINC000266017727 1136997998 /nfs/dbraw/zinc/99/79/98/1136997998.db2.gz PAFOWMDYAMEWEG-OAHLLOKOSA-N 0 3 335.429 3.518 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2C[C@@H]3C[C@@H](c4ccccc4)[C@@H]3C2)cc1F ZINC000859928274 1137037192 /nfs/dbraw/zinc/03/71/92/1137037192.db2.gz IBGYIIYBAXMVFL-YESZJQIVSA-N 0 3 326.371 3.969 20 5 EHBDHN CC(C)(CNCc1cc(Cl)ccc1[N+](=O)[O-])C1(O)CCCC1 ZINC000825232028 1137170207 /nfs/dbraw/zinc/17/02/07/1137170207.db2.gz KUBYJQNQPJCIPW-UHFFFAOYSA-N 0 3 326.824 3.669 20 5 EHBDHN CC([C@H](OC(=O)[C@H](C)Oc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845872256 1137315968 /nfs/dbraw/zinc/31/59/68/1137315968.db2.gz FPRULOCMCAOKJD-DCGLDWPTSA-N 0 3 347.342 3.543 20 5 EHBDHN CSCC1(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])CC1 ZINC000845875800 1137316141 /nfs/dbraw/zinc/31/61/41/1137316141.db2.gz CLFDFLNLEZHRIH-ABAIWWIYSA-N 0 3 341.404 3.609 20 5 EHBDHN CC([C@@H](OC(=O)[C@H]1Cc2ccc(F)cc21)c1ccccc1F)[N+](=O)[O-] ZINC000845875604 1137316266 /nfs/dbraw/zinc/31/62/66/1137316266.db2.gz AEMXYMISTRLIKL-TYFHEEPYSA-N 0 3 347.317 3.554 20 5 EHBDHN COCc1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cc1 ZINC000845874183 1137316296 /nfs/dbraw/zinc/31/62/96/1137316296.db2.gz YARHHTROVQWPTO-YVEFUNNKSA-N 0 3 347.342 3.535 20 5 EHBDHN CSCCCCC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881442 1137316886 /nfs/dbraw/zinc/31/68/86/1137316886.db2.gz ZTCMPFOSWJGHPN-ABAIWWIYSA-N 0 3 329.393 3.609 20 5 EHBDHN CC([C@H](OC(=O)C1CCC(F)(F)CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878969 1137316913 /nfs/dbraw/zinc/31/69/13/1137316913.db2.gz UJNSSYPWVOSMLD-YGRLFVJLSA-N 0 3 345.317 3.901 20 5 EHBDHN CC([C@@H](OC(=O)c1ccoc1C1CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845882992 1137317228 /nfs/dbraw/zinc/31/72/28/1137317228.db2.gz QQGQHAZTJWZXBG-MEBBXXQBSA-N 0 3 333.315 3.859 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](O)c1c(F)cccc1F ZINC000773016433 1137459558 /nfs/dbraw/zinc/45/95/58/1137459558.db2.gz YKEBDFVJJNEROT-MEDUHNTESA-N 0 3 336.338 3.566 20 5 EHBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCc1cccc(F)n1 ZINC000773083993 1137463988 /nfs/dbraw/zinc/46/39/88/1137463988.db2.gz AFYYZBHGYAPUHY-LBPRGKRZSA-N 0 3 335.404 3.789 20 5 EHBDHN CC(=O)Nc1ccc(CCN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872032623 1137566431 /nfs/dbraw/zinc/56/64/31/1137566431.db2.gz WVIIYHBZUDGNJG-LBPRGKRZSA-N 0 3 345.374 3.586 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CCCc2cn[nH]c21 ZINC000872047685 1137567604 /nfs/dbraw/zinc/56/76/04/1137567604.db2.gz COJRLOYNOCUDQC-YGRLFVJLSA-N 0 3 332.429 3.768 20 5 EHBDHN Cc1nc(C2C[C@H]3CC[C@@H](C2)N3[C@@H](C)c2cccc([N+](=O)[O-])c2)no1 ZINC000879680690 1137755095 /nfs/dbraw/zinc/75/50/95/1137755095.db2.gz VZPJLUSFMLSQMH-RJPYNODJSA-N 0 3 342.399 3.758 20 5 EHBDHN Cc1nc(C2CCN(Cc3cc(Cl)ccc3[N+](=O)[O-])CC2)[nH]c1C ZINC000886666737 1138111617 /nfs/dbraw/zinc/11/16/17/1138111617.db2.gz ZFQVMOZKSLDYTK-UHFFFAOYSA-N 0 3 348.834 3.968 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@H](C)C[C@@H](C)C1 ZINC000263802842 1138370240 /nfs/dbraw/zinc/37/02/40/1138370240.db2.gz WIKUAGQISFWWMG-JHJVBQTASA-N 0 3 330.388 3.684 20 5 EHBDHN Cc1cc(C(=O)Nc2cc(CN(C)C)ccc2C)cc([N+](=O)[O-])c1 ZINC000177349059 1139614920 /nfs/dbraw/zinc/61/49/20/1139614920.db2.gz DSXQTHUDZYDVFZ-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ccccc1-n1ccnc1)CCC2 ZINC000192727166 1140547556 /nfs/dbraw/zinc/54/75/56/1140547556.db2.gz AYOCYGCCRLZCSX-IBGZPJMESA-N 0 3 348.406 3.948 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000194803568 1140622336 /nfs/dbraw/zinc/62/23/36/1140622336.db2.gz OPTQRMFAFVBKQR-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN CCc1nc(C)c([C@@H](C)N(C)C[C@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625581 1141129136 /nfs/dbraw/zinc/12/91/36/1141129136.db2.gz CJVFZWRAJVFQOA-DOMZBBRYSA-N 0 3 349.456 3.649 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1cccc(Cn2cccn2)c1 ZINC000579732246 1014312291 /nfs/dbraw/zinc/31/22/91/1014312291.db2.gz SNMFAQBCFFAPGA-LJQANCHMSA-N 0 3 348.406 3.617 20 5 EHBDHN C[C@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000584305515 1032106826 /nfs/dbraw/zinc/10/68/26/1032106826.db2.gz VGZAPVCEQUTVRV-LBPRGKRZSA-N 0 3 347.802 3.928 20 5 EHBDHN CCc1nc(C)c([C@@H](C)N(C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000610215073 1015005750 /nfs/dbraw/zinc/00/57/50/1015005750.db2.gz HNVKSADAKNJLIP-CYBMUJFWSA-N 0 3 349.456 3.994 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@H](CC2CC2)C1 ZINC000339670822 1015492287 /nfs/dbraw/zinc/49/22/87/1015492287.db2.gz FUFRMWBBMHGYDF-TZMCWYRMSA-N 0 3 342.399 3.828 20 5 EHBDHN Cc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000593013613 1032640993 /nfs/dbraw/zinc/64/09/93/1032640993.db2.gz KDSGNDBVCPNCHH-RYUDHWBXSA-N 0 3 346.305 3.589 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@@H]2CCCC2(F)F)c1 ZINC000449497341 1032667556 /nfs/dbraw/zinc/66/75/56/1032667556.db2.gz QXQJSYBXQLRCKF-JTQLQIEISA-N 0 3 336.285 3.721 20 5 EHBDHN C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cnn(C)c1 ZINC000610272987 1017160451 /nfs/dbraw/zinc/16/04/51/1017160451.db2.gz AAWMXZPJIMWJIG-GFCCVEGCSA-N 0 3 342.424 3.908 20 5 EHBDHN CC(C)[C@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000015549966 1018756522 /nfs/dbraw/zinc/75/65/22/1018756522.db2.gz HPUBOAXCUVUVJJ-KSSFIOAISA-N 0 3 341.411 3.909 20 5 EHBDHN COc1ccccc1CCN(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000513502738 1019760433 /nfs/dbraw/zinc/76/04/33/1019760433.db2.gz DZLFICHXTSJNPB-JXMROGBWSA-N 0 3 326.396 3.791 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510436043 1021147717 /nfs/dbraw/zinc/14/77/17/1021147717.db2.gz YAQLVGKIUURGKP-GOEBONIOSA-N 0 3 336.395 3.953 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(-c2nc(-c3ccc(CN(C)C)cc3)no2)c1 ZINC000477149316 1021205563 /nfs/dbraw/zinc/20/55/63/1021205563.db2.gz FEJUASMJPZNOGV-UHFFFAOYSA-N 0 3 338.367 3.682 20 5 EHBDHN Cc1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507714655 1021467722 /nfs/dbraw/zinc/46/77/22/1021467722.db2.gz PEBGDKCOWBTJAN-KRWDZBQOSA-N 0 3 326.396 3.804 20 5 EHBDHN C[C@@H](N[C@H](C)c1ccc(-n2cncn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178325519 1022668902 /nfs/dbraw/zinc/66/89/02/1022668902.db2.gz IVXIAYLPIPWLEZ-ZIAGYGMSSA-N 0 3 337.383 3.587 20 5 EHBDHN COC(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000507152660 1023160579 /nfs/dbraw/zinc/16/05/79/1023160579.db2.gz XQZZWNIGUUWGBI-UHFFFAOYSA-N 0 3 342.395 3.792 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNCC3([C@H]4CCCCO4)CCC3)nc2c1 ZINC000602744185 1033109764 /nfs/dbraw/zinc/10/97/64/1033109764.db2.gz YYFKXTMTVCPDDH-MRXNPFEDSA-N 0 3 345.399 3.565 20 5 EHBDHN Cc1cc(NC[C@H](C)N2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000520748266 1024609745 /nfs/dbraw/zinc/60/97/45/1024609745.db2.gz GSGFYDULYOGLPX-HNNXBMFYSA-N 0 3 325.412 3.762 20 5 EHBDHN CC(C)n1cncc1CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000425369121 1024886551 /nfs/dbraw/zinc/88/65/51/1024886551.db2.gz LETUNNZTAPQTRX-MRXNPFEDSA-N 0 3 328.416 3.752 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@@H]3CSC3(C)C)o2)c([N+](=O)[O-])c1 ZINC000515140018 1025042699 /nfs/dbraw/zinc/04/26/99/1025042699.db2.gz BKQSGEBKBAJPFY-MRXNPFEDSA-N 0 3 348.424 3.847 20 5 EHBDHN C[C@H](c1ccccc1)[C@@H](O)CNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000451057563 1025480566 /nfs/dbraw/zinc/48/05/66/1025480566.db2.gz UBQJIRRJWXGPFN-KDOFPFPSSA-N 0 3 328.412 3.584 20 5 EHBDHN CC[C@@H](C)[C@H](C)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240799 1025489995 /nfs/dbraw/zinc/48/99/95/1025489995.db2.gz RFGPMOAFHOPEDG-OCCSQVGLSA-N 0 3 333.432 3.741 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](Cc2nccs2)C1 ZINC000934334244 1025506610 /nfs/dbraw/zinc/50/66/10/1025506610.db2.gz UIYFFZSXAPYMGB-KGLIPLIRSA-N 0 3 331.441 3.985 20 5 EHBDHN Cc1cccc([C@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000452089778 1026485476 /nfs/dbraw/zinc/48/54/76/1026485476.db2.gz QBIJSKQZSVVYNP-LSDHHAIUSA-N 0 3 341.411 3.889 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCOc2ccccc2C(F)(F)F)cc1 ZINC000237809959 1027762163 /nfs/dbraw/zinc/76/21/63/1027762163.db2.gz YSKFMUICJKBNAJ-UHFFFAOYSA-N 0 3 340.301 3.782 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(CN(C)C)c1 ZINC000421431661 1028412589 /nfs/dbraw/zinc/41/25/89/1028412589.db2.gz PYIZWWXOXSPIIN-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN Cc1c(CN[C@H](c2ccccc2)C(C)(C)CO)cccc1[N+](=O)[O-] ZINC000429707700 1029961090 /nfs/dbraw/zinc/96/10/90/1029961090.db2.gz BOUMMRSZCABGLO-GOSISDBHSA-N 0 3 328.412 3.753 20 5 EHBDHN CCN(CCCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000537635225 1030200759 /nfs/dbraw/zinc/20/07/59/1030200759.db2.gz YWPPXJUFTJNNRP-UHFFFAOYSA-N 0 3 348.374 3.731 20 5 EHBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCc2ccccc2Cl)n1 ZINC000447522968 1030244201 /nfs/dbraw/zinc/24/42/01/1030244201.db2.gz ROJVTWQVKILMPV-LSDHHAIUSA-N 0 3 334.807 3.718 20 5 EHBDHN CN(C)C[C@@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776187 1030704254 /nfs/dbraw/zinc/70/42/54/1030704254.db2.gz TXLRGRAJRBHTFZ-SUQGKYDKSA-N 0 3 343.402 3.640 20 5 EHBDHN CO[C@@H](CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000550894736 1030775695 /nfs/dbraw/zinc/77/56/95/1030775695.db2.gz GOMVSSDVNMRYBR-OALUTQOASA-N 0 3 326.396 3.699 20 5 EHBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC(c2c[nH]nc2C)CC1 ZINC000551564841 1031458811 /nfs/dbraw/zinc/45/88/11/1031458811.db2.gz QDJQHUVPAHBISJ-UVTDQMKNSA-N 0 3 340.427 3.909 20 5 EHBDHN COc1ccc(COCCN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000537936259 1032021257 /nfs/dbraw/zinc/02/12/57/1032021257.db2.gz ITJIPGWBJOEXJI-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN CC[C@@H](OCCNCc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000593664440 1033663916 /nfs/dbraw/zinc/66/39/16/1033663916.db2.gz NHOPSASMRHBLDO-GOSISDBHSA-N 0 3 344.411 3.861 20 5 EHBDHN CC(=O)c1cc(NC[C@@H]2CCN2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000599125690 1033745362 /nfs/dbraw/zinc/74/53/62/1033745362.db2.gz AKAOUAKENKXAMB-INIZCTEOSA-N 0 3 331.416 3.616 20 5 EHBDHN Cc1cc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000593118293 1033968269 /nfs/dbraw/zinc/96/82/69/1033968269.db2.gz POFDSYBOCUCIPG-RYUDHWBXSA-N 0 3 346.305 3.589 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000604484206 1034388845 /nfs/dbraw/zinc/38/88/45/1034388845.db2.gz FGHYIMXUQKUYBW-SFHVURJKSA-N 0 3 328.368 3.516 20 5 EHBDHN CC(C)(NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000411761311 1035019977 /nfs/dbraw/zinc/01/99/77/1035019977.db2.gz VAVIVMZYEDUMQP-UHFFFAOYSA-N 0 3 345.374 3.587 20 5 EHBDHN CC[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000164554378 1035666751 /nfs/dbraw/zinc/66/67/51/1035666751.db2.gz CQQVUZMRQVZUCV-GOEBONIOSA-N 0 3 349.431 3.645 20 5 EHBDHN COc1cc(CNCCC2=CCCCCC2)c([N+](=O)[O-])cc1OC ZINC000463715214 1035761715 /nfs/dbraw/zinc/76/17/15/1035761715.db2.gz GWAHFJKDHDUTRU-UHFFFAOYSA-N 0 3 334.416 3.982 20 5 EHBDHN CCCC[C@H](N)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000442723072 1036209903 /nfs/dbraw/zinc/20/99/03/1036209903.db2.gz YNAFKPHSINLDGQ-KRWDZBQOSA-N 0 3 343.383 3.843 20 5 EHBDHN CN1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2C1 ZINC000590369317 1036856353 /nfs/dbraw/zinc/85/63/53/1036856353.db2.gz CNIRHANQTDXFLQ-UHFFFAOYSA-N 0 3 331.803 3.700 20 5 EHBDHN CCN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1occc1C ZINC000412026011 1036858818 /nfs/dbraw/zinc/85/88/18/1036858818.db2.gz KMKIYPUVSQCMSG-UHFFFAOYSA-N 0 3 345.399 3.655 20 5 EHBDHN CC(C)[C@H](O)C1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000539588698 1036957161 /nfs/dbraw/zinc/95/71/61/1036957161.db2.gz GAGHUUSWPJGEMJ-SFHVURJKSA-N 0 3 344.411 3.742 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC(C)(C)C[C@@H]1C ZINC000412031155 1036990680 /nfs/dbraw/zinc/99/06/80/1036990680.db2.gz AMUPJCXCPXKGKX-RYUDHWBXSA-N 0 3 330.388 3.826 20 5 EHBDHN Cc1ccc(CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237783944 1037178827 /nfs/dbraw/zinc/17/88/27/1037178827.db2.gz QIEJTBNWZQAPGV-UHFFFAOYSA-N 0 3 342.424 3.655 20 5 EHBDHN CO[C@H](CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000493308448 1037243207 /nfs/dbraw/zinc/24/32/07/1037243207.db2.gz YPFXHIWGHXBHSG-MOPGFXCFSA-N 0 3 328.412 3.945 20 5 EHBDHN COc1cccc(COCCN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000540139591 1037612616 /nfs/dbraw/zinc/61/26/16/1037612616.db2.gz CEAATRKWEDJQJO-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN COc1ccc(CNC/C(C)=C\c2cccc([N+](=O)[O-])c2)cc1O ZINC000468639246 1037675573 /nfs/dbraw/zinc/67/55/73/1037675573.db2.gz RRZMRPICZMMZHO-JYRVWZFOSA-N 0 3 328.368 3.502 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2noc(CN3CCCC[C@@H]3C3CCC3)n2)c1 ZINC000592198799 1037944488 /nfs/dbraw/zinc/94/44/88/1037944488.db2.gz VNIWTCRFQSIQMN-MRXNPFEDSA-N 0 3 342.399 3.799 20 5 EHBDHN C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCc2occc21 ZINC000341439286 1038304852 /nfs/dbraw/zinc/30/48/52/1038304852.db2.gz HPNQJNXOZOUWKA-LRDDRELGSA-N 0 3 343.383 3.572 20 5 EHBDHN O=C(CN[C@H](c1ccccc1)C1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC000104701887 1038490645 /nfs/dbraw/zinc/49/06/45/1038490645.db2.gz NEAYWTWCQRIPSG-LJQANCHMSA-N 0 3 339.395 3.664 20 5 EHBDHN Cc1cc(N[C@@H]2CCN(C3CC3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461777581 1038604308 /nfs/dbraw/zinc/60/43/08/1038604308.db2.gz GAZOAXQHFAARTN-SNVBAGLBSA-N 0 3 329.322 3.571 20 5 EHBDHN CCOC(=O)C[C@](C)(NCc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000479876781 1038825349 /nfs/dbraw/zinc/82/53/49/1038825349.db2.gz VESDMVWWPDPTJI-INIZCTEOSA-N 0 3 342.823 3.706 20 5 EHBDHN C[C@@H](C[C@@H](O)c1cccs1)NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893268735 1038911679 /nfs/dbraw/zinc/91/16/79/1038911679.db2.gz YMZXDHSOBBCZGY-IINYFYTJSA-N 0 3 340.832 3.912 20 5 EHBDHN CC[C@H](N[C@@H](C)c1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000192848824 1040571368 /nfs/dbraw/zinc/57/13/68/1040571368.db2.gz JRULVDWBAONMII-SJCJKPOMSA-N 0 3 342.399 3.887 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)C1CCC(C(C)C)CC1 ZINC000433144002 1040909443 /nfs/dbraw/zinc/90/94/43/1040909443.db2.gz AQMZKIKHCGLKTF-UHFFFAOYSA-N 0 3 347.459 3.988 20 5 EHBDHN CC(C)N(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000110788966 1041602440 /nfs/dbraw/zinc/60/24/40/1041602440.db2.gz QSNIVGUMNVOWCV-UHFFFAOYSA-N 0 3 339.823 3.840 20 5 EHBDHN Cc1c([C@H](C)NCCC(=O)Nc2ccccc2)cccc1[N+](=O)[O-] ZINC000164986556 1042585093 /nfs/dbraw/zinc/58/50/93/1042585093.db2.gz FPLFIEVOEKAFII-AWEZNQCLSA-N 0 3 327.384 3.583 20 5 EHBDHN CC1(C)C[C@@H](NC[C@@H](O)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000279132142 1043401125 /nfs/dbraw/zinc/40/11/25/1043401125.db2.gz RCKHGSWUZVNISL-HZPDHXFCSA-N 0 3 332.425 3.702 20 5 EHBDHN CCOCCN(CC)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000512300224 1044563280 /nfs/dbraw/zinc/56/32/80/1044563280.db2.gz QRUPEZHOHHJFAD-UHFFFAOYSA-N 0 3 348.399 3.722 20 5 EHBDHN Cc1cc(NCC(C)(C)N2CCc3ccccc3C2)ncc1[N+](=O)[O-] ZINC000301420069 1127742592 /nfs/dbraw/zinc/74/25/92/1127742592.db2.gz DSOOFJRYQOPSKX-UHFFFAOYSA-N 0 3 340.427 3.547 20 5 EHBDHN C[C@@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000765848110 1128560092 /nfs/dbraw/zinc/56/00/92/1128560092.db2.gz FOXNBIITMGOLLW-MLGOLLRUSA-N 0 3 326.352 3.725 20 5 EHBDHN CCC[C@@H](NCc1ccc(C(=O)NC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000327011370 1128583978 /nfs/dbraw/zinc/58/39/78/1128583978.db2.gz MOGNSGDGCMHPNB-GOSISDBHSA-N 0 3 341.411 3.585 20 5 EHBDHN CCSc1cc(CNC/C=C\c2ccccc2[N+](=O)[O-])ccn1 ZINC000495178686 1120980845 /nfs/dbraw/zinc/98/08/45/1120980845.db2.gz SXVDIDBIFIUOLF-ALCCZGGFSA-N 0 3 329.425 3.905 20 5 EHBDHN O=[N+]([O-])c1ccc(N[C@H](CN2CCCC2)c2ccccc2)c(F)c1 ZINC000301081367 1121479617 /nfs/dbraw/zinc/47/96/17/1121479617.db2.gz KOLIMSBQRCMSIH-GOSISDBHSA-N 0 3 329.375 3.983 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(CCCOCC(F)(F)F)C2CC2)c1 ZINC000153269337 1121556070 /nfs/dbraw/zinc/55/60/70/1121556070.db2.gz PHLPMWDECVJDEO-UHFFFAOYSA-N 0 3 332.322 3.528 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c(Cl)c1 ZINC000322895818 1121681367 /nfs/dbraw/zinc/68/13/67/1121681367.db2.gz BSPBGKWGCYTILD-OIISXLGYSA-N 0 3 338.835 3.764 20 5 EHBDHN COc1cccc(C[C@H]2CCCN2Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000917087091 1122490930 /nfs/dbraw/zinc/49/09/30/1122490930.db2.gz QDNOISIUONMIMZ-QGZVFWFLSA-N 0 3 344.386 3.950 20 5 EHBDHN COc1cccc([C@H](CNc2ccc(Cl)cc2[N+](=O)[O-])N(C)C)c1 ZINC000301245063 1123740316 /nfs/dbraw/zinc/74/03/16/1123740316.db2.gz ZRKLYZZASFFNQU-KRWDZBQOSA-N 0 3 349.818 3.972 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCc2ccc(F)c(F)c2)c(Cl)c1 ZINC000615727108 1123864839 /nfs/dbraw/zinc/86/48/39/1123864839.db2.gz PWVSLSUEMLCXKV-UHFFFAOYSA-N 0 3 326.730 3.859 20 5 EHBDHN COCCOc1cccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000163007885 1125020826 /nfs/dbraw/zinc/02/08/26/1125020826.db2.gz DTCWBNVWFBVBQQ-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN C[C@@]1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO[C@@H]1C1CC1 ZINC000543242503 1129366562 /nfs/dbraw/zinc/36/65/62/1129366562.db2.gz QWYHRVXJECBNQF-RTBURBONSA-N 0 3 342.395 3.902 20 5 EHBDHN CSc1ccc([C@@H](CNc2ncc(C)cc2[N+](=O)[O-])N(C)C)cc1 ZINC000338832540 1129378477 /nfs/dbraw/zinc/37/84/77/1129378477.db2.gz MZTLJMAYPDFKDG-MRXNPFEDSA-N 0 3 346.456 3.735 20 5 EHBDHN Cc1cccc(F)c1CN[C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000766215007 1131371035 /nfs/dbraw/zinc/37/10/35/1131371035.db2.gz AFXYPJWSJOTAIX-CYBMUJFWSA-N 0 3 345.374 3.549 20 5 EHBDHN CSc1ccc([C@@H](CNc2nc(C)ccc2[N+](=O)[O-])N(C)C)cc1 ZINC000338834597 1129397939 /nfs/dbraw/zinc/39/79/39/1129397939.db2.gz CKFZCHOMLOOADW-MRXNPFEDSA-N 0 3 346.456 3.735 20 5 EHBDHN CC[C@@H](CO)N(Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000543447883 1129494481 /nfs/dbraw/zinc/49/44/81/1129494481.db2.gz FBRUKQFIZXNOIQ-SFHVURJKSA-N 0 3 328.412 3.676 20 5 EHBDHN CC[C@H]1CCCC[C@H]1N(C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304730 1129660158 /nfs/dbraw/zinc/66/01/58/1129660158.db2.gz UJLAKCPTEFGDAT-LSDHHAIUSA-N 0 3 333.432 3.742 20 5 EHBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032643 1129764522 /nfs/dbraw/zinc/76/45/22/1129764522.db2.gz SPQUPQLHOYTZMS-HIFRSBDPSA-N 0 3 331.441 3.979 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@H]2C[C@@H](O)c2cccs2)c1 ZINC000304785580 1129902330 /nfs/dbraw/zinc/90/23/30/1129902330.db2.gz OKOPZWXTGXKPDX-GOEBONIOSA-N 0 3 332.425 3.744 20 5 EHBDHN C[C@@H]1C[C@H]2CCCC[C@H]2N1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000246107247 1130345603 /nfs/dbraw/zinc/34/56/03/1130345603.db2.gz DOGKNZKQZLWAKG-XJKCOSOUSA-N 0 3 342.399 3.798 20 5 EHBDHN C[C@H](c1cccc(Cl)c1)N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000246198435 1130356012 /nfs/dbraw/zinc/35/60/12/1130356012.db2.gz AQECGINYVMOCIP-SJKOYZFVSA-N 0 3 334.803 3.975 20 5 EHBDHN O=[N+]([O-])c1ccc2c(cnn2CN2CCCC3(CCCCC3)C2)c1 ZINC000732190678 1130892143 /nfs/dbraw/zinc/89/21/43/1130892143.db2.gz KEFBZBVKWQKYMR-UHFFFAOYSA-N 0 3 328.416 3.948 20 5 EHBDHN CCS[C@@H]1CCCCN(Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000738221954 1131464133 /nfs/dbraw/zinc/46/41/33/1131464133.db2.gz QFUGDAQOGSULIR-OAHLLOKOSA-N 0 3 334.445 3.510 20 5 EHBDHN CC(C)[C@@H]1CCCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000738237611 1131465520 /nfs/dbraw/zinc/46/55/20/1131465520.db2.gz ANAAIQWZGNLNFJ-OAHLLOKOSA-N 0 3 343.431 3.569 20 5 EHBDHN NCc1nn([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c2ccccc12 ZINC001172902125 1131885728 /nfs/dbraw/zinc/88/57/28/1131885728.db2.gz VQIHHMQTEXPCLE-OAHLLOKOSA-N 0 3 336.395 3.523 20 5 EHBDHN COc1cc(F)c(CN[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC001173216379 1132002350 /nfs/dbraw/zinc/00/23/50/1132002350.db2.gz IYUBHZIPYCHNAE-NSHDSACASA-N 0 3 336.338 3.602 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H]1COc2ccc(Cl)cc21 ZINC001173226265 1132006738 /nfs/dbraw/zinc/00/67/38/1132006738.db2.gz WRXLIIRFLWUSLI-BZNIZROVSA-N 0 3 332.787 3.903 20 5 EHBDHN O=[N+]([O-])c1ccc2c(cnn2CN(CCc2ccccc2)C2CC2)c1 ZINC000746023456 1132350778 /nfs/dbraw/zinc/35/07/78/1132350778.db2.gz VEOCYGMJQWNJRL-UHFFFAOYSA-N 0 3 336.395 3.609 20 5 EHBDHN CCc1ccccc1-c1nc(CN[C@H]2CC[C@@H](C[N+](=O)[O-])C2)cs1 ZINC001169006393 1132630198 /nfs/dbraw/zinc/63/01/98/1132630198.db2.gz HPBKZQHOBZSZBO-HIFRSBDPSA-N 0 3 345.468 3.908 20 5 EHBDHN CCOc1cc(CN2C[C@H]3C[C@@]3(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001176086170 1132830718 /nfs/dbraw/zinc/83/07/18/1132830718.db2.gz DKGPWNTXQIPIIS-XLIONFOSSA-N 0 3 338.407 3.767 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CNCCc1ccc(F)c(F)c1 ZINC000786819043 1133911234 /nfs/dbraw/zinc/91/12/34/1133911234.db2.gz NNKAORHVGSPHEH-UHFFFAOYSA-N 0 3 326.730 3.859 20 5 EHBDHN Cc1cc(N2CCCN(Cc3ccccc3)CC2)c(F)cc1[N+](=O)[O-] ZINC001184681112 1133981237 /nfs/dbraw/zinc/98/12/37/1133981237.db2.gz JYWJEDDFYOGVHI-UHFFFAOYSA-N 0 3 343.402 3.755 20 5 EHBDHN COc1ccccc1C[C@H]1CCCN1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746707733 1134038742 /nfs/dbraw/zinc/03/87/42/1134038742.db2.gz NMUMDBXPINZIEH-QGZVFWFLSA-N 0 3 344.386 3.950 20 5 EHBDHN COc1ccc(C[C@@H](C)NCc2ccc(F)cc2F)c([N+](=O)[O-])c1 ZINC001170299285 1134738419 /nfs/dbraw/zinc/73/84/19/1134738419.db2.gz UVLGQGZFZLNONE-LLVKDONJSA-N 0 3 336.338 3.602 20 5 EHBDHN COc1ccc(C[C@H](C)NC2(c3ccccc3F)CC2)c([N+](=O)[O-])c1 ZINC001170313508 1134745974 /nfs/dbraw/zinc/74/59/74/1134745974.db2.gz NOPPKRMZLZERTA-ZDUSSCGKSA-N 0 3 344.386 3.952 20 5 EHBDHN CCN(CC)[C@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804386455 1135052784 /nfs/dbraw/zinc/05/27/84/1135052784.db2.gz CHORWQKFYOVTMZ-CQSZACIVSA-N 0 3 348.359 3.591 20 5 EHBDHN CC1(C)CN(CCc2ccc([N+](=O)[O-])cc2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC001193818817 1135188412 /nfs/dbraw/zinc/18/84/12/1135188412.db2.gz JNPWWOJEOTXKPR-UWVAXJGDSA-N 0 3 344.455 3.807 20 5 EHBDHN CSc1ccccc1CN(C)CCOc1cccc([N+](=O)[O-])c1 ZINC001193977157 1135209479 /nfs/dbraw/zinc/20/94/79/1135209479.db2.gz OTHXZDJJTSFJIV-UHFFFAOYSA-N 0 3 332.425 3.828 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2cnn(CN3CCC[C@H](C4CC4)C3)c2)c1 ZINC000808230092 1135633276 /nfs/dbraw/zinc/63/32/76/1135633276.db2.gz GWRPIHXARIERKT-INIZCTEOSA-N 0 3 326.400 3.538 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(CC[C@H](O)c2ccccc2)C2CC2)cc1 ZINC000808741825 1135734468 /nfs/dbraw/zinc/73/44/68/1135734468.db2.gz QGAHWVXDGVMNBI-IBGZPJMESA-N 0 3 326.396 3.683 20 5 EHBDHN Cc1c(CN2CCC[C@H](Cc3nccs3)C2)cccc1[N+](=O)[O-] ZINC001197921397 1135751082 /nfs/dbraw/zinc/75/10/82/1135751082.db2.gz SGZUWGYNFUVWLU-CQSZACIVSA-N 0 3 331.441 3.814 20 5 EHBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809689163 1135872045 /nfs/dbraw/zinc/87/20/45/1135872045.db2.gz WBORULAPNJYXGD-UHFFFAOYSA-N 0 3 349.774 3.831 20 5 EHBDHN Cc1ccc([C@@H](O)[C@H](C)NCc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809701711 1135874274 /nfs/dbraw/zinc/87/42/74/1135874274.db2.gz JCOUALUGGMOFFB-SJCJKPOMSA-N 0 3 334.803 3.768 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@@H](Cn1ccnc1)C(C)(C)C ZINC000850424806 1136256578 /nfs/dbraw/zinc/25/65/78/1136256578.db2.gz HMQWRFRQCMUZLW-DYVFJYSZSA-N 0 3 346.431 3.565 20 5 EHBDHN CC(COC(=O)c1ccc(Oc2ccccc2Cl)cc1)[N+](=O)[O-] ZINC000813102769 1136288147 /nfs/dbraw/zinc/28/81/47/1136288147.db2.gz VBJMPSFUKBXDJC-NSHDSACASA-N 0 3 335.743 3.954 20 5 EHBDHN C[C@@H]1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000776589716 1136453021 /nfs/dbraw/zinc/45/30/21/1136453021.db2.gz VUPNDISZUILLIL-XOKHGSTOSA-N 0 3 330.384 3.694 20 5 EHBDHN C[C@@H]1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccco2)C1 ZINC000776589714 1136453096 /nfs/dbraw/zinc/45/30/96/1136453096.db2.gz VUPNDISZUILLIL-KBRIMQKVSA-N 0 3 330.384 3.694 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC(c3cccc(F)c3)CC2)cc1 ZINC000776593614 1136454137 /nfs/dbraw/zinc/45/41/37/1136454137.db2.gz YRWYPEIJGNOSGK-LJQANCHMSA-N 0 3 344.386 3.647 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN(Cc2ccccc2F)CC2CC2)cc1 ZINC000852564659 1136467078 /nfs/dbraw/zinc/46/70/78/1136467078.db2.gz QKYAILTVSXPKSQ-IBGZPJMESA-N 0 3 344.386 3.680 20 5 EHBDHN CC([C@@H](OC(=O)c1coc(C(F)F)c1)c1ccccc1F)[N+](=O)[O-] ZINC000860854648 1137081198 /nfs/dbraw/zinc/08/11/98/1137081198.db2.gz FMSREQZVMVLMGU-ISVAXAHUSA-N 0 3 343.257 3.920 20 5 EHBDHN CC(C)(C)[C@@H]1CCCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000794706722 1137239762 /nfs/dbraw/zinc/23/97/62/1137239762.db2.gz WABVWJFZHJLYHW-OAHLLOKOSA-N 0 3 343.431 3.569 20 5 EHBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCc1cccnc1F ZINC000794826174 1137264727 /nfs/dbraw/zinc/26/47/27/1137264727.db2.gz AOKVVWRMXBWMDX-CYBMUJFWSA-N 0 3 335.404 3.789 20 5 EHBDHN Cc1ccc([C@H](C)C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845878867 1137316685 /nfs/dbraw/zinc/31/66/85/1137316685.db2.gz TYNLTHOWGYHTQJ-HWWQOWPSSA-N 0 3 335.331 3.780 20 5 EHBDHN CSCCCCC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881444 1137316724 /nfs/dbraw/zinc/31/67/24/1137316724.db2.gz ZTCMPFOSWJGHPN-NHYWBVRUSA-N 0 3 329.393 3.609 20 5 EHBDHN C[C@H](NCc1ccc(C2(C)OCCO2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000866421155 1137353252 /nfs/dbraw/zinc/35/32/52/1137353252.db2.gz MQEKZGPAYWBGGE-AWEZNQCLSA-N 0 3 342.395 3.665 20 5 EHBDHN CC[C@H](C[C@@H](C)O)N[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000866635268 1137371561 /nfs/dbraw/zinc/37/15/61/1137371561.db2.gz OJXSGBHXYIOVLJ-LSBZLQRGSA-N 0 3 328.412 3.823 20 5 EHBDHN CC[C@H](C[C@H](C)O)N[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000866635269 1137371765 /nfs/dbraw/zinc/37/17/65/1137371765.db2.gz OJXSGBHXYIOVLJ-POZUXBRTSA-N 0 3 328.412 3.823 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](c1ccco1)N(C)C ZINC000872018792 1137564829 /nfs/dbraw/zinc/56/48/29/1137564829.db2.gz PPHUCPMLPOTHPX-DOMZBBRYSA-N 0 3 349.456 3.863 20 5 EHBDHN CC(C)[C@@H](CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccnn1C ZINC000872064421 1137569141 /nfs/dbraw/zinc/56/91/41/1137569141.db2.gz GNWYGNZHBOYHNH-QWHCGFSZSA-N 0 3 334.395 3.558 20 5 EHBDHN C[C@H](N[C@@H]1CCC[C@H]1Cc1cnn(C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086093 1137570404 /nfs/dbraw/zinc/57/04/04/1137570404.db2.gz ROGMRUUJTJJONV-DUVNUKRYSA-N 0 3 346.406 3.529 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCc1ccc(C(C)(C)O)cc1 ZINC000873108557 1137590363 /nfs/dbraw/zinc/59/03/63/1137590363.db2.gz NERXDWDSVKFKNS-UHFFFAOYSA-N 0 3 328.412 3.729 20 5 EHBDHN Cc1c(CNC[C@H](O)c2cc(F)cc(Cl)c2)cccc1[N+](=O)[O-] ZINC000873116213 1137590572 /nfs/dbraw/zinc/59/05/72/1137590572.db2.gz YINXKXNGZLCSGF-INIZCTEOSA-N 0 3 338.766 3.519 20 5 EHBDHN Cc1ccnc(C2CCN(Cc3c(C)ccc([N+](=O)[O-])c3C)CC2)n1 ZINC000877331458 1137674562 /nfs/dbraw/zinc/67/45/62/1137674562.db2.gz PFBNSKIOBRUONJ-UHFFFAOYSA-N 0 3 340.427 3.690 20 5 EHBDHN C[C@H]1CCC[C@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966241 1137697468 /nfs/dbraw/zinc/69/74/68/1137697468.db2.gz DXQYDBVYFMXNAO-STQMWFEESA-N 0 3 330.388 3.655 20 5 EHBDHN O=[N+]([O-])c1ccc(OC2CCN(C[C@H]3CCC4(CCC4)O3)CC2)cc1 ZINC000878148260 1137704447 /nfs/dbraw/zinc/70/44/47/1137704447.db2.gz FXGRXUUQUGJNBL-GOSISDBHSA-N 0 3 346.427 3.540 20 5 EHBDHN CC(C)(C)[C@H]1CCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878406065 1137714547 /nfs/dbraw/zinc/71/45/47/1137714547.db2.gz YFSPLCRPBKMDNU-LBPRGKRZSA-N 0 3 330.388 3.513 20 5 EHBDHN C[C@@H]1CCC[C@H]1NCc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878507749 1137718450 /nfs/dbraw/zinc/71/84/50/1137718450.db2.gz JPBFLDWDBDHSSH-BXKDBHETSA-N 0 3 336.779 3.576 20 5 EHBDHN CC[C@@H](C)N(CC)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878885155 1137730948 /nfs/dbraw/zinc/73/09/48/1137730948.db2.gz XYEURDQGVFLDIU-SNVBAGLBSA-N 0 3 338.795 3.919 20 5 EHBDHN CN(C)C[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000282915560 1137952019 /nfs/dbraw/zinc/95/20/19/1137952019.db2.gz VKQITJVTLWLCER-KRWDZBQOSA-N 0 3 333.819 3.641 20 5 EHBDHN Cc1c([C@H](C)NCc2ccc(F)c(CN(C)C)c2)cccc1[N+](=O)[O-] ZINC000120911033 1137953500 /nfs/dbraw/zinc/95/35/00/1137953500.db2.gz HLIHLVNFQSVONP-AWEZNQCLSA-N 0 3 345.418 3.955 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 ZINC000134777134 1137960792 /nfs/dbraw/zinc/96/07/92/1137960792.db2.gz BVODMWWGHIFQFK-MJGOQNOKSA-N 0 3 344.386 3.822 20 5 EHBDHN CN(CCOCC1CC1)Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000088600182 1138194865 /nfs/dbraw/zinc/19/48/65/1138194865.db2.gz GQENHKNIGFENPF-UHFFFAOYSA-N 0 3 337.419 3.805 20 5 EHBDHN CCCCNC(=O)C1CCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000182590408 1139981738 /nfs/dbraw/zinc/98/17/38/1139981738.db2.gz APLUHPKJACTXSL-HNNXBMFYSA-N 0 3 347.459 3.593 20 5 EHBDHN Cc1ccc([C@@H](C)NCc2ccc(C(C)(C)O)cc2)cc1[N+](=O)[O-] ZINC000186617368 1140213281 /nfs/dbraw/zinc/21/32/81/1140213281.db2.gz OCXWBTMQYISGIV-CQSZACIVSA-N 0 3 328.412 3.981 20 5 EHBDHN Cc1c([C@@H](C)NCc2ccc(C(C)(C)O)cc2)cccc1[N+](=O)[O-] ZINC000186618036 1140213500 /nfs/dbraw/zinc/21/35/00/1140213500.db2.gz ZZZDBRBFGLDSDL-CQSZACIVSA-N 0 3 328.412 3.981 20 5 EHBDHN C[C@@H]1C[C@H](N(C)c2ncc([N+](=O)[O-])s2)CCN1Cc1ccccc1 ZINC000192460141 1140534625 /nfs/dbraw/zinc/53/46/25/1140534625.db2.gz BFEMBQSIUVIRLB-UKRRQHHQSA-N 0 3 346.456 3.541 20 5 EHBDHN Cc1ccc(NC2CCN([C@H](C)c3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000269928376 1141158690 /nfs/dbraw/zinc/15/86/90/1141158690.db2.gz MMGFFCICUKZIMP-OAHLLOKOSA-N 0 3 340.427 3.936 20 5 EHBDHN COc1cc(CN(C)[C@@H]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575523 1141522132 /nfs/dbraw/zinc/52/21/32/1141522132.db2.gz VOGCUFNGAHPJMZ-ZYHUDNBSSA-N 0 3 344.358 3.825 20 5 EHBDHN CC1(C)CN(Cc2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000078516558 217066681 /nfs/dbraw/zinc/06/66/81/217066681.db2.gz AGMWKGHXXGGZPD-UHFFFAOYSA-N 0 3 339.439 3.691 20 5 EHBDHN CC(C)[C@H](NCc1c(Cl)cccc1[N+](=O)[O-])C1(CO)CCC1 ZINC000339727274 1015608958 /nfs/dbraw/zinc/60/89/58/1015608958.db2.gz JVLDCZPXCUNRPF-HNNXBMFYSA-N 0 3 326.824 3.525 20 5 EHBDHN CCOc1cc(NC[C@H](c2ccc(F)cc2)N(C)C)ccc1[N+](=O)[O-] ZINC000471252407 1016131144 /nfs/dbraw/zinc/13/11/44/1016131144.db2.gz YGVQEQWFLDLHFB-QGZVFWFLSA-N 0 3 347.390 3.847 20 5 EHBDHN CCOCOc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000782952646 1016833620 /nfs/dbraw/zinc/83/36/20/1016833620.db2.gz NEQFRLVSDYOGKV-AWEZNQCLSA-N 0 3 330.384 3.818 20 5 EHBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCc1ccc(F)cn1 ZINC000349207506 1016925536 /nfs/dbraw/zinc/92/55/36/1016925536.db2.gz HUXNSPYEGDJWIM-ZDUSSCGKSA-N 0 3 335.404 3.789 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CNC1(c2ccc3c(c2)OCO3)CC1 ZINC000538423816 1032350292 /nfs/dbraw/zinc/35/02/92/1032350292.db2.gz RBTYAUZQDUPLJL-HYXAFXHYSA-N 0 3 338.363 3.616 20 5 EHBDHN CC(C)[C@@H](O)C1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000537383791 1032680979 /nfs/dbraw/zinc/68/09/79/1032680979.db2.gz NXQAHEKGGSTRBM-GOSISDBHSA-N 0 3 344.411 3.742 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(OC[C@H]2CCCO2)CC1 ZINC000182836748 1019767344 /nfs/dbraw/zinc/76/73/44/1019767344.db2.gz KXJFCBPAKCLCPR-CRAIPNDOSA-N 0 3 348.443 3.624 20 5 EHBDHN CO[C@@H]([C@@H](C)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000449627036 1032923489 /nfs/dbraw/zinc/92/34/89/1032923489.db2.gz FOKDNRWCYAKQKN-XIKOKIGWSA-N 0 3 330.384 3.758 20 5 EHBDHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000610516014 1021174871 /nfs/dbraw/zinc/17/48/71/1021174871.db2.gz VJHPYSSOWHHLOI-DZGCQCFKSA-N 0 3 331.441 3.979 20 5 EHBDHN CCS[C@H]1CCC[C@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602567661 1032977612 /nfs/dbraw/zinc/97/76/12/1032977612.db2.gz KUHCFNCHZQNZDN-AAEUAGOBSA-N 0 3 335.429 3.890 20 5 EHBDHN COc1cc(CN2CC(C)(C)[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000516670757 1021638888 /nfs/dbraw/zinc/63/88/88/1021638888.db2.gz RHBUNVPQVBMEIP-UONOGXRCSA-N 0 3 334.416 3.623 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[C@@]2(C1)CCCOC2 ZINC000602651341 1033041129 /nfs/dbraw/zinc/04/11/29/1033041129.db2.gz HEHDOBKMWJQISD-OAHLLOKOSA-N 0 3 344.333 3.616 20 5 EHBDHN CCOc1ccc([C@@H](C)NCCOc2ccccc2)cc1[N+](=O)[O-] ZINC000152585474 1033059758 /nfs/dbraw/zinc/05/97/58/1033059758.db2.gz FWZJVONGYHPSHT-CQSZACIVSA-N 0 3 330.384 3.723 20 5 EHBDHN Cc1ccc([C@H](C)NCC(=O)Nc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000610831081 1023781589 /nfs/dbraw/zinc/78/15/89/1023781589.db2.gz WYWCGVFOHRYAFX-AWEZNQCLSA-N 0 3 327.384 3.501 20 5 EHBDHN CCCn1ccnc1CCCN(C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000277247226 1024327295 /nfs/dbraw/zinc/32/72/95/1024327295.db2.gz PYUYPHVJQZWDDH-HNNXBMFYSA-N 0 3 330.432 3.827 20 5 EHBDHN CCN(CC)[C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000434953033 1024523725 /nfs/dbraw/zinc/52/37/25/1024523725.db2.gz YHGOYIGCBSGTRN-CYBMUJFWSA-N 0 3 338.795 3.731 20 5 EHBDHN CCOc1ccccc1[C@@H](CC(C)C)NCCn1cc([N+](=O)[O-])cn1 ZINC000342246462 1024544119 /nfs/dbraw/zinc/54/41/19/1024544119.db2.gz RNLIXXPZDCGKNL-QGZVFWFLSA-N 0 3 346.431 3.567 20 5 EHBDHN O=[N+]([O-])c1cccc(CCN[C@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000519197266 1024574479 /nfs/dbraw/zinc/57/44/79/1024574479.db2.gz AHFFVKJBPQCCOM-KRWDZBQOSA-N 0 3 328.416 3.772 20 5 EHBDHN CC(C)c1ccc(CN2CCC[C@@](CO)(C(C)C)C2)cc1[N+](=O)[O-] ZINC000521083816 1025193273 /nfs/dbraw/zinc/19/32/73/1025193273.db2.gz XCKFYDNRMLBWTC-LJQANCHMSA-N 0 3 334.460 3.949 20 5 EHBDHN C[C@H](CNc1ccc(F)cc1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000521402550 1025370904 /nfs/dbraw/zinc/37/09/04/1025370904.db2.gz POBDRATUUDVHJT-CYBMUJFWSA-N 0 3 329.375 3.593 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1ccc(Cn2ccnc2)cc1 ZINC000521460597 1025397131 /nfs/dbraw/zinc/39/71/31/1025397131.db2.gz GJJMWARHYMZHKT-LJQANCHMSA-N 0 3 348.406 3.617 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC2(CCOCc3ccccc3)CC2)c(F)c1 ZINC000478200242 1026021644 /nfs/dbraw/zinc/02/16/44/1026021644.db2.gz SYHXZGKJVZQAAT-UHFFFAOYSA-N 0 3 344.386 3.963 20 5 EHBDHN CN(Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCN(c2ccccc2)C1 ZINC000531378679 1026849014 /nfs/dbraw/zinc/84/90/14/1026849014.db2.gz WWKMICAQNCWYCF-GOSISDBHSA-N 0 3 325.412 3.696 20 5 EHBDHN Cc1cc(N)cc(CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000423487877 1028478030 /nfs/dbraw/zinc/47/80/30/1028478030.db2.gz YAIRJCYASZRPIT-SFHVURJKSA-N 0 3 325.412 3.998 20 5 EHBDHN Cc1cccc(CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000237636862 1028659124 /nfs/dbraw/zinc/65/91/24/1028659124.db2.gz MGTHGHRXYPRBSC-UHFFFAOYSA-N 0 3 336.395 3.594 20 5 EHBDHN CCC1CCC(N(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000533310033 1029592177 /nfs/dbraw/zinc/59/21/77/1029592177.db2.gz GJYFQBLBUSDKRC-UHFFFAOYSA-N 0 3 333.432 3.742 20 5 EHBDHN CN(C)C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000583574589 1030169303 /nfs/dbraw/zinc/16/93/03/1030169303.db2.gz DPBUGARPYHYUIA-MSOLQXFVSA-N 0 3 343.402 3.614 20 5 EHBDHN CC(C)C[C@]1(CO)CCCN1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000475691254 1030587721 /nfs/dbraw/zinc/58/77/21/1030587721.db2.gz GHNMILYFGPUNRQ-INIZCTEOSA-N 0 3 326.824 3.621 20 5 EHBDHN C[C@@H]1CCCC[C@@H]1N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623393 1030793572 /nfs/dbraw/zinc/79/35/72/1030793572.db2.gz AFUFJFGCNGIEKP-ABAIWWIYSA-N 0 3 339.823 3.697 20 5 EHBDHN Cc1cccc(NC(=O)C[C@@H](C)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000584147721 1031813365 /nfs/dbraw/zinc/81/33/65/1031813365.db2.gz ZCPSCFFHVJPXBP-CQSZACIVSA-N 0 3 341.411 3.719 20 5 EHBDHN CCS[C@@H]1CC[C@@H](N(C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485937 1033367163 /nfs/dbraw/zinc/36/71/63/1033367163.db2.gz TZRWEYUWGDVNRN-UKRRQHHQSA-N 0 3 334.445 3.508 20 5 EHBDHN CCOc1cccc(N(C)CCCN(C)Cc2ccco2)c1[N+](=O)[O-] ZINC000343806232 1033450936 /nfs/dbraw/zinc/45/09/36/1033450936.db2.gz KIZCGKUKOJAAQF-UHFFFAOYSA-N 0 3 347.415 3.545 20 5 EHBDHN COc1ccc(C2CCN(Cc3ccc([N+](=O)[O-])cc3C)CC2)nc1 ZINC000593645677 1033574100 /nfs/dbraw/zinc/57/41/00/1033574100.db2.gz XUWSVDHJLGBWJB-UHFFFAOYSA-N 0 3 341.411 3.686 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](c1cccs1)N(C)C ZINC000595002905 1033627239 /nfs/dbraw/zinc/62/72/39/1033627239.db2.gz BEKHWQSRNHYPAX-SWLSCSKDSA-N 0 3 349.456 3.618 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](C)c1ncc(C)s1 ZINC000595034324 1033655804 /nfs/dbraw/zinc/65/58/04/1033655804.db2.gz VGFYUMZYGMYGBS-CMPLNLGQSA-N 0 3 335.429 3.823 20 5 EHBDHN C[C@H](c1ccc(F)c(F)c1)N(C)CCOc1ccccc1[N+](=O)[O-] ZINC000603841252 1033964696 /nfs/dbraw/zinc/96/46/96/1033964696.db2.gz ZRQVWDSMAGYQGP-GFCCVEGCSA-N 0 3 336.338 3.945 20 5 EHBDHN COc1ccccc1[C@H]1CCCN1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609040696 1033991247 /nfs/dbraw/zinc/99/12/47/1033991247.db2.gz KHHBTPGEDQCPMW-GOSISDBHSA-N 0 3 342.395 3.819 20 5 EHBDHN CCC(O)(CC)CN(C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000599673656 1034081117 /nfs/dbraw/zinc/08/11/17/1034081117.db2.gz SOJZJAPTJYMONA-UHFFFAOYSA-N 0 3 334.338 3.597 20 5 EHBDHN C[C@@H]1c2ccsc2CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411147586 1034791500 /nfs/dbraw/zinc/79/15/00/1034791500.db2.gz PLAMBMCJPROTFC-GFCCVEGCSA-N 0 3 345.424 3.604 20 5 EHBDHN Cc1c(F)cccc1NC(=O)CCN[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000411484152 1034899586 /nfs/dbraw/zinc/89/95/86/1034899586.db2.gz OOSZLAHEYFEIAL-CYBMUJFWSA-N 0 3 345.374 3.722 20 5 EHBDHN COc1ccc(CN[C@@H](C)[C@@H](OC)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271973788 1035578083 /nfs/dbraw/zinc/57/80/83/1035578083.db2.gz ICKBADDEYGPDSH-KPZWWZAWSA-N 0 3 348.374 3.608 20 5 EHBDHN CCO[C@H]1C[C@@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000414153272 1035801032 /nfs/dbraw/zinc/80/10/32/1035801032.db2.gz ZBLQSUIHUACVBM-NZSAHSFTSA-N 0 3 326.396 3.841 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@@H]2c2cccnc2)cc1 ZINC000588203882 1035821847 /nfs/dbraw/zinc/82/18/47/1035821847.db2.gz MQKPJKMNLNSHDR-GOSISDBHSA-N 0 3 327.384 3.596 20 5 EHBDHN CCC(CC)N(CC)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000588977253 1036207080 /nfs/dbraw/zinc/20/70/80/1036207080.db2.gz FKYKSFNBPQIAMK-UHFFFAOYSA-N 0 3 327.812 3.697 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@@H]1C1CCCCC1 ZINC000165264700 1036351320 /nfs/dbraw/zinc/35/13/20/1036351320.db2.gz YMWYAQLXUIJUPY-MRXNPFEDSA-N 0 3 345.443 3.886 20 5 EHBDHN Cc1ccc(CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000237783858 1037177836 /nfs/dbraw/zinc/17/78/36/1037177836.db2.gz BHQLQNRPSGLSHO-UHFFFAOYSA-N 0 3 336.395 3.594 20 5 EHBDHN CO[C@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000493308451 1037242971 /nfs/dbraw/zinc/24/29/71/1037242971.db2.gz YPFXHIWGHXBHSG-RTBURBONSA-N 0 3 328.412 3.945 20 5 EHBDHN CC[C@@H](O)CN(C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850728 1037280321 /nfs/dbraw/zinc/28/03/21/1037280321.db2.gz OVBWTWHPUMFJCJ-KEEQEYLASA-N 0 3 340.423 3.881 20 5 EHBDHN O=[N+]([O-])c1ncccc1S[C@H]1CCCN(Cc2ccccc2)C1 ZINC000591827501 1037639584 /nfs/dbraw/zinc/63/95/84/1037639584.db2.gz QHVBNVTWFAGDFM-HNNXBMFYSA-N 0 3 329.425 3.747 20 5 EHBDHN C[C@@H]1CC(C)(C)CC[C@@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000481111346 1038112899 /nfs/dbraw/zinc/11/28/99/1038112899.db2.gz OUIJSUANTCOZSD-DOMZBBRYSA-N 0 3 344.415 3.949 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@@H](Nc3ccccc3)C2)c1 ZINC000490038759 1040306014 /nfs/dbraw/zinc/30/60/14/1040306014.db2.gz AEFIMTHKCRHYSB-QGZVFWFLSA-N 0 3 341.411 3.550 20 5 EHBDHN CC[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CC1(C)C ZINC000419313683 1041249172 /nfs/dbraw/zinc/24/91/72/1041249172.db2.gz GNHFZXJFHWBANZ-UONOGXRCSA-N 0 3 330.388 3.559 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC(OC3CCCCC3)CC2)cc1 ZINC000125432765 1042085025 /nfs/dbraw/zinc/08/50/25/1042085025.db2.gz ADBMHSVKKWKDBC-UHFFFAOYSA-N 0 3 348.443 3.787 20 5 EHBDHN COc1ccccc1[C@H]1CCN(Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000093593192 1042376714 /nfs/dbraw/zinc/37/67/14/1042376714.db2.gz PTUAHWYBLSWISY-INIZCTEOSA-N 0 3 326.396 3.901 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1F ZINC000291235462 1042789851 /nfs/dbraw/zinc/78/98/51/1042789851.db2.gz UMBLVXLIQURAOC-LESCRADOSA-N 0 3 336.407 3.640 20 5 EHBDHN CC1(C)C[C@@H](NCc2cccc(CO)c2)c2cc([N+](=O)[O-])ccc21 ZINC000279006171 1043172658 /nfs/dbraw/zinc/17/26/58/1043172658.db2.gz GJCOPDRRXXCZSI-GOSISDBHSA-N 0 3 326.396 3.599 20 5 EHBDHN C[C@H]1CCC[C@@H](N(C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898517 1043598456 /nfs/dbraw/zinc/59/84/56/1043598456.db2.gz YMKUBPLKMLTKQD-KBXCAEBGSA-N 0 3 328.416 3.926 20 5 EHBDHN Cc1cccc([C@@H](C)NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1C ZINC000183720547 1125742144 /nfs/dbraw/zinc/74/21/44/1125742144.db2.gz FJBVPPFXFNFFMM-OAHLLOKOSA-N 0 3 341.411 3.809 20 5 EHBDHN CCS[C@H]1CC[C@@H](N(C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039956 1127568707 /nfs/dbraw/zinc/56/87/07/1127568707.db2.gz USRGYCZPIAHOLJ-HIFRSBDPSA-N 0 3 348.472 3.816 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(N[C@@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000301479812 1128468219 /nfs/dbraw/zinc/46/82/19/1128468219.db2.gz NQIWRUHVONMVPK-MRXNPFEDSA-N 0 3 341.411 3.680 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@H]2CCN2Cc2ccccc2)c2ncccc12 ZINC000715715949 1128810621 /nfs/dbraw/zinc/81/06/21/1128810621.db2.gz VESHJPTWEKZESQ-MRXNPFEDSA-N 0 3 348.406 3.829 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@@H](O)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000153114426 1120691060 /nfs/dbraw/zinc/69/10/60/1120691060.db2.gz MDSPIIGBWVPNLZ-KBXCAEBGSA-N 0 3 344.411 3.686 20 5 EHBDHN COc1cccc([C@@H](CNc2ccccc2[N+](=O)[O-])N2CCCC2)c1 ZINC000301055712 1121196397 /nfs/dbraw/zinc/19/63/97/1121196397.db2.gz GXQPEDIZPBUENL-LJQANCHMSA-N 0 3 341.411 3.852 20 5 EHBDHN C[C@H]1c2ccccc2CCN1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609315893 1123374525 /nfs/dbraw/zinc/37/45/25/1123374525.db2.gz IQSGGOIHQPGAQQ-HNNXBMFYSA-N 0 3 326.396 3.983 20 5 EHBDHN CC(C)[C@H]1CCCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000609631909 1123635124 /nfs/dbraw/zinc/63/51/24/1123635124.db2.gz MUMZMQFNIXYZOR-AWEZNQCLSA-N 0 3 334.416 3.719 20 5 EHBDHN CC(C)[C@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1F ZINC000180259793 1123976001 /nfs/dbraw/zinc/97/60/01/1123976001.db2.gz LHXTYGLUOGMRDI-HNNXBMFYSA-N 0 3 340.786 3.571 20 5 EHBDHN Cc1c(CN[C@H](C)c2ccc(-n3cccn3)cc2)cccc1[N+](=O)[O-] ZINC000180842591 1124088262 /nfs/dbraw/zinc/08/82/62/1124088262.db2.gz LBTLDTQGFSCRRS-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)CC1CCCC1 ZINC000069227757 1124538503 /nfs/dbraw/zinc/53/85/03/1124538503.db2.gz LYOBQJFISICCKL-NSHDSACASA-N 0 3 339.823 3.697 20 5 EHBDHN COCCOc1ccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000080346885 1129348033 /nfs/dbraw/zinc/34/80/33/1129348033.db2.gz YQCZRMSFKNAALL-UHFFFAOYSA-N 0 3 344.411 3.645 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@@H](CO)CC2CCCC2)c(Cl)c1 ZINC000466409870 1129428854 /nfs/dbraw/zinc/42/88/54/1129428854.db2.gz OZWZKCXUNSKJDW-ZDUSSCGKSA-N 0 3 326.824 3.527 20 5 EHBDHN Cc1cc(NC[C@@H]2CSCCS2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302078302 1129766581 /nfs/dbraw/zinc/76/65/81/1129766581.db2.gz KGDBNUGCNYYVOW-GFCCVEGCSA-N 0 3 335.454 3.712 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](N[C@H]2CC[C@H](O)CC2)c2ccccc2)c1 ZINC000305787572 1129926945 /nfs/dbraw/zinc/92/69/45/1129926945.db2.gz AGISXRQMLBWLBP-BHIYHBOVSA-N 0 3 326.396 3.577 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CNCc2cc(Cl)cc(Cl)c2)cc1 ZINC000731677876 1130831879 /nfs/dbraw/zinc/83/18/79/1130831879.db2.gz ARUZMUDEFVKSSN-OAHLLOKOSA-N 0 3 341.194 3.725 20 5 EHBDHN CC(=O)[C@H](N[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172901827 1131885409 /nfs/dbraw/zinc/88/54/09/1131885409.db2.gz PRNYAYTUACMKCI-QUCCMNQESA-N 0 3 338.407 3.762 20 5 EHBDHN COc1c(F)cc(F)cc1CN[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173216548 1132002006 /nfs/dbraw/zinc/00/20/06/1132002006.db2.gz LWMQYOAHBIACSY-LLVKDONJSA-N 0 3 336.338 3.602 20 5 EHBDHN COc1cccc(OC)c1[C@H](C)N[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173216590 1132002017 /nfs/dbraw/zinc/00/20/17/1132002017.db2.gz DHFXXHQZBMWDEE-KBPBESRZSA-N 0 3 344.411 3.894 20 5 EHBDHN NCc1ccc2c(n1)N(c1cc(Cl)ccc1/C=C/[N+](=O)[O-])CCC2 ZINC001169590711 1132790142 /nfs/dbraw/zinc/79/01/42/1132790142.db2.gz LHGUGGYUGIZVND-VQHVLOKHSA-N 0 3 344.802 3.525 20 5 EHBDHN CCOc1cc(CN2C[C@@H]3C[C@]3(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001176086168 1132830824 /nfs/dbraw/zinc/83/08/24/1132830824.db2.gz DKGPWNTXQIPIIS-FXAWDEMLSA-N 0 3 338.407 3.767 20 5 EHBDHN CCC[C@@H](C)[C@H]1CCCN1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765167 1133049816 /nfs/dbraw/zinc/04/98/16/1133049816.db2.gz KHOHLPBIUORPEB-GDBMZVCRSA-N 0 3 343.431 3.711 20 5 EHBDHN CCC[C@H](C)[C@H]1CCCN1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765169 1133050444 /nfs/dbraw/zinc/05/04/44/1133050444.db2.gz KHOHLPBIUORPEB-GOEBONIOSA-N 0 3 343.431 3.711 20 5 EHBDHN CON(C)C(=O)CNCc1c2ccccc2c(Cl)c2ccccc21 ZINC001179555176 1133261438 /nfs/dbraw/zinc/26/14/38/1133261438.db2.gz SGZXMDYPBHWQPD-UHFFFAOYSA-N 0 3 342.826 3.756 20 5 EHBDHN Cc1ccc([C@H](C)NCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000774843534 1134052117 /nfs/dbraw/zinc/05/21/17/1134052117.db2.gz JVHLVERDDRGUSQ-LBPRGKRZSA-N 0 3 347.802 3.846 20 5 EHBDHN CO[C@H](c1ccccc1F)[C@H](C)N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788688724 1134157524 /nfs/dbraw/zinc/15/75/24/1134157524.db2.gz GTQQPQPTWQVQQF-SOZUMNATSA-N 0 3 347.390 3.743 20 5 EHBDHN COC[C@H](Cc1ccccc1)N(C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000789584986 1134298781 /nfs/dbraw/zinc/29/87/81/1134298781.db2.gz UKPYNFTYIXXTTK-INIZCTEOSA-N 0 3 348.830 3.938 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CC[C@@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329027 1134749416 /nfs/dbraw/zinc/74/94/16/1134749416.db2.gz NGJAINQNLUDCDD-IAQYHMDHSA-N 0 3 346.349 3.604 20 5 EHBDHN COc1ccc(CN[C@H](C)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-] ZINC001192814508 1135058098 /nfs/dbraw/zinc/05/80/98/1135058098.db2.gz NYLISFWTDXSMOQ-CYBMUJFWSA-N 0 3 326.396 3.943 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCOCC(F)(F)F)o2)cc1 ZINC001199094055 1135880746 /nfs/dbraw/zinc/88/07/46/1135880746.db2.gz UPABSJDBVPPGDA-UHFFFAOYSA-N 0 3 344.289 3.523 20 5 EHBDHN CCC[C@@H](CCO)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811481853 1136091634 /nfs/dbraw/zinc/09/16/34/1136091634.db2.gz OMPYTPXBSUOJET-JTQLQIEISA-N 0 3 335.231 3.790 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC1(O)CCCCC1 ZINC000811477425 1136096533 /nfs/dbraw/zinc/09/65/33/1136096533.db2.gz RBOZKEIOUNIUDJ-UHFFFAOYSA-N 0 3 333.215 3.686 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H](O)c1cc(C)cc(C)c1 ZINC000850467730 1136265025 /nfs/dbraw/zinc/26/50/25/1136265025.db2.gz SDVRDHLYEJMZIW-KBXCAEBGSA-N 0 3 344.411 3.604 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@]1(C)CC1(Cl)Cl ZINC000850472522 1136265977 /nfs/dbraw/zinc/26/59/77/1136265977.db2.gz JCLSFXVHPCWKSN-ZANVPECISA-N 0 3 333.215 3.838 20 5 EHBDHN CC(COC(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1)[N+](=O)[O-] ZINC000813104017 1136288188 /nfs/dbraw/zinc/28/81/88/1136288188.db2.gz WHKYUKHIAJPRJF-FRRDWIJNSA-N 0 3 346.408 3.555 20 5 EHBDHN CC(COC(=O)[C@@H](Sc1ccccc1)c1ccccc1)[N+](=O)[O-] ZINC000813105237 1136293933 /nfs/dbraw/zinc/29/39/33/1136293933.db2.gz XBDQMQCCJZWMTF-CJNGLKHVSA-N 0 3 331.393 3.728 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776591251 1136450984 /nfs/dbraw/zinc/45/09/84/1136450984.db2.gz IETFKUXXOIPIBY-RBUKOAKNSA-N 0 3 344.386 3.995 20 5 EHBDHN CC(C)Oc1cccc(CN(C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776592919 1136453734 /nfs/dbraw/zinc/45/37/34/1136453734.db2.gz CTCZAAZTWCOHGM-IBGZPJMESA-N 0 3 344.411 3.547 20 5 EHBDHN CC(C)Oc1ccccc1[C@H](C)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776606608 1136470330 /nfs/dbraw/zinc/47/03/30/1136470330.db2.gz YJSCDWIOZNNSBX-KSSFIOAISA-N 0 3 344.411 3.766 20 5 EHBDHN C[C@@H](NC[C@@H]1COC2(CCC(C)CC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776740095 1136619979 /nfs/dbraw/zinc/61/99/79/1136619979.db2.gz IEXHTURWYJIJHP-KJUJZPGYSA-N 0 3 334.416 3.567 20 5 EHBDHN Cc1nn(CN2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000776774784 1136661240 /nfs/dbraw/zinc/66/12/40/1136661240.db2.gz OKJBUSBDADPSKT-RCCFBDPRSA-N 0 3 340.427 3.715 20 5 EHBDHN Cc1c(F)nccc1CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000862386280 1137141951 /nfs/dbraw/zinc/14/19/51/1137141951.db2.gz NWOGDGWHAHFELY-MRXNPFEDSA-N 0 3 329.375 3.817 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCC[C@@H]1CCOC1 ZINC000825144149 1137167276 /nfs/dbraw/zinc/16/72/76/1137167276.db2.gz LUYZFUDFWAPOOG-SNVBAGLBSA-N 0 3 333.215 3.808 20 5 EHBDHN COC[C@@H](C)Oc1ccc(CNCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000865787711 1137311987 /nfs/dbraw/zinc/31/19/87/1137311987.db2.gz RLQXSWOEUWGMFO-OAHLLOKOSA-N 0 3 344.411 3.607 20 5 EHBDHN CC(C)(CNCc1cc([N+](=O)[O-])ccc1OC(F)F)C(C)(F)F ZINC000865789972 1137312147 /nfs/dbraw/zinc/31/21/47/1137312147.db2.gz CKUSPQQKJGDLFM-UHFFFAOYSA-N 0 3 338.301 3.967 20 5 EHBDHN COCc1cccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845873774 1137316057 /nfs/dbraw/zinc/31/60/57/1137316057.db2.gz VWOGENYVKHXHNM-SJKOYZFVSA-N 0 3 347.342 3.535 20 5 EHBDHN CS[C@H](C)CCC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874960 1137316572 /nfs/dbraw/zinc/31/65/72/1137316572.db2.gz JCEDMSBEIHTZQS-JRPNMDOOSA-N 0 3 329.393 3.607 20 5 EHBDHN COCCOc1ccc([C@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000866538541 1137362929 /nfs/dbraw/zinc/36/29/29/1137362929.db2.gz BYSCENTUAWEWIH-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN CSc1cc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])co1 ZINC000870454914 1137493197 /nfs/dbraw/zinc/49/31/97/1137493197.db2.gz RGKPUVSTARCBHX-OTYXRUKQSA-N 0 3 339.344 3.704 20 5 EHBDHN CCC(=O)c1ccc(N2CCC[C@H]2CN2CCCCC2)c([N+](=O)[O-])c1 ZINC000795141457 1137507165 /nfs/dbraw/zinc/50/71/65/1137507165.db2.gz WQBREVWGYOURNY-INIZCTEOSA-N 0 3 345.443 3.642 20 5 EHBDHN C[C@H](NC[C@@H]1CCN(c2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020789 1137565062 /nfs/dbraw/zinc/56/50/62/1137565062.db2.gz KKPINGGUGNTMOU-GJZGRUSLSA-N 0 3 343.402 3.911 20 5 EHBDHN C[C@H](NCCCc1nc2ccccc2[nH]1)c1c(F)cccc1[N+](=O)[O-] ZINC000872027404 1137566002 /nfs/dbraw/zinc/56/60/02/1137566002.db2.gz JKXOKLAVIGJGFL-LBPRGKRZSA-N 0 3 342.374 3.894 20 5 EHBDHN CC(C)[C@@H](C)N(C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877928034 1137695961 /nfs/dbraw/zinc/69/59/61/1137695961.db2.gz KVYOFSRPLBIKSI-SNVBAGLBSA-N 0 3 338.795 3.775 20 5 EHBDHN CC(C)[C@@H]1CCCC[C@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878419432 1137715109 /nfs/dbraw/zinc/71/51/09/1137715109.db2.gz FDTGRPKWLDKNLW-DZGCQCFKSA-N 0 3 344.415 3.949 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1nnc(CN2CCCC[C@H]2C2CCC2)o1 ZINC000878771857 1137727777 /nfs/dbraw/zinc/72/77/77/1137727777.db2.gz XXADHGIQHSROFB-HNNXBMFYSA-N 0 3 342.399 3.799 20 5 EHBDHN C[C@H](NC(C)(C)c1cccs1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000348319325 1137949113 /nfs/dbraw/zinc/94/91/13/1137949113.db2.gz LDLNCMQRTFFKIS-NSHDSACASA-N 0 3 333.413 3.508 20 5 EHBDHN O=[N+]([O-])c1cc(CNCCCc2c[nH]c3ccc(F)cc23)cs1 ZINC000337310979 1138528183 /nfs/dbraw/zinc/52/81/83/1138528183.db2.gz WEGJBTSYMLGKMR-UHFFFAOYSA-N 0 3 333.388 3.999 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@@H](O)c2ccccc2C)cc1[N+](=O)[O-] ZINC000153750202 1139150982 /nfs/dbraw/zinc/15/09/82/1139150982.db2.gz GQFIYOVMVJDOFD-KBXCAEBGSA-N 0 3 344.411 3.686 20 5 EHBDHN C[C@@H](NC[C@H]1COC2(CCC(C)CC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777314751 1139585194 /nfs/dbraw/zinc/58/51/94/1139585194.db2.gz WEIPAKFDUHJCKM-HGDQPMEPSA-N 0 3 334.416 3.567 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179500579 1139760539 /nfs/dbraw/zinc/76/05/39/1139760539.db2.gz FGHSMVRJFPVCSV-DOMZBBRYSA-N 0 3 341.415 3.531 20 5 EHBDHN CSC1(CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000193655381 1140581967 /nfs/dbraw/zinc/58/19/67/1140581967.db2.gz HHUAJUPQYPUGPO-UHFFFAOYSA-N 0 3 335.454 3.704 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CCCc3cn[nH]c32)o1 ZINC000268844525 1141006390 /nfs/dbraw/zinc/00/63/90/1141006390.db2.gz OJFSSHVTPVUQDJ-HNNXBMFYSA-N 0 3 338.367 3.745 20 5 EHBDHN Cc1nnc([C@H](C)N[C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000274238781 1141488247 /nfs/dbraw/zinc/48/82/47/1141488247.db2.gz QNIHOKAUECYERX-CORIIIEPSA-N 0 3 346.456 3.817 20 5 EHBDHN CC[C@@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H](O)C(C)C ZINC000414536822 1016964058 /nfs/dbraw/zinc/96/40/58/1016964058.db2.gz YHLZVAIECMNOHV-CVEARBPZSA-N 0 3 349.456 3.603 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)/C=C/c1cccc([N+](=O)[O-])c1 ZINC000177316391 1017605338 /nfs/dbraw/zinc/60/53/38/1017605338.db2.gz KOOPBSYVKSBUEZ-MDZDMXLPSA-N 0 3 339.395 3.617 20 5 EHBDHN C[C@@H]1C[C@@H](c2ccccc2F)N(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000178864620 1019321806 /nfs/dbraw/zinc/32/18/06/1019321806.db2.gz MFPZGDCMUNTSSG-VMDGZTHMSA-N 0 3 344.386 3.850 20 5 EHBDHN CC1CCN(CCNC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000614462429 1019333476 /nfs/dbraw/zinc/33/34/76/1019333476.db2.gz QBQKSDOITSGDDJ-UHFFFAOYSA-N 0 3 347.462 3.850 20 5 EHBDHN C[C@@H]1CCC[C@@H](C)C1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000182951625 1019868046 /nfs/dbraw/zinc/86/80/46/1019868046.db2.gz AVWQANPUKKMQHY-VXGBXAGGSA-N 0 3 330.388 3.559 20 5 EHBDHN CC[C@@H](NCc1ccc(NCCOC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000127168123 1020578119 /nfs/dbraw/zinc/57/81/19/1020578119.db2.gz MSGKCFFLDVXECR-LJQANCHMSA-N 0 3 343.427 3.894 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CCC2(C1)CCOCC2 ZINC000602483585 1032913697 /nfs/dbraw/zinc/91/36/97/1032913697.db2.gz MYLJBGJYVGDJGA-UHFFFAOYSA-N 0 3 344.333 3.616 20 5 EHBDHN C[C@H](NCc1cccc(Cn2ccnc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000151351521 1021310481 /nfs/dbraw/zinc/31/04/81/1021310481.db2.gz QBEOIBAYLRBPAX-HNNXBMFYSA-N 0 3 336.395 3.690 20 5 EHBDHN Cc1nn(C(C)(C)C)cc1[C@H](C)NCCOc1cccc([N+](=O)[O-])c1 ZINC000157879319 1021370438 /nfs/dbraw/zinc/37/04/38/1021370438.db2.gz JGNDSRGICDQKLU-ZDUSSCGKSA-N 0 3 346.431 3.584 20 5 EHBDHN COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])cc2C)N(C)C)c1 ZINC000097262013 1021641285 /nfs/dbraw/zinc/64/12/85/1021641285.db2.gz MDTJFJBZLOWBLK-GOSISDBHSA-N 0 3 329.400 3.627 20 5 EHBDHN O=[N+]([O-])c1cc(F)ccc1NCCCN1CCc2ccccc2C1 ZINC000506037651 1021752678 /nfs/dbraw/zinc/75/26/78/1021752678.db2.gz UQPYCOGUEHPFLJ-UHFFFAOYSA-N 0 3 329.375 3.594 20 5 EHBDHN CC[C@@](C)(COc1ncccc1Cl)NCc1ccccc1[N+](=O)[O-] ZINC000441306993 1022141608 /nfs/dbraw/zinc/14/16/08/1022141608.db2.gz KUEPYYCATSKLJE-KRWDZBQOSA-N 0 3 349.818 3.981 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)n1 ZINC000178236919 1022249582 /nfs/dbraw/zinc/24/95/82/1022249582.db2.gz VPEOTBVGWDMZPF-BBRMVZONSA-N 0 3 346.456 3.855 20 5 EHBDHN COc1ccc2c(c1)[C@@H](NC/C=C\c1ccccc1[N+](=O)[O-])CCO2 ZINC000341562065 1022344119 /nfs/dbraw/zinc/34/41/19/1022344119.db2.gz SEEODPMZTORROK-AATOQMJSSA-N 0 3 340.379 3.730 20 5 EHBDHN CN(C)[C@@H](CNCc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000237160491 1022424577 /nfs/dbraw/zinc/42/45/77/1022424577.db2.gz AEIJURWKNADNGA-KRWDZBQOSA-N 0 3 333.819 3.641 20 5 EHBDHN CCOc1ccc([C@H](C)NCCOc2ccccc2)cc1[N+](=O)[O-] ZINC000152585571 1033074600 /nfs/dbraw/zinc/07/46/00/1033074600.db2.gz FWZJVONGYHPSHT-AWEZNQCLSA-N 0 3 330.384 3.723 20 5 EHBDHN CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCCO1 ZINC000506476600 1023249796 /nfs/dbraw/zinc/24/97/96/1023249796.db2.gz IOBIMOFEFKUBAZ-CYBMUJFWSA-N 0 3 332.425 3.934 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000425246238 1024504471 /nfs/dbraw/zinc/50/44/71/1024504471.db2.gz XZQZSDSYDMJXFN-OAHLLOKOSA-N 0 3 340.427 3.936 20 5 EHBDHN COc1ccc(-c2ccc(CNCCc3ccco3)o2)c([N+](=O)[O-])c1 ZINC000520955848 1025137110 /nfs/dbraw/zinc/13/71/10/1025137110.db2.gz ZGJNPPKYNNDXGR-UHFFFAOYSA-N 0 3 342.351 3.789 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](Cc2nccs2)C1 ZINC000934334243 1025507083 /nfs/dbraw/zinc/50/70/83/1025507083.db2.gz UIYFFZSXAPYMGB-KBPBESRZSA-N 0 3 331.441 3.985 20 5 EHBDHN CC[C@@H](N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000121057002 1025620809 /nfs/dbraw/zinc/62/08/09/1025620809.db2.gz BCTYOOSJPPJNRL-GDBMZVCRSA-N 0 3 341.411 3.971 20 5 EHBDHN COc1ccccc1[C@H](CNCc1ccc([N+](=O)[O-])cc1)OC(C)C ZINC000185718407 1025688916 /nfs/dbraw/zinc/68/89/16/1025688916.db2.gz AMQASYDVRPXTNJ-IBGZPJMESA-N 0 3 344.411 3.859 20 5 EHBDHN CC(=O)c1ccc(N[C@@H](C)[C@H](c2ccccc2)N(C)C)c([N+](=O)[O-])c1 ZINC000439128819 1025789056 /nfs/dbraw/zinc/78/90/56/1025789056.db2.gz PKKNKPZHMUKKLE-ORAYPTAESA-N 0 3 341.411 3.901 20 5 EHBDHN COC[C@H](Cc1ccccc1)N(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000475141481 1026233772 /nfs/dbraw/zinc/23/37/72/1026233772.db2.gz WCQGTNDXSBZOFG-BEBFYNPSSA-N 0 3 340.423 3.798 20 5 EHBDHN C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000563418286 1026790670 /nfs/dbraw/zinc/79/06/70/1026790670.db2.gz NVLNIOWGVDTDBA-SCLBCKFNSA-N 0 3 349.394 3.514 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nnc(CN3CC[C@H](C4CCCC4)C3)o2)cc1 ZINC000420963898 1027933517 /nfs/dbraw/zinc/93/35/17/1027933517.db2.gz OPERNAAHVNPTSL-HNNXBMFYSA-N 0 3 342.399 3.657 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN[C@@H](CC(F)F)c1ccccc1 ZINC000420998106 1027976871 /nfs/dbraw/zinc/97/68/71/1027976871.db2.gz SXQDNABGEMLTDY-AWEZNQCLSA-N 0 3 336.338 3.960 20 5 EHBDHN C[C@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCCOC1 ZINC000503932544 1028237235 /nfs/dbraw/zinc/23/72/35/1028237235.db2.gz VIBZBMYCWJQVKL-GXTWGEPZSA-N 0 3 347.440 3.623 20 5 EHBDHN COC(=O)CC1(NCc2ccc(Cl)cc2[N+](=O)[O-])CCCCC1 ZINC000582999305 1028490023 /nfs/dbraw/zinc/49/00/23/1028490023.db2.gz HCXFNNVXKMZBLU-UHFFFAOYSA-N 0 3 340.807 3.604 20 5 EHBDHN COc1ccc(CN(CCc2cccc(F)c2)C2CC2)cc1[N+](=O)[O-] ZINC000523670126 1028512816 /nfs/dbraw/zinc/51/28/16/1028512816.db2.gz MISYREMNUSLWIF-UHFFFAOYSA-N 0 3 344.386 3.950 20 5 EHBDHN C[C@@H]1CCCC[C@H]1N(C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607401 1030749822 /nfs/dbraw/zinc/74/98/22/1030749822.db2.gz OSCIMSKGPUCKGO-IUODEOHRSA-N 0 3 330.388 3.655 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCC[C@@H]3CC3(F)F)cs2)c1 ZINC000598647458 1033364503 /nfs/dbraw/zinc/36/45/03/1033364503.db2.gz MMFZUENCXBDAJG-LLVKDONJSA-N 0 3 339.367 3.853 20 5 EHBDHN C[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2[nH]c(=O)[nH]c2c1 ZINC000594494524 1033396727 /nfs/dbraw/zinc/39/67/27/1033396727.db2.gz CAMYCALXMKLKBS-QMTHXVAHSA-N 0 3 338.367 3.515 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@@H](CN1CCCCC1)c1ccccc1 ZINC000611935355 1033438415 /nfs/dbraw/zinc/43/84/15/1033438415.db2.gz UMHINXNIGJJJFX-IBGZPJMESA-N 0 3 339.439 3.912 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nc(CN3CCC[C@@H](C4CC4)C3)co2)cc1 ZINC000588977548 1036206313 /nfs/dbraw/zinc/20/63/13/1036206313.db2.gz ASFASFAXHVCCHY-OAHLLOKOSA-N 0 3 327.384 3.872 20 5 EHBDHN COc1cc(CN2CCC[C@@H]2C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000609133523 1036563770 /nfs/dbraw/zinc/56/37/70/1036563770.db2.gz DXBGFJMOFRBVPT-GFCCVEGCSA-N 0 3 342.342 3.579 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@H](CO)C2CCCCC2)c(Cl)c1 ZINC000590194597 1036796147 /nfs/dbraw/zinc/79/61/47/1036796147.db2.gz SABJPQDGTNTUGW-CQSZACIVSA-N 0 3 326.824 3.527 20 5 EHBDHN CCC(CC)N(CCOC)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089892798 1036892071 /nfs/dbraw/zinc/89/20/71/1036892071.db2.gz PLQNBDFZDROBJQ-UHFFFAOYSA-N 0 3 347.415 3.887 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC2(c3ccc(F)cc3)CCOCC2)cc1 ZINC000237744362 1036901731 /nfs/dbraw/zinc/90/17/31/1036901731.db2.gz XEZZUQXFKAYLFJ-UHFFFAOYSA-N 0 3 330.359 3.529 20 5 EHBDHN C[C@@H](CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C[C@H](C)O ZINC000180601074 1036984309 /nfs/dbraw/zinc/98/43/09/1036984309.db2.gz YRPNWGWIWNQGAB-VCBZYWHSSA-N 0 3 328.412 3.681 20 5 EHBDHN Cc1ccc2[nH]c(CNc3cc(C)nc4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000542117706 1037094408 /nfs/dbraw/zinc/09/44/08/1037094408.db2.gz GBEKSIJOQIPIDV-UHFFFAOYSA-N 0 3 347.378 3.670 20 5 EHBDHN Cc1ccc2nc(CNc3cc(C)nc4ccc([N+](=O)[O-])cc43)[nH]c2c1 ZINC000542117706 1037094424 /nfs/dbraw/zinc/09/44/24/1037094424.db2.gz GBEKSIJOQIPIDV-UHFFFAOYSA-N 0 3 347.378 3.670 20 5 EHBDHN C[C@@H]1CCc2nc(CNCCc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000152535151 1037207377 /nfs/dbraw/zinc/20/73/77/1037207377.db2.gz QXMXAFHCSJGUTP-GFCCVEGCSA-N 0 3 331.441 3.508 20 5 EHBDHN Cc1ccc([C@@H](C)NC[C@H](O)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000271800021 1037303787 /nfs/dbraw/zinc/30/37/87/1037303787.db2.gz PESJYSWBMYYIKQ-DIFFPNOSSA-N 0 3 336.338 3.566 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](C)Oc1ccc(F)cc1 ZINC000462738065 1037344307 /nfs/dbraw/zinc/34/43/07/1037344307.db2.gz KQZGJVDZFOZQHK-CYBMUJFWSA-N 0 3 348.374 3.690 20 5 EHBDHN CCN(Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])CC(C)C ZINC000046064921 1037740910 /nfs/dbraw/zinc/74/09/10/1037740910.db2.gz GYEFHVOFIHSGBR-UHFFFAOYSA-N 0 3 332.347 3.683 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CN3CC[C@H](C4CC4)C3)cs2)c1 ZINC000538752998 1038517807 /nfs/dbraw/zinc/51/78/07/1038517807.db2.gz BXWZMEFSVFSRCO-AWEZNQCLSA-N 0 3 329.425 3.950 20 5 EHBDHN C[C@@H](CN(Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)CO)c1ccccc1 ZINC000554283189 1039156932 /nfs/dbraw/zinc/15/69/32/1039156932.db2.gz LTWQNZYKMSEIJD-GJZGRUSLSA-N 0 3 346.402 3.720 20 5 EHBDHN COc1cc(CN(CCc2cccc(F)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000485567504 1039246692 /nfs/dbraw/zinc/24/66/92/1039246692.db2.gz HIHNHBLGNHNASM-UHFFFAOYSA-N 0 3 344.386 3.950 20 5 EHBDHN CCCCCN(CCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549845260 1040031901 /nfs/dbraw/zinc/03/19/01/1040031901.db2.gz JFGMOSOAULJPQR-UHFFFAOYSA-N 0 3 334.338 3.598 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCC2(O)CCCCC2)c2ccccc2)c1 ZINC000490179014 1040368617 /nfs/dbraw/zinc/36/86/17/1040368617.db2.gz UNICNKXETQBXPZ-IBGZPJMESA-N 0 3 340.423 3.969 20 5 EHBDHN CC[C@@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CC1(C)C ZINC000419314211 1041251761 /nfs/dbraw/zinc/25/17/61/1041251761.db2.gz HOLVBZFZVWIMCZ-UONOGXRCSA-N 0 3 330.388 3.559 20 5 EHBDHN CC[C@@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CC1(C)C ZINC000419315166 1041276599 /nfs/dbraw/zinc/27/65/99/1041276599.db2.gz JIDMINXPSNGAFP-UONOGXRCSA-N 0 3 330.388 3.559 20 5 EHBDHN CC[C@@H](C)CN(C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000111253531 1042254313 /nfs/dbraw/zinc/25/43/13/1042254313.db2.gz HIZJUVAOCIPLJF-MNOVXSKESA-N 0 3 327.812 3.553 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC(c3ncc4n3CCCC4)CC2)cc1 ZINC000278879972 1042817466 /nfs/dbraw/zinc/81/74/66/1042817466.db2.gz MZOCIBUYPSOLAX-UHFFFAOYSA-N 0 3 340.427 3.507 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(Cc2ccc(-n3ccnc3)cc2)C2CC2)cc1 ZINC000343951397 1042930904 /nfs/dbraw/zinc/93/09/04/1042930904.db2.gz LFCBSWCZKQMCLK-UHFFFAOYSA-N 0 3 348.406 3.945 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1N[C@H]1CCN(Cc2ccccc2)C1 ZINC000039027909 1042981223 /nfs/dbraw/zinc/98/12/23/1042981223.db2.gz KJMIACYHDGJBCL-HNNXBMFYSA-N 0 3 331.803 3.935 20 5 EHBDHN C[C@H](NC[C@H](O)c1cc(F)cc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000279411126 1044062939 /nfs/dbraw/zinc/06/29/39/1044062939.db2.gz DUGBDYNNZULVPX-QFYYESIMSA-N 0 3 338.766 3.772 20 5 EHBDHN Cc1cccc([C@@H](C)NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1C ZINC000183720589 1125742101 /nfs/dbraw/zinc/74/21/01/1125742101.db2.gz AHGZYCNEABRESZ-OAHLLOKOSA-N 0 3 341.411 3.809 20 5 EHBDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283255 1127473611 /nfs/dbraw/zinc/47/36/11/1127473611.db2.gz PFKBJQOHBYXWMX-NEPJUHHUSA-N 0 3 341.839 3.943 20 5 EHBDHN Cc1ccnc(NC[C@@H]2CCCN(C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000301415283 1127742542 /nfs/dbraw/zinc/74/25/42/1127742542.db2.gz LUXLRCNWWDHECX-XJKSGUPXSA-N 0 3 346.456 3.855 20 5 EHBDHN CCN(CC)[C@@H](CNc1cc(OC)ccc1[N+](=O)[O-])c1ccco1 ZINC000338654303 1127998345 /nfs/dbraw/zinc/99/83/45/1127998345.db2.gz IPDWVTCYCHVPRM-INIZCTEOSA-N 0 3 333.388 3.691 20 5 EHBDHN C[C@@H]1C[C@@H](c2ccccc2)CN1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478248 1131242567 /nfs/dbraw/zinc/24/25/67/1131242567.db2.gz XXRKYODHZIPQDE-RHSMWYFYSA-N 0 3 336.395 3.780 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cs1 ZINC000273377228 1128516664 /nfs/dbraw/zinc/51/66/64/1128516664.db2.gz GBNQZVRYAARVNC-GJZGRUSLSA-N 0 3 336.388 3.805 20 5 EHBDHN CC[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(C)cc1 ZINC000194014238 1121752426 /nfs/dbraw/zinc/75/24/26/1121752426.db2.gz KIBOOLYXMFIDPW-KRWDZBQOSA-N 0 3 341.411 3.891 20 5 EHBDHN Cc1cc(F)ccc1[C@@H](O)CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130744799 1123554339 /nfs/dbraw/zinc/55/43/39/1123554339.db2.gz LAXLRXJCQCVPFF-IBGZPJMESA-N 0 3 344.386 3.740 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN2CCC(Oc3ccc(F)cc3)CC2)cc1 ZINC000609672539 1123639553 /nfs/dbraw/zinc/63/95/53/1123639553.db2.gz MFFUEFHAOANVFE-UHFFFAOYSA-N 0 3 344.386 3.820 20 5 EHBDHN C[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCCC[C@H]12 ZINC000182500294 1125316167 /nfs/dbraw/zinc/31/61/67/1125316167.db2.gz JXUAFBHIIUQWAD-WQVCFCJDSA-N 0 3 342.399 3.655 20 5 EHBDHN COc1cccc([C@@H](CNc2cccc(C)c2[N+](=O)[O-])N(C)C)c1 ZINC000302483918 1129779962 /nfs/dbraw/zinc/77/99/62/1129779962.db2.gz HKNDJPDRFLDMEA-QGZVFWFLSA-N 0 3 329.400 3.627 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC2(CCCC2)C1 ZINC000173825387 1130319690 /nfs/dbraw/zinc/31/96/90/1130319690.db2.gz OMOHTTBJPXFIHG-CYBMUJFWSA-N 0 3 342.399 3.972 20 5 EHBDHN Cc1ccc(CN[C@@H](C)c2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] ZINC000743498754 1131930448 /nfs/dbraw/zinc/93/04/48/1131930448.db2.gz RZAYYNXOJXSMCJ-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@@](CF)(C(F)(F)F)C1 ZINC001173221258 1132004379 /nfs/dbraw/zinc/00/43/79/1132004379.db2.gz GSEJDXUPRPRGAE-FZMZJTMJSA-N 0 3 334.313 3.750 20 5 EHBDHN Cc1ccccc1N1CCN([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173230375 1132007769 /nfs/dbraw/zinc/00/77/69/1132007769.db2.gz XTSDBGREKOJVSV-KRWDZBQOSA-N 0 3 339.439 3.656 20 5 EHBDHN C[C@@H](NCCC(=O)Nc1cc(F)cc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC001176030018 1132824323 /nfs/dbraw/zinc/82/43/23/1132824323.db2.gz XUYISAYOKMTAPO-LLVKDONJSA-N 0 3 349.337 3.552 20 5 EHBDHN CCCCC[C@H]1CCCN1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767765451 1133050524 /nfs/dbraw/zinc/05/05/24/1133050524.db2.gz PJTWTYDOIGOYLT-AWEZNQCLSA-N 0 3 331.420 3.650 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC[C@@H]1C[C@H](c2ccccc2)CO1 ZINC001182911272 1133749013 /nfs/dbraw/zinc/74/90/13/1133749013.db2.gz XXTNPPRWHWCXQC-RDJZCZTQSA-N 0 3 346.814 3.911 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC[C@H](C(=O)OC(C)(C)C)C1 ZINC001183464877 1133810610 /nfs/dbraw/zinc/81/06/10/1133810610.db2.gz ZYTXOZZTISBHGB-HNNXBMFYSA-N 0 3 348.443 3.765 20 5 EHBDHN C[C@H]1CN(CCCCNc2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000791412129 1134547500 /nfs/dbraw/zinc/54/75/00/1134547500.db2.gz BRMQVSUTVWYIKW-STQMWFEESA-N 0 3 341.839 3.550 20 5 EHBDHN COc1ccc(C[C@H](C)N(C)Cc2ccccc2OC)c([N+](=O)[O-])c1 ZINC001170341443 1134758980 /nfs/dbraw/zinc/75/89/80/1134758980.db2.gz IXJKRIIOJRTVGU-AWEZNQCLSA-N 0 3 344.411 3.675 20 5 EHBDHN COC(=O)c1ccc([N+](=O)[O-])c(CN(C)[C@H](C)Cc2cccs2)c1 ZINC001191465278 1134876054 /nfs/dbraw/zinc/87/60/54/1134876054.db2.gz YSDLGKBALDWXLN-GFCCVEGCSA-N 0 3 348.424 3.506 20 5 EHBDHN CCc1ccc([C@@H](O)CNCc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809689230 1135872218 /nfs/dbraw/zinc/87/22/18/1135872218.db2.gz LGLGQEMGSLVEOT-KRWDZBQOSA-N 0 3 334.803 3.634 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCCNc1cccc(F)c1 ZINC001201644641 1136051289 /nfs/dbraw/zinc/05/12/89/1136051289.db2.gz IQYJVIBXTHBGLE-UHFFFAOYSA-N 0 3 347.390 3.724 20 5 EHBDHN O=[N+]([O-])c1cccc(CCNCc2ccnc(Cl)c2Cl)c1 ZINC000811485438 1136092148 /nfs/dbraw/zinc/09/21/48/1136092148.db2.gz KTLLJGSZKSYTOJ-UHFFFAOYSA-N 0 3 326.183 3.629 20 5 EHBDHN Cc1c2cc(F)ccc2oc1CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275869 1136130183 /nfs/dbraw/zinc/13/01/83/1136130183.db2.gz HYPFLQFOSDPSLA-INIZCTEOSA-N 0 3 344.342 3.612 20 5 EHBDHN CC(COC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)[N+](=O)[O-] ZINC000813101846 1136287596 /nfs/dbraw/zinc/28/75/96/1136287596.db2.gz JYGULIPIJPCRKL-AWEZNQCLSA-N 0 3 341.363 3.525 20 5 EHBDHN CC(COC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)[N+](=O)[O-] ZINC000813107495 1136293923 /nfs/dbraw/zinc/29/39/23/1136293923.db2.gz RAKQLSKBHSHXOA-RLIURORJSA-N 0 3 335.356 3.636 20 5 EHBDHN Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813109349 1136294175 /nfs/dbraw/zinc/29/41/75/1136294175.db2.gz IXWAMLYDKZCATR-MRVPVSSYSA-N 0 3 340.788 3.594 20 5 EHBDHN Cc1cc(/C=C/C(=O)OCC(C)[N+](=O)[O-])c(C)n1C1CCCCC1 ZINC000813110324 1136294517 /nfs/dbraw/zinc/29/45/17/1136294517.db2.gz XQLXUXBDQFFDSE-HBWSCVEGSA-N 0 3 334.416 3.832 20 5 EHBDHN CC(COC(=O)c1ccccc1OCc1ccccc1Cl)[N+](=O)[O-] ZINC000813111648 1136294592 /nfs/dbraw/zinc/29/45/92/1136294592.db2.gz JUUNJQOEHMXBTQ-GFCCVEGCSA-N 0 3 349.770 3.741 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@H](CO)C1CCCCC1 ZINC000815150439 1136563445 /nfs/dbraw/zinc/56/34/45/1136563445.db2.gz CLBQEFMMUSAIPN-CQSZACIVSA-N 0 3 326.824 3.527 20 5 EHBDHN CC(COC(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1)[N+](=O)[O-] ZINC000816090949 1136672142 /nfs/dbraw/zinc/67/21/42/1136672142.db2.gz DYZXTCKLGMLTHD-VIFPVBQESA-N 0 3 343.257 3.787 20 5 EHBDHN CC([C@@H](OC(=O)[C@H](C)Oc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845872259 1137315874 /nfs/dbraw/zinc/31/58/74/1137315874.db2.gz FPRULOCMCAOKJD-IIYDPXPESA-N 0 3 347.342 3.543 20 5 EHBDHN Cc1ccccc1CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845872616 1137315929 /nfs/dbraw/zinc/31/59/29/1137315929.db2.gz KLLVTXJLGLUCCA-ACJLOTCBSA-N 0 3 331.343 3.626 20 5 EHBDHN Cc1cccc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845873078 1137316190 /nfs/dbraw/zinc/31/61/90/1137316190.db2.gz BAUBRCMJSQPIKV-ACJLOTCBSA-N 0 3 331.343 3.626 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H]1C[C@H]1c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882199 1137317168 /nfs/dbraw/zinc/31/71/68/1137317168.db2.gz NWJZSXCVXTXKJA-BWUSGFMJSA-N 0 3 343.354 3.879 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](O)c1ccccc1 ZINC000872015992 1137564651 /nfs/dbraw/zinc/56/46/51/1137564651.db2.gz AXVJNURBWLPKFO-MLGOLLRUSA-N 0 3 332.425 3.701 20 5 EHBDHN CC(C)n1ncc2c1C[C@@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])CC2 ZINC000872067617 1137569387 /nfs/dbraw/zinc/56/93/87/1137569387.db2.gz ZSUOUTRZRMOIPS-OCCSQVGLSA-N 0 3 346.406 3.719 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCc1ccc(C2OCCO2)cc1 ZINC000873049155 1137588870 /nfs/dbraw/zinc/58/88/70/1137588870.db2.gz BGOMFIRRFPNHCU-UHFFFAOYSA-N 0 3 342.395 3.547 20 5 EHBDHN CC(C)[C@H]1CCCCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878111751 1137702999 /nfs/dbraw/zinc/70/29/99/1137702999.db2.gz CYPDGDZSYOCBNN-CQSZACIVSA-N 0 3 330.388 3.655 20 5 EHBDHN CC(C)(C)[C@@H]1CCCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878543500 1137719585 /nfs/dbraw/zinc/71/95/85/1137719585.db2.gz DMJQNIVOWYQCIK-CYBMUJFWSA-N 0 3 344.415 3.903 20 5 EHBDHN C[C@@H](c1cccc(Cl)c1)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136962484 1138044599 /nfs/dbraw/zinc/04/45/99/1138044599.db2.gz AQECGINYVMOCIP-SJCJKPOMSA-N 0 3 334.803 3.975 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC3(CO)CCC3)o2)c(Cl)c1 ZINC000178640017 1139709447 /nfs/dbraw/zinc/70/94/47/1139709447.db2.gz BJJRSPUVNBWCIL-UHFFFAOYSA-N 0 3 336.775 3.513 20 5 EHBDHN CC(=O)Nc1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192628808 1140540607 /nfs/dbraw/zinc/54/06/07/1140540607.db2.gz DVXOGHSAEZTIPQ-IBGZPJMESA-N 0 3 339.395 3.720 20 5 EHBDHN Cc1ccc([C@@H](C)NC[C@@H](O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000268776819 1140989415 /nfs/dbraw/zinc/98/94/15/1140989415.db2.gz WBSPZSVYHIVADF-PIGZYNQJSA-N 0 3 336.338 3.566 20 5 EHBDHN CC(C)(CCCO)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000271464141 1141373821 /nfs/dbraw/zinc/37/38/21/1141373821.db2.gz GKRGXXWELZZFBC-UHFFFAOYSA-N 0 3 349.456 3.607 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN[C@H](C)[C@@H]1Oc2ccccc2[C@H]1C ZINC000430219831 1015087562 /nfs/dbraw/zinc/08/75/62/1015087562.db2.gz NWZFVASZVGGNBO-VLXJIEOASA-N 0 3 342.395 3.646 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000247146912 1016615961 /nfs/dbraw/zinc/61/59/61/1016615961.db2.gz YFBZPXXNOAJOIW-CABCVRRESA-N 0 3 347.459 3.530 20 5 EHBDHN COC1CCC(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000459678883 1032407109 /nfs/dbraw/zinc/40/71/09/1032407109.db2.gz NJRAAYOVYKNAMQ-UHFFFAOYSA-N 0 3 347.440 3.766 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCC3=CCOCC3)o2)c(Cl)c1 ZINC000449401321 1032524653 /nfs/dbraw/zinc/52/46/53/1032524653.db2.gz GPUZPZSPBDYXEA-UHFFFAOYSA-N 0 3 348.786 3.945 20 5 EHBDHN COc1c(O)cccc1CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449500150 1032677624 /nfs/dbraw/zinc/67/76/24/1032677624.db2.gz NKLYPTNCHVCFLC-HNNXBMFYSA-N 0 3 342.395 3.689 20 5 EHBDHN CN(CCCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177010418 1017545280 /nfs/dbraw/zinc/54/52/80/1017545280.db2.gz KURWMIFNYAJHOB-UHFFFAOYSA-N 0 3 325.368 3.801 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)/C=C/c1ccccc1[N+](=O)[O-] ZINC000177316498 1017604683 /nfs/dbraw/zinc/60/46/83/1017604683.db2.gz CHNPZMQWRCFHDQ-ZHACJKMWSA-N 0 3 339.395 3.617 20 5 EHBDHN CC(C)(C)O[C@@H]1C[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(C)C ZINC000412074496 1017691501 /nfs/dbraw/zinc/69/15/01/1017691501.db2.gz MQRUVNZGYFOQEF-LSDHHAIUSA-N 0 3 346.431 3.543 20 5 EHBDHN Cc1c(CN[C@H](C)c2ccccc2-n2cccn2)cccc1[N+](=O)[O-] ZINC000183163393 1020430937 /nfs/dbraw/zinc/43/09/37/1020430937.db2.gz NLHYTGGYPRFDKH-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](n2ncc3ccccc32)C1 ZINC000510436045 1021147541 /nfs/dbraw/zinc/14/75/41/1021147541.db2.gz YAQLVGKIUURGKP-ZBFHGGJFSA-N 0 3 336.395 3.953 20 5 EHBDHN COc1ccc(OCCN(C)C/C=C/c2ccccc2[N+](=O)[O-])cc1 ZINC000506054774 1021873243 /nfs/dbraw/zinc/87/32/43/1021873243.db2.gz BMVNAQKSVJJBAJ-FNORWQNLSA-N 0 3 342.395 3.627 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN(CCC(F)(F)F)CC2CC2)cc1 ZINC000084137965 1022278019 /nfs/dbraw/zinc/27/80/19/1022278019.db2.gz PJJGCWBKKWRIGY-UHFFFAOYSA-N 0 3 332.322 3.638 20 5 EHBDHN C[C@]1(CCCO)CCCN1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602668131 1033064577 /nfs/dbraw/zinc/06/45/77/1033064577.db2.gz UCMCBYREOSOMFR-OAHLLOKOSA-N 0 3 346.349 3.741 20 5 EHBDHN O=[N+]([O-])c1sc(CNC2(C3CCC3)CC2)cc1Br ZINC000602699156 1033079058 /nfs/dbraw/zinc/07/90/58/1033079058.db2.gz MPNVVBHUQYGPJK-UHFFFAOYSA-N 0 3 331.235 3.841 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(Cc2ccc(-n3ccnc3)cc2)C2CC2)c1 ZINC000507169200 1023171847 /nfs/dbraw/zinc/17/18/47/1023171847.db2.gz UMMTZIJTDGDQDA-UHFFFAOYSA-N 0 3 348.406 3.945 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H]1CC(C)(C)C ZINC000060889725 1033175205 /nfs/dbraw/zinc/17/52/05/1033175205.db2.gz ZPGZNLJVKWKDFJ-HNNXBMFYSA-N 0 3 333.432 3.742 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](Oc2ccncc2)C1 ZINC000435055010 1024584683 /nfs/dbraw/zinc/58/46/83/1024584683.db2.gz GKGPVGSPMFWEJU-ILCZHQDMSA-N 0 3 339.395 3.546 20 5 EHBDHN COc1cc(C[NH2+]CC[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1[O-] ZINC000507942996 1024789118 /nfs/dbraw/zinc/78/91/18/1024789118.db2.gz WLTKSPGRPPBJBI-ZDUSSCGKSA-N 0 3 330.384 3.592 20 5 EHBDHN C[C@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CO1 ZINC000516063418 1025949412 /nfs/dbraw/zinc/94/94/12/1025949412.db2.gz SXSUOJOGLYPKTA-QWRGUYRKSA-N 0 3 336.775 3.775 20 5 EHBDHN CC(C)C[C@H]1CCCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533391411 1027795588 /nfs/dbraw/zinc/79/55/88/1027795588.db2.gz XQEKOAKWZBNORR-MRXNPFEDSA-N 0 3 334.416 3.862 20 5 EHBDHN CC[C@@H](c1ccc(F)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496897 1028090292 /nfs/dbraw/zinc/09/02/92/1028090292.db2.gz TUFRHUSGOXDCPR-RDJZCZTQSA-N 0 3 344.390 3.766 20 5 EHBDHN CCS[C@@H]1CCCC[C@H]1NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444685664 1028131115 /nfs/dbraw/zinc/13/11/15/1028131115.db2.gz PAIQAFHEMYBTQK-UKRRQHHQSA-N 0 3 334.445 3.625 20 5 EHBDHN CC[C@H]1CCCC[C@H]1N(C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680973 1028150161 /nfs/dbraw/zinc/15/01/61/1028150161.db2.gz XWJDRIGGGIGOOL-WMLDXEAASA-N 0 3 333.432 3.742 20 5 EHBDHN CC[C@H]1C[C@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000421391334 1028367936 /nfs/dbraw/zinc/36/79/36/1028367936.db2.gz UAFNQWCTPWXDCW-CJNGLKHVSA-N 0 3 347.440 3.766 20 5 EHBDHN CCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000532935226 1029102441 /nfs/dbraw/zinc/10/24/41/1029102441.db2.gz WYSUJZKEKIQDEX-NSHDSACASA-N 0 3 327.812 3.553 20 5 EHBDHN CCC[C@@H](N[C@H](C(=O)N(C)CC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000453295451 1030042919 /nfs/dbraw/zinc/04/29/19/1030042919.db2.gz YCNGUPWVIVCSHQ-SJORKVTESA-N 0 3 335.448 3.529 20 5 EHBDHN Cc1cc(-c2noc([C@H](C)N3[C@H](C)CC[C@H]3C)n2)cc([N+](=O)[O-])c1 ZINC000453299254 1030049876 /nfs/dbraw/zinc/04/98/76/1030049876.db2.gz WZUKBQZBRLIXAJ-UPJWGTAASA-N 0 3 330.388 3.887 20 5 EHBDHN COc1ccc(CN(CCc2nccs2)C(C)C)cc1[N+](=O)[O-] ZINC000159753089 1030349702 /nfs/dbraw/zinc/34/97/02/1030349702.db2.gz SZGVAZZRKMJTHP-UHFFFAOYSA-N 0 3 335.429 3.513 20 5 EHBDHN Cc1c([C@H](C)NCCOc2ccc([N+](=O)[O-])cc2)cnn1C(C)(C)C ZINC000526050469 1030372442 /nfs/dbraw/zinc/37/24/42/1030372442.db2.gz RARVCDLGMOQAJY-ZDUSSCGKSA-N 0 3 346.431 3.584 20 5 EHBDHN C[C@@H](CCc1ccccc1[N+](=O)[O-])NCc1noc2ccccc21 ZINC000520428110 1030500140 /nfs/dbraw/zinc/50/01/40/1030500140.db2.gz KXXGAQUGLQZWQR-ZDUSSCGKSA-N 0 3 325.368 3.847 20 5 EHBDHN CCC[C@@H](C)[C@@H]1CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267979 1030515708 /nfs/dbraw/zinc/51/57/08/1030515708.db2.gz PLWBTDCXRCYIBG-DYVFJYSZSA-N 0 3 334.416 3.862 20 5 EHBDHN C[C@H]1[C@H](NC(=O)c2cc3ccccc3c3cccnc23)CCCN1C ZINC000343436002 1030867404 /nfs/dbraw/zinc/86/74/04/1030867404.db2.gz LJGSGCBFLROKBB-IFXJQAMLSA-N 0 3 333.435 3.601 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CC[C@@H](c2ccc(F)cc2)C1 ZINC000483101751 1030957350 /nfs/dbraw/zinc/95/73/50/1030957350.db2.gz DFXZDIHAVQUJFQ-OAHLLOKOSA-N 0 3 330.359 3.602 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC(c2cn[nH]c2)CC1 ZINC000347370082 1031429267 /nfs/dbraw/zinc/42/92/67/1031429267.db2.gz URKWECPQTRDBBX-ZROIWOOFSA-N 0 3 326.400 3.601 20 5 EHBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC(c2c[nH]nc2C)CC1 ZINC000551564839 1031457824 /nfs/dbraw/zinc/45/78/24/1031457824.db2.gz QDJQHUVPAHBISJ-GXDHUFHOSA-N 0 3 340.427 3.909 20 5 EHBDHN C[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2[nH]c(=O)[nH]c2c1 ZINC000594494525 1033397404 /nfs/dbraw/zinc/39/74/04/1033397404.db2.gz CAMYCALXMKLKBS-YGRLFVJLSA-N 0 3 338.367 3.515 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H](c1ccsc1)N(C)C ZINC000595002981 1033628468 /nfs/dbraw/zinc/62/84/68/1033628468.db2.gz AMTRFQWLQNIGDN-LRDDRELGSA-N 0 3 349.456 3.618 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H](c1ccsc1)N(C)C ZINC000595002983 1033628488 /nfs/dbraw/zinc/62/84/88/1033628488.db2.gz AMTRFQWLQNIGDN-WBMJQRKESA-N 0 3 349.456 3.618 20 5 EHBDHN COc1ccc([C@H](C)NC/C=C\c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000598994625 1033647344 /nfs/dbraw/zinc/64/73/44/1033647344.db2.gz CZFMHHMKXVQWHX-QPBFKRLHSA-N 0 3 342.395 3.976 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC1(c2ccccn2)CCC1 ZINC000595042529 1033660947 /nfs/dbraw/zinc/66/09/47/1033660947.db2.gz HKUVAUSLRGDSGS-AWEZNQCLSA-N 0 3 341.411 3.771 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN2CC3(CCOCC3)[C@H]2c2ccco2)cc1 ZINC000595715487 1033959715 /nfs/dbraw/zinc/95/97/15/1033959715.db2.gz AKXRIPKPGVBMBX-GOSISDBHSA-N 0 3 342.395 3.584 20 5 EHBDHN COc1cc(CNC2(CC(C)C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000595835230 1034015079 /nfs/dbraw/zinc/01/50/79/1034015079.db2.gz SZHDYVMYTKFWLX-UHFFFAOYSA-N 0 3 344.358 3.873 20 5 EHBDHN COc1ccc([C@@H]2CCN(Cc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000599679785 1034108377 /nfs/dbraw/zinc/10/83/77/1034108377.db2.gz OVYJVFDHZXZOJV-OAHLLOKOSA-N 0 3 330.359 3.732 20 5 EHBDHN C[C@@H](NC(=O)[C@@H]1CCCCN1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413039 1034298782 /nfs/dbraw/zinc/29/87/82/1034298782.db2.gz SKMDWINSCADWGZ-KDOFPFPSSA-N 0 3 345.443 3.569 20 5 EHBDHN CCOc1ccc([C@@H](C)N[C@@H]2CCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000596649921 1034345945 /nfs/dbraw/zinc/34/59/45/1034345945.db2.gz DRMFZBROZBTYLG-SJKOYZFVSA-N 0 3 341.411 3.914 20 5 EHBDHN CCc1nnc(CN[C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000290146944 1034769251 /nfs/dbraw/zinc/76/92/51/1034769251.db2.gz LAWHCQLDBXUCMU-GXTWGEPZSA-N 0 3 346.456 3.510 20 5 EHBDHN CCc1nnc(CN[C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000290146951 1034802243 /nfs/dbraw/zinc/80/22/43/1034802243.db2.gz LAWHCQLDBXUCMU-TZMCWYRMSA-N 0 3 346.456 3.510 20 5 EHBDHN COc1cc(CN(C)C2CCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179893610 1034984382 /nfs/dbraw/zinc/98/43/82/1034984382.db2.gz UPKPJHNXBMQCGY-UHFFFAOYSA-N 0 3 344.358 3.622 20 5 EHBDHN C[C@H](NCCN(C(=O)OC(C)(C)C)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000310659643 1035282241 /nfs/dbraw/zinc/28/22/41/1035282241.db2.gz XNQMZDANZAKRCX-ZDUSSCGKSA-N 0 3 349.431 3.645 20 5 EHBDHN COc1ccc(CN[C@@H](C)[C@H](OC)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271973792 1035577438 /nfs/dbraw/zinc/57/74/38/1035577438.db2.gz ICKBADDEYGPDSH-SGTLLEGYSA-N 0 3 348.374 3.608 20 5 EHBDHN C[C@@H](c1ccccc1)[C@H](CO)NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000613389353 1035719846 /nfs/dbraw/zinc/71/98/46/1035719846.db2.gz IQQQROXKKQNDTB-LRDDRELGSA-N 0 3 334.803 3.502 20 5 EHBDHN CN1CC[C@H](NCc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000589284649 1036340103 /nfs/dbraw/zinc/34/01/03/1036340103.db2.gz NZQLJZIQCOKGDL-FUHWJXTLSA-N 0 3 345.830 3.783 20 5 EHBDHN COC(=O)c1ccc([N+](=O)[O-])c(CN(C)C[C@@H](C)c2ccccc2)c1 ZINC000589497027 1036436460 /nfs/dbraw/zinc/43/64/60/1036436460.db2.gz GUNLPVIMUAKAFK-CQSZACIVSA-N 0 3 342.395 3.617 20 5 EHBDHN CC(C)[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000045471142 1036448290 /nfs/dbraw/zinc/44/82/90/1036448290.db2.gz VFKTYRODIHMAEF-SFHVURJKSA-N 0 3 345.374 3.659 20 5 EHBDHN CCC[C@H](N[C@@H]1CCCC(F)(F)[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000414305425 1036558232 /nfs/dbraw/zinc/55/82/32/1036558232.db2.gz RTQOFKZHXBHJFL-ZNMIVQPWSA-N 0 3 328.359 3.574 20 5 EHBDHN C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cncn2)cc1 ZINC000152782467 1036722911 /nfs/dbraw/zinc/72/29/11/1036722911.db2.gz GLRDWIAFUSYIBO-KGLIPLIRSA-N 0 3 337.383 3.587 20 5 EHBDHN CN(C)Cc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000127604580 1036816144 /nfs/dbraw/zinc/81/61/44/1036816144.db2.gz XEFUNIYCLRPJEI-UHFFFAOYSA-N 0 3 333.775 3.562 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](C)Oc1ccccc1C ZINC000462738130 1037344462 /nfs/dbraw/zinc/34/44/62/1037344462.db2.gz LBTZUGGBXRTZBA-OAHLLOKOSA-N 0 3 344.411 3.859 20 5 EHBDHN CC(C)CN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000031582054 1037722853 /nfs/dbraw/zinc/72/28/53/1037722853.db2.gz ZOVMXWKWCSLGDP-UHFFFAOYSA-N 0 3 327.812 3.553 20 5 EHBDHN CC[C@@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341220563 1037784881 /nfs/dbraw/zinc/78/48/81/1037784881.db2.gz NVGNGAFCBIGPCG-CXAGYDPISA-N 0 3 327.384 3.663 20 5 EHBDHN COc1cc(CN(C)CCCOc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000485774313 1039530921 /nfs/dbraw/zinc/53/09/21/1039530921.db2.gz RDSDSZAHVNRSBZ-UHFFFAOYSA-N 0 3 348.374 3.643 20 5 EHBDHN COc1cc(CN2CC[C@](C)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490042478 1040318089 /nfs/dbraw/zinc/31/80/89/1040318089.db2.gz VQNBYVJQIFRNLF-IBGZPJMESA-N 0 3 326.396 3.767 20 5 EHBDHN CCOc1cc(CN(C)C[C@@H](C)c2nccs2)ccc1[N+](=O)[O-] ZINC000276938788 1040431305 /nfs/dbraw/zinc/43/13/05/1040431305.db2.gz RXPZCEVYVUWWIA-GFCCVEGCSA-N 0 3 335.429 3.686 20 5 EHBDHN CC1CCN([C@@H](CNc2ncccc2[N+](=O)[O-])c2cccs2)CC1 ZINC000015128654 1041300170 /nfs/dbraw/zinc/30/01/70/1041300170.db2.gz WPDNRPZRZFVFAT-HNNXBMFYSA-N 0 3 346.456 3.936 20 5 EHBDHN COc1ccc(CN2CC[C@@H](c3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC000544185701 1041371914 /nfs/dbraw/zinc/37/19/14/1041371914.db2.gz HQSDAPJWDSECDG-QGZVFWFLSA-N 0 3 326.396 3.901 20 5 EHBDHN Cc1nc(CNCCc2ccc(Cl)cc2[N+](=O)[O-])sc1C ZINC000893403566 1041734207 /nfs/dbraw/zinc/73/42/07/1041734207.db2.gz ULFBFWCKDJSZFQ-UHFFFAOYSA-N 0 3 325.821 3.654 20 5 EHBDHN CCC[C@H](NCc1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000120337072 1042596344 /nfs/dbraw/zinc/59/63/44/1042596344.db2.gz ONGYAITWBKTXEJ-INIZCTEOSA-N 0 3 328.368 3.955 20 5 EHBDHN COc1ccc(CN[C@H]2CCCNc3ccccc32)cc1[N+](=O)[O-] ZINC000278908601 1042904596 /nfs/dbraw/zinc/90/45/96/1042904596.db2.gz ZZJPYWVKWVBRTP-INIZCTEOSA-N 0 3 327.384 3.640 20 5 EHBDHN CSCCCN(C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000305936827 1042955502 /nfs/dbraw/zinc/95/55/02/1042955502.db2.gz KRYBQBAWCVVAEQ-UHFFFAOYSA-N 0 3 333.251 3.542 20 5 EHBDHN Cc1cc(N2CCC[C@H](c3ncc[nH]3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272892026 1127097819 /nfs/dbraw/zinc/09/78/19/1127097819.db2.gz YCHGULUEOSRMMW-ZDUSSCGKSA-N 0 3 337.383 3.559 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(-n2ccnc2)cc1 ZINC000765357702 1127601092 /nfs/dbraw/zinc/60/10/92/1127601092.db2.gz CEGHVNWIDSGYDN-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN Cc1ccnc(NC[C@H](c2ccccc2)N2CCCC2)c1[N+](=O)[O-] ZINC000301279636 1127618975 /nfs/dbraw/zinc/61/89/75/1127618975.db2.gz JRLGNHCNRJCGNA-MRXNPFEDSA-N 0 3 326.400 3.547 20 5 EHBDHN Cc1cc(Nc2cccc(CN3CCSCC3)c2)ncc1[N+](=O)[O-] ZINC000301417102 1127742421 /nfs/dbraw/zinc/74/24/21/1127742421.db2.gz CFFFAANDEMMPEP-UHFFFAOYSA-N 0 3 344.440 3.591 20 5 EHBDHN COc1cc(NC[C@@H](c2ccc(C)o2)N2CCCC2)ccc1[N+](=O)[O-] ZINC000301418001 1127742499 /nfs/dbraw/zinc/74/24/99/1127742499.db2.gz RJCSZIRDDYJVKQ-INIZCTEOSA-N 0 3 345.399 3.754 20 5 EHBDHN O=[N+]([O-])c1cnc2c(c1)CN(CCCc1ccc(Cl)cc1)CC2 ZINC000495456286 1121215610 /nfs/dbraw/zinc/21/56/10/1121215610.db2.gz ZCKCMLLURBHJMR-UHFFFAOYSA-N 0 3 331.803 3.634 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CC[C@H]3SCCS[C@H]23)c1 ZINC000762613015 1121382916 /nfs/dbraw/zinc/38/29/16/1121382916.db2.gz GPJVEMOVJVUEEB-MGPQQGTHSA-N 0 3 344.889 3.717 20 5 EHBDHN CCC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000193630475 1121514425 /nfs/dbraw/zinc/51/44/25/1121514425.db2.gz PVTMPUWHQKBVHA-GOSISDBHSA-N 0 3 341.411 3.973 20 5 EHBDHN O=[N+]([O-])c1c(F)cccc1NCCCN1CCc2ccccc2C1 ZINC000301089558 1121541964 /nfs/dbraw/zinc/54/19/64/1121541964.db2.gz KYICTBJQMYURIV-UHFFFAOYSA-N 0 3 329.375 3.594 20 5 EHBDHN CCOc1ccc([C@H](C)NCC2(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000556919602 1123208373 /nfs/dbraw/zinc/20/83/73/1123208373.db2.gz GUZQHULDWVRMJR-JTQLQIEISA-N 0 3 332.322 3.987 20 5 EHBDHN CCCCCN(Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)C ZINC000734829046 1131282763 /nfs/dbraw/zinc/28/27/63/1131282763.db2.gz GNNVVGNJEXHRQI-UHFFFAOYSA-N 0 3 331.420 3.711 20 5 EHBDHN COc1cc(CN2CC[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453581 1129360917 /nfs/dbraw/zinc/36/09/17/1129360917.db2.gz HQKURWMNINJHKO-CMPLNLGQSA-N 0 3 342.342 3.579 20 5 EHBDHN COc1ccccc1[C@H](CNc1ccccc1[N+](=O)[O-])N1CCCC1 ZINC000068836506 1129401810 /nfs/dbraw/zinc/40/18/10/1129401810.db2.gz PMGTTWMIHKBRTG-SFHVURJKSA-N 0 3 341.411 3.852 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)[C@@H](C)c1ccco1 ZINC000069070382 1129420719 /nfs/dbraw/zinc/42/07/19/1129420719.db2.gz LRCPGGBATQZETI-ZDUSSCGKSA-N 0 3 331.372 3.518 20 5 EHBDHN C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000700734075 1130066898 /nfs/dbraw/zinc/06/68/98/1130066898.db2.gz ITOVCXDBKCVAQP-HEHGZKQESA-N 0 3 349.431 3.643 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@@H]3CCC[C@@H]3C2)c1F ZINC001173178277 1131992804 /nfs/dbraw/zinc/99/28/04/1131992804.db2.gz ACFXDYLKKMQTEN-MELADBBJSA-N 0 3 336.407 3.796 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N(C)Cc2cccnc2C)c1F ZINC001173191214 1131995145 /nfs/dbraw/zinc/99/51/45/1131995145.db2.gz BBSXRBZUACGLJF-GFCCVEGCSA-N 0 3 347.390 3.509 20 5 EHBDHN CCN(Cc1ccccn1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173196591 1131997005 /nfs/dbraw/zinc/99/70/05/1131997005.db2.gz NXYQHKPFNQDJGI-ZDUSSCGKSA-N 0 3 347.390 3.591 20 5 EHBDHN COc1cccnc1[C@H](N[C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173228800 1132008009 /nfs/dbraw/zinc/00/80/09/1132008009.db2.gz KLGGMNMMAQCISX-FZKQIMNGSA-N 0 3 341.411 3.670 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NCc1cc(-c2ccccc2)no1 ZINC001173212997 1132014145 /nfs/dbraw/zinc/01/41/45/1132014145.db2.gz FEPCYIYXYDPVPQ-AWEZNQCLSA-N 0 3 337.379 3.971 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CNC[C@@H](O)C3CCCCC3)o2)c1 ZINC001177625205 1133088730 /nfs/dbraw/zinc/08/87/30/1133088730.db2.gz YLKQEOTWCQJJND-GOSISDBHSA-N 0 3 344.411 3.886 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(Cc2ccccc2)[C@H](CO)C2CC2)cc1F ZINC000788486381 1134131031 /nfs/dbraw/zinc/13/10/31/1134131031.db2.gz UUOAODKQRXVKBR-LJQANCHMSA-N 0 3 344.386 3.507 20 5 EHBDHN CCCCO[C@@H]1C[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(C)C ZINC001170118494 1134326476 /nfs/dbraw/zinc/32/64/76/1134326476.db2.gz QXANYTVPNYAAFJ-JKSUJKDBSA-N 0 3 346.431 3.545 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]1CC1CCCC1 ZINC001195639451 1135445882 /nfs/dbraw/zinc/44/58/82/1135445882.db2.gz URHSTALJFIOSQE-INIZCTEOSA-N 0 3 345.443 3.886 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CCC2(CCSCC2)CC1 ZINC001196685517 1135600735 /nfs/dbraw/zinc/60/07/35/1135600735.db2.gz XAGHRHQHJDBJPL-UHFFFAOYSA-N 0 3 336.457 3.583 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(CC[C@H](O)c2ccccc2)C2CC2)c1 ZINC000808735551 1135732513 /nfs/dbraw/zinc/73/25/13/1135732513.db2.gz RFHYMECUFNMGCC-IBGZPJMESA-N 0 3 326.396 3.683 20 5 EHBDHN C[C@H](N)c1ncc(-c2ccccc2)n1-c1c(Cl)cncc1[N+](=O)[O-] ZINC001170681068 1136221622 /nfs/dbraw/zinc/22/16/22/1136221622.db2.gz DZCUWVVGQBXDIM-JTQLQIEISA-N 0 3 343.774 3.516 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCC3SCCS3)o2)cc1 ZINC000850401492 1136249833 /nfs/dbraw/zinc/24/98/33/1136249833.db2.gz FGYFACBQYCJFQV-UHFFFAOYSA-N 0 3 336.438 3.751 20 5 EHBDHN C[C@H](c1ccccc1)[C@@H](O)CNCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000850411563 1136252604 /nfs/dbraw/zinc/25/26/04/1136252604.db2.gz FPXNOEVYJQMOJB-PXAZEXFGSA-N 0 3 334.803 3.502 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H](O)c1cc(C)cc(C)c1 ZINC000850467733 1136265197 /nfs/dbraw/zinc/26/51/97/1136265197.db2.gz SDVRDHLYEJMZIW-RDTXWAMCSA-N 0 3 344.411 3.604 20 5 EHBDHN CC(COC(=O)[C@H](Oc1ccc(Cl)cc1)c1ccccc1)[N+](=O)[O-] ZINC000813102526 1136288246 /nfs/dbraw/zinc/28/82/46/1136288246.db2.gz HQZDZEGUAXTKGC-MLGOLLRUSA-N 0 3 349.770 3.669 20 5 EHBDHN COc1ccc(-c2cc(C(=O)OCC(C)[N+](=O)[O-])sc2C)cc1 ZINC000813102520 1136288344 /nfs/dbraw/zinc/28/83/44/1136288344.db2.gz HOCZKHBDNJHLQJ-JTQLQIEISA-N 0 3 335.381 3.554 20 5 EHBDHN CC(COC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)[N+](=O)[O-] ZINC000813112200 1136294444 /nfs/dbraw/zinc/29/44/44/1136294444.db2.gz NPPCEMCANUDJJE-LBPRGKRZSA-N 0 3 349.770 3.741 20 5 EHBDHN CC(COC(=O)C1(c2c(Cl)cccc2Cl)CCC1)[N+](=O)[O-] ZINC000813110282 1136294827 /nfs/dbraw/zinc/29/48/27/1136294827.db2.gz WMKPHZQCBXRTRK-SECBINFHSA-N 0 3 332.183 3.624 20 5 EHBDHN CC([C@H](OC(=O)C1CC2(CC2(F)F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000851109413 1136338539 /nfs/dbraw/zinc/33/85/39/1136338539.db2.gz XXMZUCFPZKFCNF-QKMGCCESSA-N 0 3 343.301 3.511 20 5 EHBDHN CC(C)C[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000776948691 1136883818 /nfs/dbraw/zinc/88/38/18/1136883818.db2.gz GMRINRDAIPFDSG-UKRRQHHQSA-N 0 3 326.824 3.932 20 5 EHBDHN CC[C@H](NCc1ccc(N(C)C(C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000858496018 1136973302 /nfs/dbraw/zinc/97/33/02/1136973302.db2.gz HQFWRMUHJLIELU-IBGZPJMESA-N 0 3 341.411 3.818 20 5 EHBDHN CC[C@@H](NCc1ccc(N(C)C(C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000858496019 1136973521 /nfs/dbraw/zinc/97/35/21/1136973521.db2.gz HQFWRMUHJLIELU-LJQANCHMSA-N 0 3 341.411 3.818 20 5 EHBDHN CC([C@H](OC(=O)c1coc(C(F)F)c1)c1ccccc1F)[N+](=O)[O-] ZINC000860854649 1137081279 /nfs/dbraw/zinc/08/12/79/1137081279.db2.gz FMSREQZVMVLMGU-OQPBUACISA-N 0 3 343.257 3.920 20 5 EHBDHN CO[C@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000824592031 1137144266 /nfs/dbraw/zinc/14/42/66/1137144266.db2.gz XSFNLWBDSJEOHG-HNNXBMFYSA-N 0 3 334.803 3.596 20 5 EHBDHN C[C@@H](CSc1ccccc1)N(C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359979 1137215273 /nfs/dbraw/zinc/21/52/73/1137215273.db2.gz LXGJXYNJJPNODU-KBXCAEBGSA-N 0 3 346.452 3.741 20 5 EHBDHN C[C@H](CSc1ccccc1)N(C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359981 1137215357 /nfs/dbraw/zinc/21/53/57/1137215357.db2.gz LXGJXYNJJPNODU-KDOFPFPSSA-N 0 3 346.452 3.741 20 5 EHBDHN CC([C@H](OC(=O)CSC(C)(C)C)c1ccccc1F)[N+](=O)[O-] ZINC000845872291 1137315979 /nfs/dbraw/zinc/31/59/79/1137315979.db2.gz GCGZBTGKVQIYSJ-YGRLFVJLSA-N 0 3 329.393 3.607 20 5 EHBDHN CC([C@@H](OC(=O)CC1CCSCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845873581 1137316044 /nfs/dbraw/zinc/31/60/44/1137316044.db2.gz DDBPFMGZLVEMCC-BDJLRTHQSA-N 0 3 341.404 3.609 20 5 EHBDHN CC([C@H](OC(=O)C[C@@H](C)n1cccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845877418 1137316437 /nfs/dbraw/zinc/31/64/37/1137316437.db2.gz PPOQHDBYIGLQMX-XNJGSVPQSA-N 0 3 334.347 3.528 20 5 EHBDHN Cc1nc(C2CC2)oc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881180 1137316676 /nfs/dbraw/zinc/31/66/76/1137316676.db2.gz ZCNBEJIQPHQESM-ZUZCIYMTSA-N 0 3 348.330 3.563 20 5 EHBDHN CC(C)c1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])nc1 ZINC000845882680 1137316764 /nfs/dbraw/zinc/31/67/64/1137316764.db2.gz PQUUESMGLVHRMR-PXAZEXFGSA-N 0 3 346.358 3.907 20 5 EHBDHN CC(C)c1cccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845879655 1137316780 /nfs/dbraw/zinc/31/67/80/1137316780.db2.gz WBSZVSSFSBVCJZ-SJCJKPOMSA-N 0 3 346.358 3.907 20 5 EHBDHN Cc1ccc([C@H](C)C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845878871 1137316918 /nfs/dbraw/zinc/31/69/18/1137316918.db2.gz TYNLTHOWGYHTQJ-MKBNYLNASA-N 0 3 335.331 3.780 20 5 EHBDHN C[C@@H](NC[C@@H](C[C@H](C)O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872043232 1137567372 /nfs/dbraw/zinc/56/73/72/1137567372.db2.gz HPAYUNWATDAJJP-SQWLQELKSA-N 0 3 346.402 3.939 20 5 EHBDHN CN1CCC[C@H]2[C@H]1CCN2C(=O)c1cc2ccccc2c2cccnc12 ZINC000874842444 1137624411 /nfs/dbraw/zinc/62/44/11/1137624411.db2.gz HMSGIULCUUKMML-UXHICEINSA-N 0 3 345.446 3.697 20 5 EHBDHN CC[C@@H]1CCCCCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878124653 1137703417 /nfs/dbraw/zinc/70/34/17/1137703417.db2.gz JUPLQOMQXSOAII-CYBMUJFWSA-N 0 3 330.388 3.799 20 5 EHBDHN CC[C@@H](NCc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC000878950669 1137733398 /nfs/dbraw/zinc/73/33/98/1137733398.db2.gz XIEBKVKEQRMEPN-GFCCVEGCSA-N 0 3 336.779 3.576 20 5 EHBDHN C[C@H](c1cccc(Cl)c1)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136962515 1138044620 /nfs/dbraw/zinc/04/46/20/1138044620.db2.gz AQECGINYVMOCIP-PXAZEXFGSA-N 0 3 334.803 3.975 20 5 EHBDHN Cc1ccc([C@@H](C)NC[C@@H]2COC3(CCC(C)CC3)O2)cc1[N+](=O)[O-] ZINC000777313945 1139583540 /nfs/dbraw/zinc/58/35/40/1139583540.db2.gz SBUIGHYUTUAKNH-SUUVNEMCSA-N 0 3 348.443 3.876 20 5 EHBDHN CC[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000179627622 1139769713 /nfs/dbraw/zinc/76/97/13/1139769713.db2.gz QCOJKNZTCZWMNS-DLBZAZTESA-N 0 3 336.338 3.647 20 5 EHBDHN Cc1nnc([C@H](C)N[C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000274238783 1141488388 /nfs/dbraw/zinc/48/83/88/1141488388.db2.gz QNIHOKAUECYERX-LNSITVRQSA-N 0 3 346.456 3.817 20 5 EHBDHN C[C@@]1(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCOC1 ZINC000120157722 1014510737 /nfs/dbraw/zinc/51/07/37/1014510737.db2.gz PTGIPQHFRVUXBE-GOSISDBHSA-N 0 3 346.358 3.795 20 5 EHBDHN CC[C@@H](C)[C@H](N)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000430383822 1016579697 /nfs/dbraw/zinc/57/96/97/1016579697.db2.gz JJRXJNYEOLBISG-PXAZEXFGSA-N 0 3 343.383 3.699 20 5 EHBDHN C[C@@H]1CCC[C@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001167226898 1016662985 /nfs/dbraw/zinc/66/29/85/1016662985.db2.gz DJIBNAFALYIQGT-YPMHNXCESA-N 0 3 339.823 3.697 20 5 EHBDHN C[C@@H]1C[C@@H](CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)O1 ZINC000414517053 1016948247 /nfs/dbraw/zinc/94/82/47/1016948247.db2.gz QCTAZMJFNZNBMN-DYEKYZERSA-N 0 3 347.440 3.621 20 5 EHBDHN CC[C@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H](O)C(C)C ZINC000414536825 1016963508 /nfs/dbraw/zinc/96/35/08/1016963508.db2.gz YHLZVAIECMNOHV-JKSUJKDBSA-N 0 3 349.456 3.603 20 5 EHBDHN Cc1c([C@@H](C)N[C@H](CN(C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368980 1032252377 /nfs/dbraw/zinc/25/23/77/1032252377.db2.gz PVQVZKDNOAOGGV-RDTXWAMCSA-N 0 3 345.418 3.996 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(F)c(CN(C)C)c1 ZINC000120910164 1017182485 /nfs/dbraw/zinc/18/24/85/1017182485.db2.gz FWSWSIGYKUJQLU-AWEZNQCLSA-N 0 3 345.418 3.955 20 5 EHBDHN CCc1nc(CCNCc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000892806132 1017476981 /nfs/dbraw/zinc/47/69/81/1017476981.db2.gz ZPPWNFWZBRYBNF-UHFFFAOYSA-N 0 3 325.821 3.599 20 5 EHBDHN CCS[C@H]1CCCC[C@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000190064373 1017972913 /nfs/dbraw/zinc/97/29/13/1017972913.db2.gz NANVFCRWJOEMKS-DOMZBBRYSA-N 0 3 335.429 3.890 20 5 EHBDHN CC(C)c1ccc(CN2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cc1[N+](=O)[O-] ZINC000449550999 1032771580 /nfs/dbraw/zinc/77/15/80/1032771580.db2.gz FEIPREZFTDINMT-IXDOHACOSA-N 0 3 332.444 3.701 20 5 EHBDHN CCCN(Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000610476500 1020414901 /nfs/dbraw/zinc/41/49/01/1020414901.db2.gz WIKVCDAYICLDAS-OIISXLGYSA-N 0 3 336.407 3.759 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CCC[C@@H]2COCC[C@H]21 ZINC000602485464 1032914133 /nfs/dbraw/zinc/91/41/33/1032914133.db2.gz QRDDEVWPNMBQBA-TZMCWYRMSA-N 0 3 344.333 3.615 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCCOCC1CC1 ZINC000602514053 1032951266 /nfs/dbraw/zinc/95/12/66/1032951266.db2.gz QVYBWZMUKXIEKA-UHFFFAOYSA-N 0 3 332.322 3.520 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNC3CCC(C(F)F)CC3)nc2c1 ZINC000602687617 1033070209 /nfs/dbraw/zinc/07/02/09/1033070209.db2.gz OOGSBHJNYRMERX-UHFFFAOYSA-N 0 3 325.315 3.650 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN(C[C@@H]3CCCO3)C3CCCC3)nc2c1 ZINC000610582758 1022823286 /nfs/dbraw/zinc/82/32/86/1022823286.db2.gz VSTDMEQYGZDITG-HNNXBMFYSA-N 0 3 345.399 3.660 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@H]2C[C@@H](O)C2)ccc1Oc1ccccc1Cl ZINC000449748593 1033160809 /nfs/dbraw/zinc/16/08/09/1033160809.db2.gz MNJBPMKMGDJLNX-BETUJISGSA-N 0 3 348.786 3.653 20 5 EHBDHN Cc1ccc(CN(CCc2ccccc2)[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000535825209 1023799511 /nfs/dbraw/zinc/79/95/11/1023799511.db2.gz PIMDEYZPBQMVAU-LJQANCHMSA-N 0 3 340.423 3.737 20 5 EHBDHN C[C@H](c1ccc(Cl)cc1)N(CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000176214689 1023883166 /nfs/dbraw/zinc/88/31/66/1023883166.db2.gz RDNQYOPNYMKOKK-GFCCVEGCSA-N 0 3 334.807 3.670 20 5 EHBDHN COc1ccc(CN(C)C/C=C\c2ccccc2[N+](=O)[O-])cc1OC ZINC000611252209 1024265782 /nfs/dbraw/zinc/26/57/82/1024265782.db2.gz OLPXBTQRGJNIDE-VURMDHGXSA-N 0 3 342.395 3.757 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@H](CCO)c1ccc(Cl)cc1 ZINC000342293442 1024740535 /nfs/dbraw/zinc/74/05/35/1024740535.db2.gz GLMLJIDRUSTZEU-MAVJXHJTSA-N 0 3 346.814 3.975 20 5 EHBDHN COc1ccc([C@@H]2CCCN2CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000515123759 1025034517 /nfs/dbraw/zinc/03/45/17/1025034517.db2.gz OLIVCRXKDJLMBK-IBGZPJMESA-N 0 3 342.395 3.819 20 5 EHBDHN Cc1c(CN[C@H](C)CC(=O)Nc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000478491406 1026126178 /nfs/dbraw/zinc/12/61/78/1026126178.db2.gz ONPSPNYDIXLSGO-GFCCVEGCSA-N 0 3 345.374 3.549 20 5 EHBDHN CCN(Cc1ccccc1[N+](=O)[O-])[C@@H](COC)Cc1ccccc1 ZINC000530627263 1026151628 /nfs/dbraw/zinc/15/16/28/1026151628.db2.gz NATVLFBXZOMGNG-GOSISDBHSA-N 0 3 328.412 3.674 20 5 EHBDHN Cn1ccc(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)c1 ZINC000530640464 1026173292 /nfs/dbraw/zinc/17/32/92/1026173292.db2.gz UIZSALNPSUJVEF-UHFFFAOYSA-N 0 3 327.409 3.952 20 5 EHBDHN C[C@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)C1 ZINC000127629585 1026195590 /nfs/dbraw/zinc/19/55/90/1026195590.db2.gz GHVULNVRYMBPBZ-QWHCGFSZSA-N 0 3 330.388 3.513 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC(O)(C2CCC2)CC1 ZINC000897036080 1026255291 /nfs/dbraw/zinc/25/52/91/1026255291.db2.gz HZWDHQZRHBEFSW-NTCAYCPXSA-N 0 3 330.428 3.625 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[C@H](C)C1 ZINC000452066901 1026460353 /nfs/dbraw/zinc/46/03/53/1026460353.db2.gz LTMLYUNZGAWWTE-KCQAQPDRSA-N 0 3 344.415 3.949 20 5 EHBDHN CCN(CCc1nccs1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000159192069 1026529062 /nfs/dbraw/zinc/52/90/62/1026529062.db2.gz OYOUQEQAXGMGGS-UHFFFAOYSA-N 0 3 325.821 3.769 20 5 EHBDHN COc1ccccc1CC(C)(C)NCc1ccc([N+](=O)[O-])cc1F ZINC000479971540 1026920548 /nfs/dbraw/zinc/92/05/48/1026920548.db2.gz SZLHOIWLWNTVTL-UHFFFAOYSA-N 0 3 332.375 3.853 20 5 EHBDHN CCO[C@@H]1C[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(CC)CC ZINC000444691014 1028163834 /nfs/dbraw/zinc/16/38/34/1028163834.db2.gz WRENWHMBJIWOAU-HZPDHXFCSA-N 0 3 346.431 3.545 20 5 EHBDHN CC[C@@H](C)N[C@@H](CNc1nc(C)cc(C)c1[N+](=O)[O-])c1ccco1 ZINC000343258796 1029960532 /nfs/dbraw/zinc/96/05/32/1029960532.db2.gz WDZPYGKJWYWTFV-OCCSQVGLSA-N 0 3 332.404 3.741 20 5 EHBDHN Cc1noc([C@@H]2CCCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000245529480 1030121084 /nfs/dbraw/zinc/12/10/84/1030121084.db2.gz RLFWDKNBSQVDCM-TZMCWYRMSA-N 0 3 330.388 3.535 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@]2(C1)OCc1ccccc12 ZINC000482383576 1030364434 /nfs/dbraw/zinc/36/44/34/1030364434.db2.gz YRDPTKGZIUOMDB-FQEVSTJZSA-N 0 3 338.407 3.925 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@@H]3CC[C@@H](C)O3)o2)c([N+](=O)[O-])c1 ZINC000453631584 1030434031 /nfs/dbraw/zinc/43/40/31/1030434031.db2.gz OAMWBRBKAKUCFQ-OCCSQVGLSA-N 0 3 346.383 3.521 20 5 EHBDHN COCCNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000061002526 1033416791 /nfs/dbraw/zinc/41/67/91/1033416791.db2.gz SOPQAXBCZQJJTH-UHFFFAOYSA-N 0 3 336.775 3.777 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C1CC1)C1CCC(C)CC1 ZINC000063522466 1033434690 /nfs/dbraw/zinc/43/46/90/1033434690.db2.gz NLOZAYZYEKXBTG-UHFFFAOYSA-N 0 3 345.443 3.885 20 5 EHBDHN COC[C@H](C)Oc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000594925206 1033546863 /nfs/dbraw/zinc/54/68/63/1033546863.db2.gz MQHKISIOULAGEG-GJZGRUSLSA-N 0 3 344.411 3.859 20 5 EHBDHN O=[N+]([O-])c1ccccc1CCNCc1cccc(F)c1OC(F)F ZINC000594929968 1033551188 /nfs/dbraw/zinc/55/11/88/1033551188.db2.gz QUPSNCGVPIGETQ-UHFFFAOYSA-N 0 3 340.301 3.668 20 5 EHBDHN COC[C@H](Cc1ccccc1)N[C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595011470 1033606094 /nfs/dbraw/zinc/60/60/94/1033606094.db2.gz HOQPSTJSHXREKQ-ZBFHGGJFSA-N 0 3 344.411 3.512 20 5 EHBDHN C[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)F)nc1 ZINC000595019154 1033611800 /nfs/dbraw/zinc/61/18/00/1033611800.db2.gz IYVYAEUYMLSNJE-LLVKDONJSA-N 0 3 337.326 3.657 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H](c1ccccc1)N(C)C ZINC000595003262 1033629154 /nfs/dbraw/zinc/62/91/54/1033629154.db2.gz FKWJXWFHEUCCAW-KSSFIOAISA-N 0 3 343.427 3.557 20 5 EHBDHN Cc1ccc(CN(CCCOc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000604013535 1034138522 /nfs/dbraw/zinc/13/85/22/1034138522.db2.gz OFVBDQVLJBJMKD-UHFFFAOYSA-N 0 3 330.384 3.930 20 5 EHBDHN CC[C@H](NCCN(C)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000310054806 1034209213 /nfs/dbraw/zinc/20/92/13/1034209213.db2.gz YOVLQJVXBNVUMT-HNNXBMFYSA-N 0 3 337.420 3.502 20 5 EHBDHN CC[C@@H](C)CN(C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000171948227 1034731953 /nfs/dbraw/zinc/73/19/53/1034731953.db2.gz UADYPSSSQNFBNO-MNOVXSKESA-N 0 3 327.812 3.553 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@H]1CCC[C@@H]1OCc1ccccc1 ZINC000450975254 1034974426 /nfs/dbraw/zinc/97/44/26/1034974426.db2.gz XMDWBJDPGIUIPV-HKUYNNGSSA-N 0 3 326.396 3.822 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCc2cccnc2)c2ccccc2)c1 ZINC000180073367 1035368522 /nfs/dbraw/zinc/36/85/22/1035368522.db2.gz OIKPHVQNGNCQHU-FQEVSTJZSA-N 0 3 333.391 3.912 20 5 EHBDHN Cc1c([C@@H](C)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000164535652 1035655333 /nfs/dbraw/zinc/65/53/33/1035655333.db2.gz IDXIPSDFYFZKEP-KGLIPLIRSA-N 0 3 349.431 3.563 20 5 EHBDHN CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000164554014 1035667442 /nfs/dbraw/zinc/66/74/42/1035667442.db2.gz CQQVUZMRQVZUCV-ZBFHGGJFSA-N 0 3 349.431 3.645 20 5 EHBDHN COc1cc(CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])c2ccccc2n1 ZINC000572735047 1036476376 /nfs/dbraw/zinc/47/63/76/1036476376.db2.gz OOFJLSJGYOKPDU-QGZVFWFLSA-N 0 3 349.390 3.929 20 5 EHBDHN CCC(O)(CC)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180330235 1036684904 /nfs/dbraw/zinc/68/49/04/1036684904.db2.gz OORUCXKQSPUUSG-SFHVURJKSA-N 0 3 328.412 3.825 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@H]2CCCC(F)(F)C2)c1 ZINC000539526594 1036866727 /nfs/dbraw/zinc/86/67/27/1036866727.db2.gz ZNKLLXJIYOBBOL-JTQLQIEISA-N 0 3 336.285 3.864 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)N2CC[C@H](C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000443651834 1036941789 /nfs/dbraw/zinc/94/17/89/1036941789.db2.gz JXVZIURJJKLCLL-GUTXKFCHSA-N 0 3 333.432 3.598 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(Cc3n[nH]c4ccccc43)C2)cc1 ZINC000590659589 1036995711 /nfs/dbraw/zinc/99/57/11/1036995711.db2.gz QWZVOJQKOKWIPB-HNNXBMFYSA-N 0 3 336.395 3.851 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CNC2(c3cccc(Cl)c3)CC2)c1 ZINC000271758882 1037125260 /nfs/dbraw/zinc/12/52/60/1037125260.db2.gz HMAHWNZCXUIJPG-INIZCTEOSA-N 0 3 332.787 3.561 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1C[C@@H]1Cc1ccccc1 ZINC000462751802 1037362555 /nfs/dbraw/zinc/36/25/55/1037362555.db2.gz CFKAMZYKGYEIPL-MAUKXSAKSA-N 0 3 326.396 3.714 20 5 EHBDHN CC[C@@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341221653 1037780841 /nfs/dbraw/zinc/78/08/41/1037780841.db2.gz QVBHBQJKBYYJCC-SUMWQHHRSA-N 0 3 327.384 3.663 20 5 EHBDHN Cc1ccc([C@@H](C)NCCOc2ncccc2Cl)cc1[N+](=O)[O-] ZINC000090408292 1038057208 /nfs/dbraw/zinc/05/72/08/1038057208.db2.gz MOYCORZASYGXEI-GFCCVEGCSA-N 0 3 335.791 3.681 20 5 EHBDHN CCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000027284904 1040158778 /nfs/dbraw/zinc/15/87/78/1040158778.db2.gz BJAQROLQRRHMJQ-UHFFFAOYSA-N 0 3 339.823 3.841 20 5 EHBDHN CCC[C@@H](C)[C@H]1CCCN1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787132 1040443627 /nfs/dbraw/zinc/44/36/27/1040443627.db2.gz HEDIZDDHMCMDDG-RHSMWYFYSA-N 0 3 333.432 3.742 20 5 EHBDHN CC1(CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCOCC1 ZINC000500231395 1040765420 /nfs/dbraw/zinc/76/54/20/1040765420.db2.gz NTOYWAGHCVRUAY-UHFFFAOYSA-N 0 3 347.440 3.625 20 5 EHBDHN CC[C@H]1[C@@H](C)CCN1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371473 1040790763 /nfs/dbraw/zinc/79/07/63/1040790763.db2.gz MXYURLXIVJSOIU-JQWIXIFHSA-N 0 3 344.358 3.825 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCCN2CCC=C(c3ccco3)C2)cc1 ZINC000586773630 1040991184 /nfs/dbraw/zinc/99/11/84/1040991184.db2.gz QBERYICQPGTXAS-UHFFFAOYSA-N 0 3 328.368 3.746 20 5 EHBDHN C[C@H](N[C@@H](C)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000107070107 1041813218 /nfs/dbraw/zinc/81/32/18/1041813218.db2.gz UVIVOMFVYMNLDJ-RYUDHWBXSA-N 0 3 347.802 3.926 20 5 EHBDHN CC1(C)C[C@@H](NC[C@H](O)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000279132137 1043400497 /nfs/dbraw/zinc/40/04/97/1043400497.db2.gz RCKHGSWUZVNISL-CVEARBPZSA-N 0 3 332.425 3.702 20 5 EHBDHN Cc1cnc([C@H](NCCCOc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000185302908 1126856709 /nfs/dbraw/zinc/85/67/09/1126856709.db2.gz QEYOSIKAKMOLOP-MRXNPFEDSA-N 0 3 347.440 3.870 20 5 EHBDHN COC(=O)CCC1CCN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000552059446 1127550368 /nfs/dbraw/zinc/55/03/68/1127550368.db2.gz BGQZBVLLKBABRE-UHFFFAOYSA-N 0 3 348.443 3.883 20 5 EHBDHN C[C@H]1C[C@@H](c2ccccc2)CN1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478249 1131242395 /nfs/dbraw/zinc/24/23/95/1131242395.db2.gz XXRKYODHZIPQDE-WMLDXEAASA-N 0 3 336.395 3.780 20 5 EHBDHN CC(C)(C)[C@@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000273063157 1128438601 /nfs/dbraw/zinc/43/86/01/1128438601.db2.gz MVAURWNQFASBPI-WFASDCNBSA-N 0 3 326.824 3.932 20 5 EHBDHN Cc1csc(C2(NCCCOc3ccc([N+](=O)[O-])cc3)CCC2)n1 ZINC000494808039 1120848442 /nfs/dbraw/zinc/84/84/42/1120848442.db2.gz BWTKAYSDQKWHBB-UHFFFAOYSA-N 0 3 347.440 3.798 20 5 EHBDHN Cc1ccccc1CN1CCCN(c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000915211820 1121248771 /nfs/dbraw/zinc/24/87/71/1121248771.db2.gz HDKUWOIXRTULBS-UHFFFAOYSA-N 0 3 343.402 3.755 20 5 EHBDHN COc1cccc([C@@H](CNc2ccc(C)cc2[N+](=O)[O-])N(C)C)c1 ZINC000301098272 1121604117 /nfs/dbraw/zinc/60/41/17/1121604117.db2.gz SATQTHWJGUYSHP-GOSISDBHSA-N 0 3 329.400 3.627 20 5 EHBDHN C[C@H]1CCC[C@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000078539659 1129160214 /nfs/dbraw/zinc/16/02/14/1129160214.db2.gz DNJUPBFKECSJOH-WFASDCNBSA-N 0 3 330.388 3.655 20 5 EHBDHN CN1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000301837155 1129168649 /nfs/dbraw/zinc/16/86/49/1129168649.db2.gz MKASNDFHOUXTGE-UKRRQHHQSA-N 0 3 332.791 3.501 20 5 EHBDHN CCOc1cc(NCC2CN(Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000716223316 1131364255 /nfs/dbraw/zinc/36/42/55/1131364255.db2.gz RJUPSUVZBGFNLB-UHFFFAOYSA-N 0 3 341.411 3.537 20 5 EHBDHN C[C@@H]1CCC[C@H](C)CN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000125434282 1129691546 /nfs/dbraw/zinc/69/15/46/1129691546.db2.gz FOXKSGOKCFWXCY-QWHCGFSZSA-N 0 3 330.388 3.655 20 5 EHBDHN CC(C)(NCCOCCOc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000429239438 1130173481 /nfs/dbraw/zinc/17/34/81/1130173481.db2.gz UMHCWFBPCPXWBW-UHFFFAOYSA-N 0 3 344.411 3.515 20 5 EHBDHN C[C@H](CN(C)C(=O)OC(C)(C)C)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000701878119 1130178207 /nfs/dbraw/zinc/17/82/07/1130178207.db2.gz JYAIVDKNIFZNSQ-OLZOCXBDSA-N 0 3 337.420 3.501 20 5 EHBDHN C[C@@H](NC[C@@H](c1c(F)cccc1F)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173419142 1130228569 /nfs/dbraw/zinc/22/85/69/1130228569.db2.gz SLTHKKUGMNNEBO-PXAZEXFGSA-N 0 3 349.381 3.827 20 5 EHBDHN Cc1csc(C(C)(C)NCCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000173430748 1130230919 /nfs/dbraw/zinc/23/09/19/1130230919.db2.gz UWENYHKSUNNSRB-UHFFFAOYSA-N 0 3 335.429 3.654 20 5 EHBDHN CCN(CC)Cc1ccc(C(=O)O[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000728167593 1130642252 /nfs/dbraw/zinc/64/22/52/1130642252.db2.gz PQFNBZCHYMCJCP-CYBMUJFWSA-N 0 3 346.383 3.948 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N(C)Cc2ccc(C)nc2)c1F ZINC001173191205 1131994794 /nfs/dbraw/zinc/99/47/94/1131994794.db2.gz BACCWDNJIGCXIZ-ZDUSSCGKSA-N 0 3 347.390 3.509 20 5 EHBDHN CCCCCCN1CCN([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173226401 1132007250 /nfs/dbraw/zinc/00/72/50/1132007250.db2.gz JRVJHLHPMMUFQN-KRWDZBQOSA-N 0 3 333.476 3.724 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H](c1ncccc1F)C1CC1 ZINC001173230564 1132009689 /nfs/dbraw/zinc/00/96/89/1132009689.db2.gz RXMFQNAMAZRWFE-YVEFUNNKSA-N 0 3 329.375 3.801 20 5 EHBDHN NCc1ccc2c(n1)N(c1cc3cccnc3c3ncccc13)CCC2 ZINC001169590913 1132790506 /nfs/dbraw/zinc/79/05/06/1132790506.db2.gz PVDWFHGSZGPTOI-UHFFFAOYSA-N 0 3 341.418 3.721 20 5 EHBDHN O=C1OC[C@@H]2CN(Cc3c4ccccc4cc4ccccc43)CCN12 ZINC000769482565 1133287812 /nfs/dbraw/zinc/28/78/12/1133287812.db2.gz ATOHCYHMBISZTI-KRWDZBQOSA-N 0 3 332.403 3.629 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000792913114 1134823805 /nfs/dbraw/zinc/82/38/05/1134823805.db2.gz LXXBCWHCFXSCGY-UONOGXRCSA-N 0 3 345.226 3.619 20 5 EHBDHN CC[C@@H](c1ccccc1OC)N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834352 1135332888 /nfs/dbraw/zinc/33/28/88/1135332888.db2.gz FXIKGSHGOYLJKN-ZWKOTPCHSA-N 0 3 344.411 3.720 20 5 EHBDHN Cc1c(CN2C[C@H](C(=O)OC(C)(C)C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC001195250334 1135399405 /nfs/dbraw/zinc/39/94/05/1135399405.db2.gz MBUCTEKVNBDKTA-XJKSGUPXSA-N 0 3 348.443 3.703 20 5 EHBDHN CCCN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC(C)(C)O ZINC000809942317 1135902712 /nfs/dbraw/zinc/90/27/12/1135902712.db2.gz HOVAWQDDYJGSMD-UHFFFAOYSA-N 0 3 335.231 3.885 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CNC[C@@]2(CO)C[C@H]2c2ccccc2)c1 ZINC000810165504 1135929710 /nfs/dbraw/zinc/92/97/10/1135929710.db2.gz URSKPJDDCSLDJD-FUHWJXTLSA-N 0 3 346.814 3.504 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC(c3ccccc3F)CC2)cc1 ZINC000776278059 1136130884 /nfs/dbraw/zinc/13/08/84/1136130884.db2.gz RCBKGGAINOKBGT-LJQANCHMSA-N 0 3 344.386 3.647 20 5 EHBDHN CCN(Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812849007 1136260155 /nfs/dbraw/zinc/26/01/55/1136260155.db2.gz NSPWHADXAJSQLL-KUHUBIRLSA-N 0 3 344.411 3.547 20 5 EHBDHN CCOc1ccccc1Oc1ccccc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813105428 1136293841 /nfs/dbraw/zinc/29/38/41/1136293841.db2.gz MCUFFURKTPUBKA-ZDUSSCGKSA-N 0 3 345.351 3.700 20 5 EHBDHN CC(COC(=O)c1ccc(Oc2ccc(F)cc2F)cc1)[N+](=O)[O-] ZINC000813106183 1136294094 /nfs/dbraw/zinc/29/40/94/1136294094.db2.gz ZZFQOMZRFQUCEQ-SNVBAGLBSA-N 0 3 337.278 3.579 20 5 EHBDHN CC(COC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)[N+](=O)[O-] ZINC000813106866 1136294255 /nfs/dbraw/zinc/29/42/55/1136294255.db2.gz IYBHUTMNGNKRBD-SECBINFHSA-N 0 3 339.269 3.593 20 5 EHBDHN Cc1c(CNC[C@@H](O)c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-] ZINC000819262129 1136929523 /nfs/dbraw/zinc/92/95/23/1136929523.db2.gz RNTWRDMXAYOSDN-MRXNPFEDSA-N 0 3 338.766 3.519 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000859830161 1137033486 /nfs/dbraw/zinc/03/34/86/1137033486.db2.gz NECOVKJHNUFIMG-YDEXJTGXSA-N 0 3 333.215 3.803 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN3C[C@@H]4C[C@@H](c5ccccc5)[C@@H]4C3)nc2c1 ZINC000859929972 1137037277 /nfs/dbraw/zinc/03/72/77/1137037277.db2.gz NWJDBEMKDSSVJM-BHYGNILZSA-N 0 3 349.390 3.972 20 5 EHBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCc1cccnc1F ZINC000794826176 1137264703 /nfs/dbraw/zinc/26/47/03/1137264703.db2.gz AOKVVWRMXBWMDX-ZDUSSCGKSA-N 0 3 335.404 3.789 20 5 EHBDHN CC([C@H](OC(=O)[C@@H](C)c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881186 1137316680 /nfs/dbraw/zinc/31/66/80/1137316680.db2.gz ZENLTFVNDZVPQR-DCGLDWPTSA-N 0 3 331.343 3.879 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H]1CCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845881956 1137317095 /nfs/dbraw/zinc/31/70/95/1137317095.db2.gz MZNJYYGGHGYVHR-GIPNMCIBSA-N 0 3 331.290 3.511 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1c2ccccc2[C@@H](N)C1(C)C ZINC000867989025 1137392697 /nfs/dbraw/zinc/39/26/97/1137392697.db2.gz ZWTCCYLYYJTSBX-QGZVFWFLSA-N 0 3 339.395 3.650 20 5 EHBDHN C[C@H](NC1CCC(OC(F)F)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077245 1137570037 /nfs/dbraw/zinc/57/00/37/1137570037.db2.gz DGQLQKKVGAVGIE-WHXUTIOJSA-N 0 3 332.322 3.935 20 5 EHBDHN C[C@H]1CCC[C@@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966240 1137697441 /nfs/dbraw/zinc/69/74/41/1137697441.db2.gz DXQYDBVYFMXNAO-QWHCGFSZSA-N 0 3 330.388 3.655 20 5 EHBDHN CCC[C@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)(C)C ZINC000878670271 1137724446 /nfs/dbraw/zinc/72/44/46/1137724446.db2.gz TUVCKZIDAUKTHE-AWEZNQCLSA-N 0 3 332.404 3.949 20 5 EHBDHN C[C@H](NC1(C2CC2)CCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000887147359 1138222589 /nfs/dbraw/zinc/22/25/89/1138222589.db2.gz JIBLCAMKWADOMT-NSHDSACASA-N 0 3 328.372 3.628 20 5 EHBDHN CCOc1ccc([C@@H](C)NCc2ccccc2COC)cc1[N+](=O)[O-] ZINC000152715106 1139105435 /nfs/dbraw/zinc/10/54/35/1139105435.db2.gz XIOKMLNQACDYAB-CQSZACIVSA-N 0 3 344.411 3.991 20 5 EHBDHN C[C@H]1CCC[C@H](C)C1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000182946539 1140003571 /nfs/dbraw/zinc/00/35/71/1140003571.db2.gz QBFLQGLEWRYDBW-RYUDHWBXSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@H]1C[C@H](N(C)c2ncc([N+](=O)[O-])s2)CCN1Cc1ccccc1 ZINC000192460149 1140534651 /nfs/dbraw/zinc/53/46/51/1140534651.db2.gz BFEMBQSIUVIRLB-DZGCQCFKSA-N 0 3 346.456 3.541 20 5 EHBDHN C[C@H](NC(=O)Nc1cccc(CN(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000271617045 1141407248 /nfs/dbraw/zinc/40/72/48/1141407248.db2.gz DHUVAVMTZIJLRI-ZDUSSCGKSA-N 0 3 342.399 3.539 20 5 EHBDHN CC(=O)Nc1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000154464034 1015465536 /nfs/dbraw/zinc/46/55/36/1015465536.db2.gz MQLJDLJRVQBZRU-UHFFFAOYSA-N 0 3 341.411 3.964 20 5 EHBDHN COc1ccc(C)cc1[C@H](C)NCCOc1ccccc1[N+](=O)[O-] ZINC000459692656 1032418656 /nfs/dbraw/zinc/41/86/56/1032418656.db2.gz MNPJCOIYRJDASK-AWEZNQCLSA-N 0 3 330.384 3.641 20 5 EHBDHN CC[C@@H](C[C@H](C)CO)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610345670 1018360651 /nfs/dbraw/zinc/36/06/51/1018360651.db2.gz YGLVEXOWMUJLCN-JSGCOSHPSA-N 0 3 349.456 3.605 20 5 EHBDHN C[C@@H]1C[C@H](c2ccccc2F)N(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000178864599 1019321639 /nfs/dbraw/zinc/32/16/39/1019321639.db2.gz MFPZGDCMUNTSSG-ZNOIYHFQSA-N 0 3 344.386 3.850 20 5 EHBDHN CN(C)[C@H](CNCc1cc([N+](=O)[O-])ccc1Cl)c1cccs1 ZINC000060774035 1032865808 /nfs/dbraw/zinc/86/58/08/1032865808.db2.gz AFLQVYQMXXCUOT-CQSZACIVSA-N 0 3 339.848 3.702 20 5 EHBDHN CC[C@H](C)CN(CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000177855572 1020213449 /nfs/dbraw/zinc/21/34/49/1020213449.db2.gz DDLCOMAYZDYNNC-NSHDSACASA-N 0 3 327.812 3.555 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNCC3(c4ccc(F)cc4)CC3)nc2c1 ZINC000602516564 1032928380 /nfs/dbraw/zinc/92/83/80/1032928380.db2.gz NNFBMZWYSYTPTB-UHFFFAOYSA-N 0 3 341.342 3.697 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(CCCO)[C@H]2CCc3ccccc32)cc1F ZINC000276270540 1020984186 /nfs/dbraw/zinc/98/41/86/1020984186.db2.gz CSXDPFDLTXTHKC-SFHVURJKSA-N 0 3 344.386 3.606 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC[C@@H](c2cccs2)N2CCCC2)n1 ZINC000178150573 1021793459 /nfs/dbraw/zinc/79/34/59/1021793459.db2.gz KRGYHAIJHXCZBF-AWEZNQCLSA-N 0 3 332.429 3.609 20 5 EHBDHN Cc1ncsc1CCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602676890 1033079707 /nfs/dbraw/zinc/07/97/07/1033079707.db2.gz TYBVJNDGDHZOEW-UHFFFAOYSA-N 0 3 345.346 3.711 20 5 EHBDHN CO[C@](C)(CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000602677784 1033081388 /nfs/dbraw/zinc/08/13/88/1033081388.db2.gz UKUKOUWYPVZKRM-CQSZACIVSA-N 0 3 332.322 3.518 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nc(CN3CC[C@@H](CC4CC4)C3)co2)cc1 ZINC000550405560 1022815159 /nfs/dbraw/zinc/81/51/59/1022815159.db2.gz UDYKVXZHCNIJSD-AWEZNQCLSA-N 0 3 327.384 3.872 20 5 EHBDHN CN1C[C@H]2C[C@@H](C1)N(C(=O)c1c3ccccc3cc3ccccc31)C2 ZINC001270378030 1022914484 /nfs/dbraw/zinc/91/44/84/1022914484.db2.gz XMMLZOWGKQEERN-QAPCUYQASA-N 0 3 330.431 3.769 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN(Cc2ccc(F)cc2)C2CC2)cc1 ZINC000065208977 1023916618 /nfs/dbraw/zinc/91/66/18/1023916618.db2.gz SCANEEKGWOEYRL-UHFFFAOYSA-N 0 3 330.359 3.777 20 5 EHBDHN CC(=O)Nc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000178486301 1024324401 /nfs/dbraw/zinc/32/44/01/1024324401.db2.gz LCWOLDXQYVEULQ-ZDUSSCGKSA-N 0 3 327.384 3.712 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](OCc2ccncc2)C1 ZINC000280899670 1024410677 /nfs/dbraw/zinc/41/06/77/1024410677.db2.gz DSUPKIIDKRLVOC-QAPCUYQASA-N 0 3 341.411 3.650 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC(OCC3CCCC3)CC2)c1 ZINC000434899654 1024490666 /nfs/dbraw/zinc/49/06/66/1024490666.db2.gz ABKXUVARVRKYNC-UHFFFAOYSA-N 0 3 348.443 3.645 20 5 EHBDHN C[C@@H](c1ccccc1)N1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957239 1024525608 /nfs/dbraw/zinc/52/56/08/1024525608.db2.gz ZMKBBUVSXQAOEL-SWLSCSKDSA-N 0 3 346.818 3.891 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCCOc1ccc(C)cc1 ZINC000507947675 1024790723 /nfs/dbraw/zinc/79/07/23/1024790723.db2.gz FKULRHYLSIEJML-UHFFFAOYSA-N 0 3 344.411 3.861 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]1CC(C)(C)C ZINC000435441719 1024927314 /nfs/dbraw/zinc/92/73/14/1024927314.db2.gz HJIQQKIJLYRHQZ-HNNXBMFYSA-N 0 3 333.432 3.742 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@H]3CSC3(C)C)o2)c([N+](=O)[O-])c1 ZINC000515140017 1025042308 /nfs/dbraw/zinc/04/23/08/1025042308.db2.gz BKQSGEBKBAJPFY-INIZCTEOSA-N 0 3 348.424 3.847 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000521479192 1025404298 /nfs/dbraw/zinc/40/42/98/1025404298.db2.gz BVPWMOUXGJTRJZ-SFHVURJKSA-N 0 3 330.359 3.950 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNCC[C@H]3CCC(F)(F)C3)nc2c1 ZINC000898013715 1033288916 /nfs/dbraw/zinc/28/89/16/1033288916.db2.gz GQLFJHIMHGRHNK-SNVBAGLBSA-N 0 3 325.315 3.651 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCC2(Cc3ccc(F)cc3)CC2)c(F)c1 ZINC000478327743 1026067032 /nfs/dbraw/zinc/06/70/32/1026067032.db2.gz ZTTAUBYKPQYPFZ-UHFFFAOYSA-N 0 3 332.350 3.986 20 5 EHBDHN Cc1c(CNCc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000048018021 1027660494 /nfs/dbraw/zinc/66/04/94/1027660494.db2.gz OJSKUKOMJUPBAE-UHFFFAOYSA-N 0 3 335.201 3.956 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc(CN3CC[C@@H](C4CCCC4)C3)n2)cc1 ZINC000420958747 1027928052 /nfs/dbraw/zinc/92/80/52/1027928052.db2.gz CLPIMNJYUZYSMP-OAHLLOKOSA-N 0 3 342.399 3.657 20 5 EHBDHN COCc1ccccc1/C=C(\C)CNCc1ccccc1[N+](=O)[O-] ZINC000509972476 1028139160 /nfs/dbraw/zinc/13/91/60/1028139160.db2.gz QLTNZFGCNJJCSO-RVDMUPIBSA-N 0 3 326.396 3.934 20 5 EHBDHN C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])s2)CCN1Cc1ccccc1 ZINC000192480552 1029684576 /nfs/dbraw/zinc/68/45/76/1029684576.db2.gz HDPGSRLYTSFHNX-TZMCWYRMSA-N 0 3 332.429 3.516 20 5 EHBDHN CC(C)(CO)CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453268785 1030005538 /nfs/dbraw/zinc/00/55/38/1030005538.db2.gz BHUMIOVHGVZULW-GOSISDBHSA-N 0 3 328.412 3.682 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H](C)N2[C@@H](C)CC[C@@H]2C)n1 ZINC000526954268 1030503500 /nfs/dbraw/zinc/50/35/00/1030503500.db2.gz DPUKKFPPBRUGII-AVGNSLFASA-N 0 3 330.388 3.887 20 5 EHBDHN C[C@H](NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cn2ccccc2n1 ZINC000550918197 1030799156 /nfs/dbraw/zinc/79/91/56/1030799156.db2.gz YYWTXKXHCWOUNJ-LBPRGKRZSA-N 0 3 344.802 3.789 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@@H](Cc2nccs2)C1 ZINC000898071951 1033325046 /nfs/dbraw/zinc/32/50/46/1033325046.db2.gz VNRSXUGSAJGJDY-KQIUPUNMSA-N 0 3 329.425 3.629 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCc1sc(C)nc1C ZINC000595014593 1033607530 /nfs/dbraw/zinc/60/75/30/1033607530.db2.gz BXBJYNOXIOECDC-JTQLQIEISA-N 0 3 335.429 3.570 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](c1ccccc1)N(C)C ZINC000595003263 1033628333 /nfs/dbraw/zinc/62/83/33/1033628333.db2.gz FKWJXWFHEUCCAW-RDTXWAMCSA-N 0 3 343.427 3.557 20 5 EHBDHN Cc1csc([C@@H](C)NCCc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000599041508 1033670539 /nfs/dbraw/zinc/67/05/39/1033670539.db2.gz DRIMYYKAALFYLQ-SNVBAGLBSA-N 0 3 325.821 3.906 20 5 EHBDHN COc1cccc([C@@H](CN[C@H](C)c2cccc([N+](=O)[O-])c2)OC)c1 ZINC000599060972 1033701715 /nfs/dbraw/zinc/70/17/15/1033701715.db2.gz ICONOWLMTAMBHD-FZKQIMNGSA-N 0 3 330.384 3.642 20 5 EHBDHN Cc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000593013609 1033806953 /nfs/dbraw/zinc/80/69/53/1033806953.db2.gz KDSGNDBVCPNCHH-NWDGAFQWSA-N 0 3 346.305 3.589 20 5 EHBDHN C[C@@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCC(F)CC1 ZINC000595819085 1033993712 /nfs/dbraw/zinc/99/37/12/1033993712.db2.gz MEHNICQQNSHIMS-LKSINWNRSA-N 0 3 348.378 3.651 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@H]1CC1(C)C ZINC000595909474 1034025131 /nfs/dbraw/zinc/02/51/31/1034025131.db2.gz OLRVGBRNXHMSRK-WCQYABFASA-N 0 3 330.388 3.684 20 5 EHBDHN Cc1cccc(NCC2CCN(Cc3ccncc3)CC2)c1[N+](=O)[O-] ZINC000596436699 1034245261 /nfs/dbraw/zinc/24/52/61/1034245261.db2.gz OXAGFUANKUIUNL-UHFFFAOYSA-N 0 3 340.427 3.622 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC([C@@H]2CCCCO2)CC1 ZINC000597225017 1034625788 /nfs/dbraw/zinc/62/57/88/1034625788.db2.gz LOTZPSJAFNQSCE-XZXOBPBMSA-N 0 3 330.428 3.889 20 5 EHBDHN CN(CCc1nccs1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000180179085 1036059293 /nfs/dbraw/zinc/05/92/93/1036059293.db2.gz SNRIXSYFQGRPML-UHFFFAOYSA-N 0 3 343.408 3.986 20 5 EHBDHN CCC[C@@H](N[C@@H]1CCCC(F)(F)[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000414305424 1036557731 /nfs/dbraw/zinc/55/77/31/1036557731.db2.gz RTQOFKZHXBHJFL-KFWWJZLASA-N 0 3 328.359 3.574 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000170647942 1036659716 /nfs/dbraw/zinc/65/97/16/1036659716.db2.gz NOKSMWBHBKJRLS-ZIAGYGMSSA-N 0 3 349.431 3.502 20 5 EHBDHN CC[C@@H](NCc1cccc([N+](=O)[O-])c1C)c1ccc2c(c1)OCCO2 ZINC000180639460 1037042783 /nfs/dbraw/zinc/04/27/83/1037042783.db2.gz WKGOQLKFZLDBFQ-MRXNPFEDSA-N 0 3 342.395 3.915 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@H](C2CCC2)C1 ZINC000591061787 1037221815 /nfs/dbraw/zinc/22/18/15/1037221815.db2.gz IJRZIFUAFMCBLT-DOMZBBRYSA-N 0 3 342.399 3.828 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[C@@H](C)CC1 ZINC000249836045 1037611816 /nfs/dbraw/zinc/61/18/16/1037611816.db2.gz RXSDBQYYTWVLNO-CHWSQXEVSA-N 0 3 330.388 3.828 20 5 EHBDHN CCN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCOC1 ZINC000463034343 1037692105 /nfs/dbraw/zinc/69/21/05/1037692105.db2.gz FDAWHMYEHAFEON-CYBMUJFWSA-N 0 3 332.425 3.934 20 5 EHBDHN CC[C@H](CSC)N(C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000167416956 1038133820 /nfs/dbraw/zinc/13/38/20/1038133820.db2.gz LTIQHKJPUSWSSO-LLVKDONJSA-N 0 3 347.278 3.931 20 5 EHBDHN CC(C)[C@H](CO)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000554089113 1038901768 /nfs/dbraw/zinc/90/17/68/1038901768.db2.gz RNOIWMDGILABPR-PKOBYXMFSA-N 0 3 328.412 3.538 20 5 EHBDHN C[C@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)C1 ZINC000246585154 1038913363 /nfs/dbraw/zinc/91/33/63/1038913363.db2.gz GHVULNVRYMBPBZ-STQMWFEESA-N 0 3 330.388 3.513 20 5 EHBDHN COC(=O)C(C)(C)CCNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000512491947 1039501047 /nfs/dbraw/zinc/50/10/47/1039501047.db2.gz MXNDFSPTUMEOHA-UHFFFAOYSA-N 0 3 346.383 3.534 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCCOCC2CCC2)o1 ZINC000567533326 1040088928 /nfs/dbraw/zinc/08/89/28/1040088928.db2.gz VHZNDJRFOYOSIB-UHFFFAOYSA-N 0 3 330.384 3.761 20 5 EHBDHN CN(CCSc1ncc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000432920518 1040180752 /nfs/dbraw/zinc/18/07/52/1040180752.db2.gz YIZYJDKOJPCYRK-UHFFFAOYSA-N 0 3 337.832 3.867 20 5 EHBDHN CN(C)[C@@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1ccsc1 ZINC000432328560 1042911691 /nfs/dbraw/zinc/91/16/91/1042911691.db2.gz KUTIHXSCQDXRSZ-INIZCTEOSA-N 0 3 342.424 3.919 20 5 EHBDHN Cc1ccc([C@H](O)CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000279029808 1043220519 /nfs/dbraw/zinc/22/05/19/1043220519.db2.gz IHPPRCYEJUXYNH-JKSUJKDBSA-N 0 3 330.384 3.542 20 5 EHBDHN CC1(C)C[C@H](NC[C@H](O)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000279132139 1043400929 /nfs/dbraw/zinc/40/09/29/1043400929.db2.gz RCKHGSWUZVNISL-HOTGVXAUSA-N 0 3 332.425 3.702 20 5 EHBDHN Cc1ccc(C[C@H](CO)NCc2ccc(Cl)cc2[N+](=O)[O-])cc1C ZINC001658277488 1126261913 /nfs/dbraw/zinc/26/19/13/1126261913.db2.gz VJBRVAQFBYPHPR-QGZVFWFLSA-N 0 3 348.830 3.558 20 5 EHBDHN C[C@@H](CS(C)(=O)=O)NCc1c2ccccc2cc2ccccc21 ZINC000172122017 1127771223 /nfs/dbraw/zinc/77/12/23/1127771223.db2.gz XNVXJPSFEAJCDO-AWEZNQCLSA-N 0 3 327.449 3.516 20 5 EHBDHN COc1cc(NC[C@H](c2ccc(Cl)cc2)N(C)C)ccc1[N+](=O)[O-] ZINC000301464536 1128457645 /nfs/dbraw/zinc/45/76/45/1128457645.db2.gz GRCKRABRBRMXNI-MRXNPFEDSA-N 0 3 349.818 3.972 20 5 EHBDHN Cc1cc([N+](=O)[O-])cnc1NC[C@@H](c1ccc(Cl)cc1)N(C)C ZINC000301477347 1128467553 /nfs/dbraw/zinc/46/75/53/1128467553.db2.gz PFICKRBIHJXWEU-HNNXBMFYSA-N 0 3 334.807 3.666 20 5 EHBDHN C[C@@H]1CC2(CCC2)CN1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000762145108 1121125528 /nfs/dbraw/zinc/12/55/28/1121125528.db2.gz SYHRRDHGJLWWOI-CQSZACIVSA-N 0 3 326.400 3.680 20 5 EHBDHN CN(Cc1cc2ccccc2o1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154394433 1122596140 /nfs/dbraw/zinc/59/61/40/1122596140.db2.gz LYNXKZWHWHWQPB-QGZVFWFLSA-N 0 3 326.352 3.506 20 5 EHBDHN C[C@@H](CNc1cccc(F)c1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000919963680 1123248591 /nfs/dbraw/zinc/24/85/91/1123248591.db2.gz SLQLWQXCSMGWPT-ZDUSSCGKSA-N 0 3 329.375 3.593 20 5 EHBDHN CC[C@@H](C)[C@@H]1CCCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001843 1123710695 /nfs/dbraw/zinc/71/06/95/1123710695.db2.gz DSIHTARBBOQNJP-DYVFJYSZSA-N 0 3 334.416 3.862 20 5 EHBDHN CC[C@H](NCc1ccc(OC)c(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000078635514 1129174816 /nfs/dbraw/zinc/17/48/16/1129174816.db2.gz UCIKRUAMTYNVDT-INIZCTEOSA-N 0 3 330.384 3.853 20 5 EHBDHN C[C@H]1CCC[C@H](C)N(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000131027065 1129376419 /nfs/dbraw/zinc/37/64/19/1129376419.db2.gz YSYQPZBNUGZPQI-STQMWFEESA-N 0 3 330.388 3.655 20 5 EHBDHN CSc1ccc([C@@H](CNc2cc(C)c([N+](=O)[O-])cn2)N(C)C)cc1 ZINC000338837400 1129413430 /nfs/dbraw/zinc/41/34/30/1129413430.db2.gz OAINQKPXRPZTKB-MRXNPFEDSA-N 0 3 346.456 3.735 20 5 EHBDHN Cc1ccc([C@H](CN[C@H](C)c2cccc([N+](=O)[O-])c2)N2CCCC2)o1 ZINC000173371072 1130219542 /nfs/dbraw/zinc/21/95/42/1130219542.db2.gz WNANDWZYALZFQX-QAPCUYQASA-N 0 3 343.427 3.984 20 5 EHBDHN CCCC(=O)NC[C@H]1CCCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245538853 1130233243 /nfs/dbraw/zinc/23/32/43/1130233243.db2.gz ZFPVKUUNPBDOFW-HZPDHXFCSA-N 0 3 347.459 3.593 20 5 EHBDHN CC[C@H](C)[C@@H](O)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000245976140 1130335571 /nfs/dbraw/zinc/33/55/71/1130335571.db2.gz OSXQVIVIVROWSG-ZOCIIQOWSA-N 0 3 328.412 3.681 20 5 EHBDHN CC(C)[C@@H]1CCCN(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000738241925 1131465838 /nfs/dbraw/zinc/46/58/38/1131465838.db2.gz VASOVEKMWDWZRQ-OAHLLOKOSA-N 0 3 343.431 3.569 20 5 EHBDHN CCCN(Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000740881781 1131553052 /nfs/dbraw/zinc/55/30/52/1131553052.db2.gz CWSQXBYFLXWXKI-USXIJHARSA-N 0 3 336.407 3.759 20 5 EHBDHN COC(=O)[C@H]1CCCC[C@H]1CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860263 1132582959 /nfs/dbraw/zinc/58/29/59/1132582959.db2.gz VYKFJNJSGUQUPC-YJBOKZPZSA-N 0 3 346.427 3.539 20 5 EHBDHN COc1ccc(CN[C@H](C)COc2c(C)cccc2C)cc1[N+](=O)[O-] ZINC001177463525 1133064898 /nfs/dbraw/zinc/06/48/98/1133064898.db2.gz BJORVFPWXUMRDR-OAHLLOKOSA-N 0 3 344.411 3.777 20 5 EHBDHN O=C(Nc1cc2cccnc2c2ncccc12)[C@@H]1CCCN1CC1CC1 ZINC001182558715 1133697015 /nfs/dbraw/zinc/69/70/15/1133697015.db2.gz ZGHBIIOTNMGEQY-SFHVURJKSA-N 0 3 346.434 3.596 20 5 EHBDHN C[C@@H]1C[C@H](c2ccccc2)CN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886600 1134099977 /nfs/dbraw/zinc/09/99/77/1134099977.db2.gz WGAZCGAXJHFDSH-CJNGLKHVSA-N 0 3 341.367 3.881 20 5 EHBDHN CN(Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCCN(c2ccccc2)C1 ZINC000788481271 1134130032 /nfs/dbraw/zinc/13/00/32/1134130032.db2.gz HFPCAGTVIXUVBJ-KRWDZBQOSA-N 0 3 343.402 3.835 20 5 EHBDHN CC(C)Oc1ccccc1[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000774982217 1134176909 /nfs/dbraw/zinc/17/69/09/1134176909.db2.gz RASXMRULHYRVOE-RDTXWAMCSA-N 0 3 344.411 3.766 20 5 EHBDHN CN1CC(CNc2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC001170254085 1134733123 /nfs/dbraw/zinc/73/31/23/1134733123.db2.gz HVHJIZXVMHJBIO-UHFFFAOYSA-N 0 3 329.425 3.720 20 5 EHBDHN COc1ccc(C[C@H](C)NCc2ccc(F)cc2F)c([N+](=O)[O-])c1 ZINC001170299286 1134738173 /nfs/dbraw/zinc/73/81/73/1134738173.db2.gz UVLGQGZFZLNONE-NSHDSACASA-N 0 3 336.338 3.602 20 5 EHBDHN Cc1cc(C)c2c(c1)CN(CCOc1ccc([N+](=O)[O-])cc1)CC2 ZINC001193526056 1135152370 /nfs/dbraw/zinc/15/23/70/1135152370.db2.gz HEKVSHSSYYVLSG-UHFFFAOYSA-N 0 3 326.396 3.649 20 5 EHBDHN CCC1(CC)[C@@H](NCc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1OC ZINC001194091441 1135231370 /nfs/dbraw/zinc/23/13/70/1135231370.db2.gz MOPADTJBXWQUQK-GJZGRUSLSA-N 0 3 326.824 3.932 20 5 EHBDHN CC(C)(C)OC(=O)CCN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194477857 1135276973 /nfs/dbraw/zinc/27/69/73/1135276973.db2.gz RNVGJJPAIJFRMW-OAHLLOKOSA-N 0 3 334.416 3.506 20 5 EHBDHN Cc1c(CN2C[C@@H](C)C[C@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195250331 1135399371 /nfs/dbraw/zinc/39/93/71/1135399371.db2.gz MBUCTEKVNBDKTA-BBRMVZONSA-N 0 3 348.443 3.703 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCc1ccncc1 ZINC000811483008 1136091584 /nfs/dbraw/zinc/09/15/84/1136091584.db2.gz AFIMWNXCJWNUMI-UHFFFAOYSA-N 0 3 326.183 3.629 20 5 EHBDHN CC[C@@H]1c2ccsc2CCN1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275029 1136129234 /nfs/dbraw/zinc/12/92/34/1136129234.db2.gz FOMIBXORJSPDOV-HZPDHXFCSA-N 0 3 332.425 3.699 20 5 EHBDHN C[C@H](c1ccc(F)c(F)c1)N(C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274372 1136129429 /nfs/dbraw/zinc/12/94/29/1136129429.db2.gz HFTLOTDYQPDFFQ-PIGZYNQJSA-N 0 3 336.338 3.599 20 5 EHBDHN CC(COC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1)[N+](=O)[O-] ZINC000813107939 1136293857 /nfs/dbraw/zinc/29/38/57/1136293857.db2.gz RVRTUWSVYGMIEZ-LRDDRELGSA-N 0 3 349.383 3.868 20 5 EHBDHN CC(COC(=O)CCCC(=O)c1ccc(Cl)c(Cl)c1)[N+](=O)[O-] ZINC000813108001 1136294148 /nfs/dbraw/zinc/29/41/48/1136294148.db2.gz STJALQCRJGSYSF-VIFPVBQESA-N 0 3 348.182 3.555 20 5 EHBDHN CC(COC(=O)CCCC(=O)c1ccc(Cl)c(Cl)c1)[N+](=O)[O-] ZINC000813108000 1136294165 /nfs/dbraw/zinc/29/41/65/1136294165.db2.gz STJALQCRJGSYSF-SECBINFHSA-N 0 3 348.182 3.555 20 5 EHBDHN CCOc1ccccc1Oc1ccccc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813105426 1136294321 /nfs/dbraw/zinc/29/43/21/1136294321.db2.gz MCUFFURKTPUBKA-CYBMUJFWSA-N 0 3 345.351 3.700 20 5 EHBDHN CC(COC(=O)c1cccc(F)c1Sc1ccccc1)[N+](=O)[O-] ZINC000813110275 1136294759 /nfs/dbraw/zinc/29/47/59/1136294759.db2.gz WJHPAFMPCHERPG-NSHDSACASA-N 0 3 335.356 3.799 20 5 EHBDHN CCOc1ccccc1[C@@H](CC)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776605371 1136467888 /nfs/dbraw/zinc/46/78/88/1136467888.db2.gz KXPJUJBOXLGKSM-MSOLQXFVSA-N 0 3 344.411 3.768 20 5 EHBDHN CC(C)Oc1ccccc1[C@@H](C)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776606610 1136470530 /nfs/dbraw/zinc/47/05/30/1136470530.db2.gz YJSCDWIOZNNSBX-RDTXWAMCSA-N 0 3 344.411 3.766 20 5 EHBDHN CN(C)[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)c1ccccc1 ZINC000111195310 1136520353 /nfs/dbraw/zinc/52/03/53/1136520353.db2.gz XIQZUXGNAUJIBI-HNNXBMFYSA-N 0 3 342.424 3.919 20 5 EHBDHN CCS(=O)(=O)C[C@H](C)NCc1c2ccccc2cc2ccccc21 ZINC000113349623 1136697910 /nfs/dbraw/zinc/69/79/10/1136697910.db2.gz FUYIZILLNXIZRF-HNNXBMFYSA-N 0 3 341.476 3.906 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC(c3ccsc3)CC2)cc1 ZINC000776882660 1136773280 /nfs/dbraw/zinc/77/32/80/1136773280.db2.gz PVUXBNYOTRKKTO-KRWDZBQOSA-N 0 3 332.425 3.569 20 5 EHBDHN COc1ccc(C[C@@H](C)N(C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000109839900 1136895796 /nfs/dbraw/zinc/89/57/96/1136895796.db2.gz UENAJHQRQGOMMZ-CQSZACIVSA-N 0 3 344.411 3.675 20 5 EHBDHN CC[C@@H](COCC(F)(F)F)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000824554435 1137142642 /nfs/dbraw/zinc/14/26/42/1137142642.db2.gz GFQROAPFVZSPSQ-JTQLQIEISA-N 0 3 340.729 3.695 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CCO[C@@H](c3ccncc3)C2)c1 ZINC000824949072 1137158891 /nfs/dbraw/zinc/15/88/91/1137158891.db2.gz XGIRVTLZIPFVQN-RHSMWYFYSA-N 0 3 347.802 3.653 20 5 EHBDHN CC(C)(C)[C@H]1CCCN(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000794707002 1137239185 /nfs/dbraw/zinc/23/91/85/1137239185.db2.gz SBKSBRWXHGQUMZ-HNNXBMFYSA-N 0 3 343.431 3.569 20 5 EHBDHN CC([C@H](OC(=O)CC1CC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845878654 1137316446 /nfs/dbraw/zinc/31/64/46/1137316446.db2.gz IASKAGDJRAWQBB-OTYXRUKQSA-N 0 3 331.290 3.511 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](c1ccco1)N(C)C ZINC000872018793 1137564930 /nfs/dbraw/zinc/56/49/30/1137564930.db2.gz PPHUCPMLPOTHPX-IUODEOHRSA-N 0 3 349.456 3.863 20 5 EHBDHN C[C@@H](NCCCc1nc2ccccc2[nH]1)c1c(F)cccc1[N+](=O)[O-] ZINC000872027402 1137566060 /nfs/dbraw/zinc/56/60/60/1137566060.db2.gz JKXOKLAVIGJGFL-GFCCVEGCSA-N 0 3 342.374 3.894 20 5 EHBDHN C[C@@H](N[C@@H]1CCO[C@@H](c2cccnc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872080579 1137570238 /nfs/dbraw/zinc/57/02/38/1137570238.db2.gz AOQZSALRPKJKOZ-SUYBPPKGSA-N 0 3 345.374 3.700 20 5 EHBDHN CC[C@@H](NC1CC(n2cc([N+](=O)[O-])cn2)C1)c1cc(F)ccc1F ZINC000877054822 1137668879 /nfs/dbraw/zinc/66/88/79/1137668879.db2.gz LHMLOTIPWKXUCZ-ZEPSKSRBSA-N 0 3 336.342 3.514 20 5 EHBDHN CC(C)[C@H]1CCCC[C@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878419434 1137715062 /nfs/dbraw/zinc/71/50/62/1137715062.db2.gz FDTGRPKWLDKNLW-UKRRQHHQSA-N 0 3 344.415 3.949 20 5 EHBDHN C[C@@H]1CCC[C@H](NCc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H]1C ZINC000878446546 1137716307 /nfs/dbraw/zinc/71/63/07/1137716307.db2.gz GNYSIRQZZLGKCH-DYEKYZERSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@@H]1CCCC[C@@H]1N(C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476033 1137717346 /nfs/dbraw/zinc/71/73/46/1137717346.db2.gz VJXRXJWQEBZFJR-OCCSQVGLSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H]1CCCC[C@]1(C)NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878699152 1137725546 /nfs/dbraw/zinc/72/55/46/1137725546.db2.gz NYOQHZFUAZQRBJ-SJCJKPOMSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1nc(C2C[C@H]3CC[C@@H](C2)N3[C@H](C)c2ccccc2[N+](=O)[O-])no1 ZINC000879681206 1137755120 /nfs/dbraw/zinc/75/51/20/1137755120.db2.gz MLLAQDDASMJZCY-JZIBPQBNSA-N 0 3 342.399 3.758 20 5 EHBDHN C[C@H](NC(C)(C)c1cccs1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000348306221 1137924686 /nfs/dbraw/zinc/92/46/86/1137924686.db2.gz CPLYIJYKNYXWSY-NSHDSACASA-N 0 3 333.413 3.508 20 5 EHBDHN CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCCC1 ZINC000073158370 1138111542 /nfs/dbraw/zinc/11/15/42/1138111542.db2.gz ICAFXODBHMMUOO-UHFFFAOYSA-N 0 3 330.388 3.799 20 5 EHBDHN Cc1ccc([C@H](C)N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000079324895 1138155040 /nfs/dbraw/zinc/15/50/40/1138155040.db2.gz MBNRSNNKAQZDDM-UONOGXRCSA-N 0 3 327.384 3.581 20 5 EHBDHN CC(C)O[C@H]1C[C@@H](NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001202749049 1138269944 /nfs/dbraw/zinc/26/99/44/1138269944.db2.gz GAKIXKGGYBABHU-KDYLLFBJSA-N 0 3 330.384 3.900 20 5 EHBDHN CCC[C@@H](NCC[S@@](=O)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000127424136 1138357202 /nfs/dbraw/zinc/35/72/02/1138357202.db2.gz TZWCMGNELWAFEP-QRQCRPRQSA-N 0 3 326.462 3.573 20 5 EHBDHN Cc1nc(C[C@H]2CCCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000182744514 1139989839 /nfs/dbraw/zinc/98/98/39/1139989839.db2.gz BWLNLPPWYBNUAD-UKRRQHHQSA-N 0 3 344.415 3.610 20 5 EHBDHN C[C@@H](NC[C@@H](O)c1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000266781861 1140724253 /nfs/dbraw/zinc/72/42/53/1140724253.db2.gz NEASNZXHJZMKDP-MEBBXXQBSA-N 0 3 338.766 3.772 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000269684239 1141135158 /nfs/dbraw/zinc/13/51/58/1141135158.db2.gz SHZCKIMIUIZJOO-QZTJIDSGSA-N 0 3 330.359 3.604 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@H]1c1ccccc1 ZINC000348541161 1141548398 /nfs/dbraw/zinc/54/83/98/1141548398.db2.gz QQLHZEYAMTZNLR-SFHVURJKSA-N 0 3 339.395 3.679 20 5 EHBDHN CNC(=O)CC[C@@H]1CCCCN1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000348836521 1141592809 /nfs/dbraw/zinc/59/28/09/1141592809.db2.gz CTTFELHQISFOJS-INIZCTEOSA-N 0 3 347.459 3.599 20 5 EHBDHN CCc1nc(C)c([C@H](C)N(C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000610215074 1015005964 /nfs/dbraw/zinc/00/59/64/1015005964.db2.gz HNVKSADAKNJLIP-ZDUSSCGKSA-N 0 3 349.456 3.994 20 5 EHBDHN CSc1ccc([C@H](CNCc2ccccc2[N+](=O)[O-])N(C)C)cc1 ZINC000339591223 1015091973 /nfs/dbraw/zinc/09/19/73/1015091973.db2.gz ZBLLICCHTYDZMI-SFHVURJKSA-N 0 3 345.468 3.709 20 5 EHBDHN C[C@H](NC[C@H](O)c1ccc(F)cc1Cl)c1ccccc1[N+](=O)[O-] ZINC000274824581 1015438162 /nfs/dbraw/zinc/43/81/62/1015438162.db2.gz KRUQDRPNIAYHFF-QFYYESIMSA-N 0 3 338.766 3.772 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@@H]2Cn2cnc3ccccc32)c1 ZINC000339908755 1015881766 /nfs/dbraw/zinc/88/17/66/1015881766.db2.gz FLVVAGQVUXXFCJ-QGZVFWFLSA-N 0 3 336.395 3.609 20 5 EHBDHN CN(CCc1ccccn1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120786217 1016231385 /nfs/dbraw/zinc/23/13/85/1016231385.db2.gz DWMZCABVRVKCNO-UHFFFAOYSA-N 0 3 337.379 3.924 20 5 EHBDHN CCOCOc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000782952647 1016833349 /nfs/dbraw/zinc/83/33/49/1016833349.db2.gz NEQFRLVSDYOGKV-CQSZACIVSA-N 0 3 330.384 3.818 20 5 EHBDHN CC(C)O[C@@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000584410000 1032442811 /nfs/dbraw/zinc/44/28/11/1032442811.db2.gz DVELGCDUSROAAN-OAHLLOKOSA-N 0 3 330.384 3.854 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC[C@H](CCO)c1ccccc1 ZINC000893012394 1018155447 /nfs/dbraw/zinc/15/54/47/1018155447.db2.gz FTTFGACUMAUDME-AWEZNQCLSA-N 0 3 334.803 3.504 20 5 EHBDHN CCN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCCC1 ZINC000052559549 1018999667 /nfs/dbraw/zinc/99/96/67/1018999667.db2.gz WDECQLFFWZDRQS-UHFFFAOYSA-N 0 3 330.388 3.799 20 5 EHBDHN Cc1ccc([C@@H](C)NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000182329594 1019065002 /nfs/dbraw/zinc/06/50/02/1019065002.db2.gz FIXOLYODEIKMGI-CQSZACIVSA-N 0 3 327.384 3.501 20 5 EHBDHN CO[C@H](c1ccccc1F)[C@@H](C)NCc1ccc([N+](=O)[O-])cc1C ZINC000542725222 1019072832 /nfs/dbraw/zinc/07/28/32/1019072832.db2.gz ZOPHUXMGXXLCBB-ACJLOTCBSA-N 0 3 332.375 3.908 20 5 EHBDHN C[C@@H]1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1cccc(F)c1 ZINC000178865343 1019322253 /nfs/dbraw/zinc/32/22/53/1019322253.db2.gz VLDIJTJMASNIFK-VMDGZTHMSA-N 0 3 344.386 3.850 20 5 EHBDHN CCCCNC(=O)[C@H]1CCCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182718429 1019737962 /nfs/dbraw/zinc/73/79/62/1019737962.db2.gz LAWUPBSGLNPYMT-HOTGVXAUSA-N 0 3 347.459 3.593 20 5 EHBDHN CO[C@H]([C@H](C)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000449627033 1032923865 /nfs/dbraw/zinc/92/38/65/1032923865.db2.gz FOKDNRWCYAKQKN-KPZWWZAWSA-N 0 3 330.384 3.758 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](C)c1c(C)cccc1C ZINC000546225407 1021278253 /nfs/dbraw/zinc/27/82/53/1021278253.db2.gz IEDMJDOUCDYPFL-OAHLLOKOSA-N 0 3 341.411 3.809 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCCN(c2ccccc2)CC1 ZINC000518582799 1021349489 /nfs/dbraw/zinc/34/94/89/1021349489.db2.gz XCMDCXZVEIAVMD-INIZCTEOSA-N 0 3 325.412 3.868 20 5 EHBDHN Cc1ccc(CC[C@@H](C)NCc2nc3cc([N+](=O)[O-])ccc3o2)o1 ZINC000602572880 1032980030 /nfs/dbraw/zinc/98/00/30/1032980030.db2.gz YTIMQKJGJJPMIL-LLVKDONJSA-N 0 3 329.356 3.748 20 5 EHBDHN Cc1ccc(CC[C@H](C)NCc2nc3cc([N+](=O)[O-])ccc3o2)o1 ZINC000602572882 1032981521 /nfs/dbraw/zinc/98/15/21/1032981521.db2.gz YTIMQKJGJJPMIL-NSHDSACASA-N 0 3 329.356 3.748 20 5 EHBDHN CN(CCCCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000471819103 1022397890 /nfs/dbraw/zinc/39/78/90/1022397890.db2.gz BMDGEKPKJLSGDQ-UHFFFAOYSA-N 0 3 348.374 3.731 20 5 EHBDHN N=C(N)N(c1ccc(F)cc1)c1cc2cccnc2c2ncccc12 ZINC001167994839 1022421271 /nfs/dbraw/zinc/42/12/71/1022421271.db2.gz PECZWEXWAYAVIC-UHFFFAOYSA-N 0 3 331.354 3.954 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000425236342 1024488073 /nfs/dbraw/zinc/48/80/73/1024488073.db2.gz JUSFOBATSWYLCF-HNNXBMFYSA-N 0 3 340.427 3.936 20 5 EHBDHN CCOc1ccccc1[C@@H](CC(C)C)NCCn1ccc([N+](=O)[O-])n1 ZINC000342245292 1024537246 /nfs/dbraw/zinc/53/72/46/1024537246.db2.gz QQFJUNNBPXHFOO-MRXNPFEDSA-N 0 3 346.431 3.567 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNCC[C@@H]3CCCC3(F)F)nc2c1 ZINC000895544302 1024602762 /nfs/dbraw/zinc/60/27/62/1024602762.db2.gz IFWZCBSXWCLMNU-JTQLQIEISA-N 0 3 325.315 3.651 20 5 EHBDHN CCOc1ccc(CN(C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000515549597 1025342793 /nfs/dbraw/zinc/34/27/93/1025342793.db2.gz FWKODALYVNAGBP-UHFFFAOYSA-N 0 3 330.384 3.504 20 5 EHBDHN CO[C@H](C)CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000442997467 1025640463 /nfs/dbraw/zinc/64/04/63/1025640463.db2.gz YVHHIKROGQUGTB-GFCCVEGCSA-N 0 3 334.347 3.651 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC[C@H](c3ncc4n3CCCC4)C2)cc1 ZINC000281896176 1025650033 /nfs/dbraw/zinc/65/00/33/1025650033.db2.gz BEHOEPNUEIXAFU-INIZCTEOSA-N 0 3 340.427 3.507 20 5 EHBDHN CCC[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)(C)C ZINC000451414559 1025949277 /nfs/dbraw/zinc/94/92/77/1025949277.db2.gz DKUJGGWMKARFBU-AWEZNQCLSA-N 0 3 332.404 3.949 20 5 EHBDHN CC[C@H](c1ccc(F)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496888 1028085821 /nfs/dbraw/zinc/08/58/21/1028085821.db2.gz TUFRHUSGOXDCPR-DOTOQJQBSA-N 0 3 344.390 3.766 20 5 EHBDHN Cc1ccc(C[C@H](C)N(C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444636457 1028087316 /nfs/dbraw/zinc/08/73/16/1028087316.db2.gz DIKBJSFOCJYLQY-AWEZNQCLSA-N 0 3 338.411 3.843 20 5 EHBDHN CCc1nc(C)c([C@H](C)N(C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000525122506 1029694908 /nfs/dbraw/zinc/69/49/08/1029694908.db2.gz IIDXBUDFIRTVRO-ZDUSSCGKSA-N 0 3 349.456 3.994 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000282059897 1029721279 /nfs/dbraw/zinc/72/12/79/1029721279.db2.gz MOUVGIPNKBJTIM-MRXNPFEDSA-N 0 3 340.427 3.507 20 5 EHBDHN CC(C)C[C@H]1OCCC[C@H]1NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481756397 1029905743 /nfs/dbraw/zinc/90/57/43/1029905743.db2.gz NBDYRMSMXFYLAL-GDBMZVCRSA-N 0 3 326.824 3.932 20 5 EHBDHN Cc1c(CN[C@@H](c2ccccc2)C(C)(C)CO)cccc1[N+](=O)[O-] ZINC000429707701 1029959947 /nfs/dbraw/zinc/95/99/47/1029959947.db2.gz BOUMMRSZCABGLO-SFHVURJKSA-N 0 3 328.412 3.753 20 5 EHBDHN CCC[C@H](NCc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000192911159 1030036198 /nfs/dbraw/zinc/03/61/98/1030036198.db2.gz NOKQVKPYKYYNQA-KRWDZBQOSA-N 0 3 342.395 3.997 20 5 EHBDHN CCC1(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)COC1 ZINC000453365935 1030183425 /nfs/dbraw/zinc/18/34/25/1030183425.db2.gz LWQHXGCJURDHGL-SFHVURJKSA-N 0 3 326.396 3.700 20 5 EHBDHN C[C@@H]1CCC[C@H](C)[C@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000245880907 1030278265 /nfs/dbraw/zinc/27/82/65/1030278265.db2.gz NQERNQCGGRZCJV-ATCWAGBWSA-N 0 3 330.388 3.559 20 5 EHBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCCO1 ZINC000482286606 1030307636 /nfs/dbraw/zinc/30/76/36/1030307636.db2.gz HAWNXVDHYGHUJC-HNNXBMFYSA-N 0 3 332.425 3.934 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000159865356 1030396189 /nfs/dbraw/zinc/39/61/89/1030396189.db2.gz LXZZZZREEDBHIW-UONOGXRCSA-N 0 3 337.383 3.587 20 5 EHBDHN CC(C)C[C@@]1(CO)CCCN1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000475691256 1030588036 /nfs/dbraw/zinc/58/80/36/1030588036.db2.gz GHNMILYFGPUNRQ-MRXNPFEDSA-N 0 3 326.824 3.621 20 5 EHBDHN COc1ccc(CN2CC[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000527243073 1030732109 /nfs/dbraw/zinc/73/21/09/1030732109.db2.gz MTEQUISHTPKSTK-OAHLLOKOSA-N 0 3 330.359 3.732 20 5 EHBDHN CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCC(C)(C)C1 ZINC000483097481 1030951335 /nfs/dbraw/zinc/95/13/35/1030951335.db2.gz MNSQXKFZQVDAMP-GFCCVEGCSA-N 0 3 339.823 3.697 20 5 EHBDHN CCc1cnc(CN[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000130425287 1031168555 /nfs/dbraw/zinc/16/85/55/1031168555.db2.gz RBRGPCFVHIFYJZ-OAHLLOKOSA-N 0 3 331.441 3.725 20 5 EHBDHN Cc1c(NC(=O)CCN(C)Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000026223915 1031388102 /nfs/dbraw/zinc/38/81/02/1031388102.db2.gz CSLFYIAGTYRYGO-UHFFFAOYSA-N 0 3 345.374 3.503 20 5 EHBDHN C[C@@H]1C[C@@H](C)[C@@H](C)N(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737964 1031703860 /nfs/dbraw/zinc/70/38/60/1031703860.db2.gz HERGFMCDWSRMQA-JHJVBQTASA-N 0 3 330.388 3.511 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H](CCO)c1ccccc1)CCC2 ZINC000278662886 1031873993 /nfs/dbraw/zinc/87/39/93/1031873993.db2.gz ITSSXHAUFQRXJQ-MOPGFXCFSA-N 0 3 326.396 3.686 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@@H](Cc2nccs2)C1 ZINC000898071953 1033324346 /nfs/dbraw/zinc/32/43/46/1033324346.db2.gz VNRSXUGSAJGJDY-MFBWXBCUSA-N 0 3 329.425 3.629 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CO[C@H](C4CC4)C3)o2)cc1 ZINC000599007610 1033640096 /nfs/dbraw/zinc/64/00/96/1033640096.db2.gz QPLRZCUXFOCPRO-KDOFPFPSSA-N 0 3 328.368 3.512 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](C)c1nc(C)cs1 ZINC000595032013 1033653109 /nfs/dbraw/zinc/65/31/09/1033653109.db2.gz LCAVIGHTWWIZNH-JQWIXIFHSA-N 0 3 335.429 3.823 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H](C)c1nc(C)cs1 ZINC000595032014 1033653557 /nfs/dbraw/zinc/65/35/57/1033653557.db2.gz LCAVIGHTWWIZNH-PWSUYJOCSA-N 0 3 335.429 3.823 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCc1ncc(C)cc1C ZINC000595046704 1033665695 /nfs/dbraw/zinc/66/56/95/1033665695.db2.gz NILCKYRHCIQSMM-AWEZNQCLSA-N 0 3 329.400 3.509 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NCC1CCN(Cc2ccncc2)CC1 ZINC000596437076 1034244670 /nfs/dbraw/zinc/24/46/70/1034244670.db2.gz RGTCVCVSJSFPMU-UHFFFAOYSA-N 0 3 340.427 3.622 20 5 EHBDHN CN(c1ccccc1)c1ccc(CN[C@@]2(C)CCOC2)cc1[N+](=O)[O-] ZINC000534455288 1034578900 /nfs/dbraw/zinc/57/89/00/1034578900.db2.gz LNIOGCAJUJUDLT-IBGZPJMESA-N 0 3 341.411 3.631 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](N[C@@H]2C[C@H]3OCCC[C@@H]23)c2ccccc2)c1 ZINC000251436046 1034646404 /nfs/dbraw/zinc/64/64/04/1034646404.db2.gz AVFBLVKAOMQSFP-MTQWCTHYSA-N 0 3 338.407 3.841 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC2(CCOCC2)[C@H]1C ZINC000612540180 1035044185 /nfs/dbraw/zinc/04/41/85/1035044185.db2.gz CBNNNOBZJPTFAT-OAHLLOKOSA-N 0 3 348.443 3.773 20 5 EHBDHN Cc1c(CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)cccc1[N+](=O)[O-] ZINC000180004628 1035173530 /nfs/dbraw/zinc/17/35/30/1035173530.db2.gz JUKALHRMVIQIBC-CYBMUJFWSA-N 0 3 339.395 3.639 20 5 EHBDHN Cc1ccc([C@H](C)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000164525978 1035653393 /nfs/dbraw/zinc/65/33/93/1035653393.db2.gz KHVVKDNCTPWAQD-DZGCQCFKSA-N 0 3 349.431 3.563 20 5 EHBDHN CC[C@@H]1CCCC[C@@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000163395832 1037095059 /nfs/dbraw/zinc/09/50/59/1037095059.db2.gz OIDDBNWMHYVZHX-DOMZBBRYSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1ccc(-c2noc([C@@H](C)N3[C@H](C)CC[C@@H]3C)n2)cc1[N+](=O)[O-] ZINC000443206328 1037125675 /nfs/dbraw/zinc/12/56/75/1037125675.db2.gz WFRXGZGNSDPHSO-FRRDWIJNSA-N 0 3 330.388 3.887 20 5 EHBDHN CCOCc1ccc(CN[C@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000575880969 1037436657 /nfs/dbraw/zinc/43/66/57/1037436657.db2.gz CDNPYNFIJIFLCB-SFHVURJKSA-N 0 3 326.396 3.908 20 5 EHBDHN CN(C)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000152641800 1037446028 /nfs/dbraw/zinc/44/60/28/1037446028.db2.gz PGXVOZIMZJCGLE-UHFFFAOYSA-N 0 3 333.775 3.562 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCNC(=O)CC1CCCCC1 ZINC000540186260 1037668868 /nfs/dbraw/zinc/66/88/68/1037668868.db2.gz PZECKFVFMDGLRQ-OAHLLOKOSA-N 0 3 347.459 3.640 20 5 EHBDHN O=[N+]([O-])c1cc(CN2CCCC[C@@H]2C2CCC2)c2c(c1)COCO2 ZINC000592198795 1037944636 /nfs/dbraw/zinc/94/46/36/1037944636.db2.gz VEMHYIQHBODJLP-QGZVFWFLSA-N 0 3 332.400 3.616 20 5 EHBDHN CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])[n-]1 ZINC000488465421 1039206802 /nfs/dbraw/zinc/20/68/02/1039206802.db2.gz OHIZDSVDFHALTP-BFHYXJOUSA-N 0 3 345.447 3.898 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@H]1CC(C)(C)C ZINC000488687399 1039333791 /nfs/dbraw/zinc/33/37/91/1039333791.db2.gz ZPGZNLJVKWKDFJ-OAHLLOKOSA-N 0 3 333.432 3.742 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1cccc(CO)c1)CCCC2 ZINC000417312692 1039665817 /nfs/dbraw/zinc/66/58/17/1039665817.db2.gz ODTDKRMNAVTYNW-IBGZPJMESA-N 0 3 326.396 3.644 20 5 EHBDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298581 1039814689 /nfs/dbraw/zinc/81/46/89/1039814689.db2.gz WZEQYKDAVIBUKV-RYUDHWBXSA-N 0 3 341.839 3.943 20 5 EHBDHN CN(C)[C@H]1CCOc2c(Nc3ccc(F)cc3[N+](=O)[O-])cccc21 ZINC000432928685 1040200876 /nfs/dbraw/zinc/20/08/76/1040200876.db2.gz NWVHGAFAOWIHPY-HNNXBMFYSA-N 0 3 331.347 3.863 20 5 EHBDHN COc1ccc(CN[C@@H]2CCCNc3ccccc32)cc1[N+](=O)[O-] ZINC000278908605 1042905168 /nfs/dbraw/zinc/90/51/68/1042905168.db2.gz ZZJPYWVKWVBRTP-MRXNPFEDSA-N 0 3 327.384 3.640 20 5 EHBDHN Cc1ccc(Br)cc1CNCc1ccc([N+](=O)[O-])cc1 ZINC000190299320 1042912222 /nfs/dbraw/zinc/91/22/22/1042912222.db2.gz RORXJAAASCWKJX-UHFFFAOYSA-N 0 3 335.201 3.956 20 5 EHBDHN C[C@@H]1CCC[C@H](N(C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898518 1043598950 /nfs/dbraw/zinc/59/89/50/1043598950.db2.gz YMKUBPLKMLTKQD-KDOFPFPSSA-N 0 3 328.416 3.926 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@H]2CCCCS2)c1 ZINC000344362179 1043741108 /nfs/dbraw/zinc/74/11/08/1043741108.db2.gz RRSOQLZQZJMCRX-GFCCVEGCSA-N 0 3 332.372 3.572 20 5 EHBDHN C[C@H](NC[C@@H](O)c1cc(F)cc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000279542805 1044207603 /nfs/dbraw/zinc/20/76/03/1044207603.db2.gz QGJDBLKZLRGOQZ-MGPLVRAMSA-N 0 3 338.766 3.772 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@H](C)[C@@H](C)C1 ZINC000123078930 1128562674 /nfs/dbraw/zinc/56/26/74/1128562674.db2.gz XWJJRVJVCAPJGK-AVGNSLFASA-N 0 3 330.388 3.684 20 5 EHBDHN CSCCCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000076764794 1121656755 /nfs/dbraw/zinc/65/67/55/1121656755.db2.gz ZZFGGYLZUPBNOQ-UHFFFAOYSA-N 0 3 337.470 3.951 20 5 EHBDHN COCCOc1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000154079111 1122211119 /nfs/dbraw/zinc/21/11/19/1122211119.db2.gz OBMJVTCQOBWGMX-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN COc1ccccc1OCCN(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350602 1123573340 /nfs/dbraw/zinc/57/33/40/1123573340.db2.gz KDQRZJMRZJIULX-UHFFFAOYSA-N 0 3 344.411 3.893 20 5 EHBDHN COCc1cc([N+](=O)[O-])ccc1NC[C@H](c1ccc(F)cc1)N(C)C ZINC000080580386 1124534906 /nfs/dbraw/zinc/53/49/06/1124534906.db2.gz QRBUOTIANCWOGH-GOSISDBHSA-N 0 3 347.390 3.595 20 5 EHBDHN Cc1cc(C)cc([C@@H](C)NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000182917013 1125400747 /nfs/dbraw/zinc/40/07/47/1125400747.db2.gz WYNOSICQFAETKU-OAHLLOKOSA-N 0 3 341.411 3.525 20 5 EHBDHN COC[C@H](C)Oc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000922540461 1129568715 /nfs/dbraw/zinc/56/87/15/1129568715.db2.gz JHYGVEYSHYOILR-LSDHHAIUSA-N 0 3 344.411 3.859 20 5 EHBDHN CCCN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000021819962 1129736401 /nfs/dbraw/zinc/73/64/01/1129736401.db2.gz DDUONRJPJUFCCH-INIZCTEOSA-N 0 3 347.802 3.928 20 5 EHBDHN C[C@@H](CN(C)C(=O)OC(C)(C)C)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000701878122 1130178154 /nfs/dbraw/zinc/17/81/54/1130178154.db2.gz JYAIVDKNIFZNSQ-STQMWFEESA-N 0 3 337.420 3.501 20 5 EHBDHN Cc1ccc(C(=O)CN[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172912049 1131917685 /nfs/dbraw/zinc/91/76/85/1131917685.db2.gz LMXSFYPHOLFHNP-SFHVURJKSA-N 0 3 338.407 3.623 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@H]3CCC[C@H]3C2)c1F ZINC001173178278 1131992281 /nfs/dbraw/zinc/99/22/81/1131992281.db2.gz ACFXDYLKKMQTEN-MJBXVCDLSA-N 0 3 336.407 3.796 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1COc2ccc(Cl)cc21 ZINC001173226266 1132006807 /nfs/dbraw/zinc/00/68/07/1132006807.db2.gz WRXLIIRFLWUSLI-MEDUHNTESA-N 0 3 332.787 3.903 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)NCc1nc2ccccc2s1 ZINC001173212083 1132014025 /nfs/dbraw/zinc/01/40/25/1132014025.db2.gz WOYRJPDWQGBUOA-GFCCVEGCSA-N 0 3 327.409 3.925 20 5 EHBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCc3cccc(C(F)(F)F)c3C2)C1 ZINC001169039027 1132638441 /nfs/dbraw/zinc/63/84/41/1132638441.db2.gz MPANHCCZJQYBLO-YPMHNXCESA-N 0 3 328.334 3.509 20 5 EHBDHN CC(C)C[C@@H]1OCCC[C@H]1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000775371659 1134675214 /nfs/dbraw/zinc/67/52/14/1134675214.db2.gz OUNKCLWCLPPAAA-CVEARBPZSA-N 0 3 326.824 3.932 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CC(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170351607 1134760251 /nfs/dbraw/zinc/76/02/51/1134760251.db2.gz GKIOVCMRESETDW-CQSZACIVSA-N 0 3 326.396 3.634 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CC[C@H](c3ccccc3F)C2)c1 ZINC001170535865 1135576235 /nfs/dbraw/zinc/57/62/35/1135576235.db2.gz IRTNWEXBWNMDTO-AWEZNQCLSA-N 0 3 330.359 3.602 20 5 EHBDHN C[C@H](O)C[C@H]1CCCCCN1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700318 1135869105 /nfs/dbraw/zinc/86/91/05/1135869105.db2.gz CPTYFTGQFHIUPE-GXTWGEPZSA-N 0 3 326.824 3.764 20 5 EHBDHN CCN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCOC1 ZINC000809935408 1135902055 /nfs/dbraw/zinc/90/20/55/1135902055.db2.gz HDSFDUCTZHTNTG-SNVBAGLBSA-N 0 3 333.215 3.760 20 5 EHBDHN CC(C)(NC[C@H]1CCC[C@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC001170650851 1136161943 /nfs/dbraw/zinc/16/19/43/1136161943.db2.gz QGPDLTATISZBJF-BXUZGUMPSA-N 0 3 346.349 3.920 20 5 EHBDHN CCC[C@H](NC[C@]12OCCC[C@H]1C2(F)F)c1cccc([N+](=O)[O-])c1 ZINC000850534082 1136281145 /nfs/dbraw/zinc/28/11/45/1136281145.db2.gz ILXFUVOJRBRIFP-XHSDSOJGSA-N 0 3 340.370 3.840 20 5 EHBDHN CC(COC(=O)c1ccc(CSc2ccccc2)cc1)[N+](=O)[O-] ZINC000813113586 1136294942 /nfs/dbraw/zinc/29/49/42/1136294942.db2.gz GQMNTWOMJJFNJR-ZDUSSCGKSA-N 0 3 331.393 3.801 20 5 EHBDHN CC([C@H](OC(=O)C1CC2(CC2(F)F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000851109417 1136338379 /nfs/dbraw/zinc/33/83/79/1136338379.db2.gz XXMZUCFPZKFCNF-TXZZNMSBSA-N 0 3 343.301 3.511 20 5 EHBDHN CC(C)Oc1cccc(CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815561729 1136611289 /nfs/dbraw/zinc/61/12/89/1136611289.db2.gz OMZLELRTNHDHOR-CYBMUJFWSA-N 0 3 329.400 3.815 20 5 EHBDHN CCS[C@H](C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-])C(C)C ZINC000845878122 1137316551 /nfs/dbraw/zinc/31/65/51/1137316551.db2.gz ULCDRUDAXANQEF-UGFHNGPFSA-N 0 3 343.420 3.853 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCC1(CO)CCC1 ZINC000846104046 1137335516 /nfs/dbraw/zinc/33/55/16/1137335516.db2.gz CSTLIIQLUGSXSH-UHFFFAOYSA-N 0 3 333.215 3.544 20 5 EHBDHN CC[C@H](C[C@@H](C)O)N[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000866635267 1137371486 /nfs/dbraw/zinc/37/14/86/1137371486.db2.gz OJXSGBHXYIOVLJ-BJZITVGISA-N 0 3 328.412 3.823 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](O)c1c(F)cccc1F ZINC000773016436 1137459615 /nfs/dbraw/zinc/45/96/15/1137459615.db2.gz YKEBDFVJJNEROT-ZBEGNZNMSA-N 0 3 336.338 3.566 20 5 EHBDHN C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCc2ccccc21 ZINC001171740047 1137511119 /nfs/dbraw/zinc/51/11/19/1137511119.db2.gz ARGUWPFDJFFWPP-ZDUSSCGKSA-N 0 3 341.367 3.665 20 5 EHBDHN C[C@@H](NC[C@H]1CCN(c2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020791 1137565085 /nfs/dbraw/zinc/56/50/85/1137565085.db2.gz KKPINGGUGNTMOU-HUUCEWRRSA-N 0 3 343.402 3.911 20 5 EHBDHN CC1(C)CCCC[C@@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878446568 1137716361 /nfs/dbraw/zinc/71/63/61/1137716361.db2.gz PDLUDBCLAGWANT-AWEZNQCLSA-N 0 3 330.388 3.703 20 5 EHBDHN C[C@H]1CC(C)(C)CC[C@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447921 1137716466 /nfs/dbraw/zinc/71/64/66/1137716466.db2.gz OVZLGIYKROZIIL-GXTWGEPZSA-N 0 3 344.415 3.949 20 5 EHBDHN C[C@H]1CCCC[C@H]1N(C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476031 1137717422 /nfs/dbraw/zinc/71/74/22/1137717422.db2.gz VJXRXJWQEBZFJR-GXTWGEPZSA-N 0 3 330.388 3.655 20 5 EHBDHN CC(C)(C)[C@H]1CCCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878543501 1137719614 /nfs/dbraw/zinc/71/96/14/1137719614.db2.gz DMJQNIVOWYQCIK-ZDUSSCGKSA-N 0 3 344.415 3.903 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@@H](c2ncccn2)C1 ZINC000886685950 1138115056 /nfs/dbraw/zinc/11/50/56/1138115056.db2.gz HGJWUBWRTKQUAU-LSDHHAIUSA-N 0 3 326.400 3.634 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CC[C@@H](COCc3ccccc3)C2)c1 ZINC000075864316 1138129051 /nfs/dbraw/zinc/12/90/51/1138129051.db2.gz IGBQYBOENWCBDO-GOSISDBHSA-N 0 3 326.396 3.634 20 5 EHBDHN Cc1c([C@@H](C)NC[C@H]2COC3(CCC(C)CC3)O2)cccc1[N+](=O)[O-] ZINC000777311274 1139566773 /nfs/dbraw/zinc/56/67/73/1139566773.db2.gz AYOJDMNMENZCKH-VTLRXDCVSA-N 0 3 348.443 3.876 20 5 EHBDHN C[C@@H](NC[C@@H](O)c1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000271518379 1141386235 /nfs/dbraw/zinc/38/62/35/1141386235.db2.gz PWECTCXBUYORTC-MEBBXXQBSA-N 0 3 338.766 3.772 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H]1c1ccccc1 ZINC000348527561 1141545735 /nfs/dbraw/zinc/54/57/35/1141545735.db2.gz TWHSHQNAUOMCAU-GOSISDBHSA-N 0 3 339.395 3.679 20 5 EHBDHN C[C@@H]1CN(c2ccc3ccc4ccc(Cl)nc4c3n2)[C@@H](C)CN1C ZINC001164643636 719204849 /nfs/dbraw/zinc/20/48/49/719204849.db2.gz ZVADVIGMJFPKTK-OLZOCXBDSA-N 0 3 340.858 3.965 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](N[C@H]2CCc3c[nH]nc3C2)c2ccccc2)c1 ZINC000359895402 1015910658 /nfs/dbraw/zinc/91/06/58/1015910658.db2.gz GWIYINRSQQWNND-FXAWDEMLSA-N 0 3 348.406 3.554 20 5 EHBDHN COc1cc(C[NH2+]CC[C@H]2CCc3ccccc32)c([N+](=O)[O-])cc1[O-] ZINC000449379762 1032505844 /nfs/dbraw/zinc/50/58/44/1032505844.db2.gz UNEWKGUKCXOVRP-CQSZACIVSA-N 0 3 342.395 3.519 20 5 EHBDHN Cc1ccccc1[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000537290973 1032595132 /nfs/dbraw/zinc/59/51/32/1032595132.db2.gz UFNGJJRKNSDGKA-IBGZPJMESA-N 0 3 339.395 3.583 20 5 EHBDHN COc1ccc(C2CCN([C@H](C)c3ccccc3[N+](=O)[O-])CC2)nc1 ZINC000593041484 1032675423 /nfs/dbraw/zinc/67/54/23/1032675423.db2.gz QKKXHQBVZLGNQU-CQSZACIVSA-N 0 3 341.411 3.939 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(Cc3cnc4ccccn34)C2)cc1 ZINC000449501112 1032681026 /nfs/dbraw/zinc/68/10/26/1032681026.db2.gz OWKMUKZDFSLCQP-INIZCTEOSA-N 0 3 336.395 3.622 20 5 EHBDHN CCCn1cc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449505386 1032689736 /nfs/dbraw/zinc/68/97/36/1032689736.db2.gz XGDAWPCRAJUYET-KRWDZBQOSA-N 0 3 328.416 3.581 20 5 EHBDHN Cc1ccc(C(C)C)c(Oc2ccc(CNCCO)cc2[N+](=O)[O-])c1 ZINC000236740906 1017592304 /nfs/dbraw/zinc/59/23/04/1017592304.db2.gz GAUSOGZCYHKCLG-UHFFFAOYSA-N 0 3 344.411 3.901 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000177338556 1017647890 /nfs/dbraw/zinc/64/78/90/1017647890.db2.gz IHYVMXSLXYKAJW-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN CCS[C@H]1CCCC[C@@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000190064343 1017973388 /nfs/dbraw/zinc/97/33/88/1017973388.db2.gz NANVFCRWJOEMKS-WFASDCNBSA-N 0 3 335.429 3.890 20 5 EHBDHN C[C@H](O)C[C@@H](CNCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000893128114 1018576798 /nfs/dbraw/zinc/57/67/98/1018576798.db2.gz LHZCNMQZPLKIET-BBRMVZONSA-N 0 3 348.830 3.893 20 5 EHBDHN C[C@H]1CCCC[C@H]1N(C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548075197 1019000032 /nfs/dbraw/zinc/00/00/32/1019000032.db2.gz XGALUINHRBIZIA-SMDDNHRTSA-N 0 3 339.823 3.697 20 5 EHBDHN CC[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 ZINC000126051046 1020157674 /nfs/dbraw/zinc/15/76/74/1020157674.db2.gz HSDPIBDXZAEAOS-MRXNPFEDSA-N 0 3 330.384 3.853 20 5 EHBDHN CC(C)(C)[C@@H]1OCCC[C@@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602549542 1032958213 /nfs/dbraw/zinc/95/82/13/1032958213.db2.gz DKFQMDQCTKHNJU-SJKOYZFVSA-N 0 3 347.415 3.667 20 5 EHBDHN CO[C@H]([C@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000449633668 1032965389 /nfs/dbraw/zinc/96/53/89/1032965389.db2.gz UQPIZIORFVPSQV-KPZWWZAWSA-N 0 3 330.384 3.758 20 5 EHBDHN CC(C)OC1CCC(NCc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000602583050 1033001176 /nfs/dbraw/zinc/00/11/76/1033001176.db2.gz OQMOUZIREGUXOP-UHFFFAOYSA-N 0 3 333.388 3.562 20 5 EHBDHN CC(C)(NCc1ccc(-n2ccnc2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000175986148 1022374738 /nfs/dbraw/zinc/37/47/38/1022374738.db2.gz LKFYWIZTRKZYGD-UHFFFAOYSA-N 0 3 336.395 3.805 20 5 EHBDHN CN(C)[C@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)c1cccs1 ZINC000075469841 1024199194 /nfs/dbraw/zinc/19/91/94/1024199194.db2.gz MFMPLLPGXQCCOR-OAHLLOKOSA-N 0 3 342.424 3.919 20 5 EHBDHN C[C@H]1CN(C2CC2)C[C@H]1Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000514176399 1024201834 /nfs/dbraw/zinc/20/18/34/1024201834.db2.gz PBOYEFHPLSBSDC-TVQRCGJNSA-N 0 3 329.322 3.508 20 5 EHBDHN COC1(OC)CC2(CN(Cc3cccc([N+](=O)[O-])c3C)[C@@H]2C(C)C)C1 ZINC000895987853 1025045152 /nfs/dbraw/zinc/04/51/52/1025045152.db2.gz JJVFVQXOQDVVSG-QGZVFWFLSA-N 0 3 348.443 3.513 20 5 EHBDHN Cc1c(CN2CCC([C@H](O)c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000051531706 1025639149 /nfs/dbraw/zinc/63/91/49/1025639149.db2.gz AOMNSCQMHYUTJZ-HXUWFJFHSA-N 0 3 340.423 3.849 20 5 EHBDHN Cc1cccc([C@@H](C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC000540386799 1025659427 /nfs/dbraw/zinc/65/94/27/1025659427.db2.gz ZWRYDRZNOZLUHN-CABCVRRESA-N 0 3 341.411 3.889 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC(O)(C2CCC2)CC1 ZINC000897036081 1026256649 /nfs/dbraw/zinc/25/66/49/1026256649.db2.gz HZWDHQZRHBEFSW-QINSGFPZSA-N 0 3 330.428 3.625 20 5 EHBDHN C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H](C)NC(=O)OC(C)(C)C ZINC000310435243 1027005611 /nfs/dbraw/zinc/00/56/11/1027005611.db2.gz OFOAGBQALWHMSP-AGIUHOORSA-N 0 3 337.420 3.547 20 5 EHBDHN CN(C)[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)c1cccs1 ZINC000729629834 1027369857 /nfs/dbraw/zinc/36/98/57/1027369857.db2.gz GFDZWPMVINMMMT-GFCCVEGCSA-N 0 3 348.453 3.981 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CC[C@H](c2ccccc2F)C1 ZINC000503656012 1028007569 /nfs/dbraw/zinc/00/75/69/1028007569.db2.gz YMIGEBYZTAMROD-AWEZNQCLSA-N 0 3 330.359 3.602 20 5 EHBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccc(C(F)F)cc3)C2)nc1 ZINC000183968708 1028590499 /nfs/dbraw/zinc/59/04/99/1028590499.db2.gz ZJHBSVBAMYGEFM-CQSZACIVSA-N 0 3 348.353 3.614 20 5 EHBDHN Cc1cc(-n2ccnc2)ccc1CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000192152427 1029604754 /nfs/dbraw/zinc/60/47/54/1029604754.db2.gz BZULNZIOAIOQDB-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN CC[C@H](C)N[C@@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000343257840 1029954249 /nfs/dbraw/zinc/95/42/49/1029954249.db2.gz ZMFIFAWYRINOJK-JQWIXIFHSA-N 0 3 338.795 3.778 20 5 EHBDHN CSCCNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000237508959 1030365498 /nfs/dbraw/zinc/36/54/98/1030365498.db2.gz RJWKFIQYCSQIST-UHFFFAOYSA-N 0 3 326.805 3.961 20 5 EHBDHN CC(C)(C)[C@H]1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000483245072 1031051509 /nfs/dbraw/zinc/05/15/09/1031051509.db2.gz GVPCKCZBQIEQLU-AWEZNQCLSA-N 0 3 344.415 3.903 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@H]3CCCS3)cs2)c1 ZINC000152610811 1031116418 /nfs/dbraw/zinc/11/64/18/1031116418.db2.gz YORYIQAYIFXVFF-CQSZACIVSA-N 0 3 335.454 3.704 20 5 EHBDHN O=[N+]([O-])c1ccccc1CCNCc1cc(F)ccc1OC(F)F ZINC000594929009 1033549165 /nfs/dbraw/zinc/54/91/65/1033549165.db2.gz JCMIFMKRLUNEEL-UHFFFAOYSA-N 0 3 340.301 3.668 20 5 EHBDHN CCS[C@H]1CC[C@@H](N(C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293220 1033574993 /nfs/dbraw/zinc/57/49/93/1033574993.db2.gz TUIYLQZGPKCQBV-HIFRSBDPSA-N 0 3 348.472 3.816 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCc1sc(C)nc1C ZINC000595014594 1033607459 /nfs/dbraw/zinc/60/74/59/1033607459.db2.gz BXBJYNOXIOECDC-SNVBAGLBSA-N 0 3 335.429 3.570 20 5 EHBDHN CC1(C)[C@@H](CNCc2cc([N+](=O)[O-])ccc2OC(F)F)C1(F)F ZINC000594990790 1033621495 /nfs/dbraw/zinc/62/14/95/1033621495.db2.gz ADRJUQLDFIHKAP-LLVKDONJSA-N 0 3 336.285 3.577 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C1CC1)[C@H]1CCCCO1 ZINC000595044485 1033663173 /nfs/dbraw/zinc/66/31/73/1033663173.db2.gz ALYJPADQFRQXRL-BJOOFOGMSA-N 0 3 334.416 3.602 20 5 EHBDHN COc1ccc([C@H](NCc2ccc([N+](=O)[O-])cc2C)C2CC2)cn1 ZINC000599019261 1033667297 /nfs/dbraw/zinc/66/72/97/1033667297.db2.gz CRKJYTFYSBBIOO-GOSISDBHSA-N 0 3 327.384 3.548 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCc1noc2ccccc12 ZINC000595051872 1033667599 /nfs/dbraw/zinc/66/75/99/1033667599.db2.gz WHCAFIKPRZLUIB-LBPRGKRZSA-N 0 3 341.367 3.638 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC(C)(C)c1ccc(C)cn1 ZINC000599069701 1033710572 /nfs/dbraw/zinc/71/05/72/1033710572.db2.gz VGTSHZKPPUTUSJ-AWEZNQCLSA-N 0 3 343.427 3.935 20 5 EHBDHN CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1=CCCOC1 ZINC000597205007 1034607982 /nfs/dbraw/zinc/60/79/82/1034607982.db2.gz BXJVHRIROMYZSM-UHFFFAOYSA-N 0 3 328.368 3.633 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCC[C@@H]2CCc3ccccc3N2)c(F)c1 ZINC000593318901 1034654877 /nfs/dbraw/zinc/65/48/77/1034654877.db2.gz SADJYTVSSXSSTR-HNNXBMFYSA-N 0 3 329.375 3.641 20 5 EHBDHN COCCCOC1CCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000347354744 1034882020 /nfs/dbraw/zinc/88/20/20/1034882020.db2.gz IJCOPRVQEOXXIT-DTQAZKPQSA-N 0 3 348.443 3.516 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NC2CCC(O)CC2)c2ccccc2)c1 ZINC000179966314 1035095798 /nfs/dbraw/zinc/09/57/98/1035095798.db2.gz AGISXRQMLBWLBP-KVZIAJEVSA-N 0 3 326.396 3.577 20 5 EHBDHN COc1ccc(CN[C@H](C)[C@H](OC)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271973793 1035593706 /nfs/dbraw/zinc/59/37/06/1035593706.db2.gz ICKBADDEYGPDSH-XIKOKIGWSA-N 0 3 348.374 3.608 20 5 EHBDHN CC(C)[C@@H]1CCCC[C@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000460361952 1036035648 /nfs/dbraw/zinc/03/56/48/1036035648.db2.gz JCMTYGUMJAHMCV-JKSUJKDBSA-N 0 3 344.415 3.949 20 5 EHBDHN CCOC(=O)C(C)(C)C1CCN(Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000589183631 1036295253 /nfs/dbraw/zinc/29/52/53/1036295253.db2.gz ZMMDGZKARBKPML-UHFFFAOYSA-N 0 3 348.443 3.705 20 5 EHBDHN CCC[C@H](NCc1ccc([S@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000090220737 1036946752 /nfs/dbraw/zinc/94/67/52/1036946752.db2.gz QUERRIOMIHKXKL-MHECFPHRSA-N 0 3 346.452 3.963 20 5 EHBDHN C[C@@](CO)(NCc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000542000358 1036963724 /nfs/dbraw/zinc/96/37/24/1036963724.db2.gz QQAAPLLRVDZNHW-INIZCTEOSA-N 0 3 326.824 3.669 20 5 EHBDHN Cc1ccc(-c2noc([C@H](C)N3[C@H](C)CC[C@@H]3C)n2)cc1[N+](=O)[O-] ZINC000443206332 1037131657 /nfs/dbraw/zinc/13/16/57/1037131657.db2.gz WFRXGZGNSDPHSO-XQQFMLRXSA-N 0 3 330.388 3.887 20 5 EHBDHN C[C@]1(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCO1 ZINC000180740711 1037133793 /nfs/dbraw/zinc/13/37/93/1037133793.db2.gz CCZXNUSHEVDOAS-RTBURBONSA-N 0 3 326.396 3.843 20 5 EHBDHN CC[C@@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000341187522 1037728871 /nfs/dbraw/zinc/72/88/71/1037728871.db2.gz CUPAKXDAOCTMFW-GOEBONIOSA-N 0 3 341.411 3.971 20 5 EHBDHN C[C@@H](CNCc1c(Cl)n[nH]c1C1CC1)c1ccccc1[N+](=O)[O-] ZINC000897458560 1037795814 /nfs/dbraw/zinc/79/58/14/1037795814.db2.gz BHQXRXLVYNTCIA-JTQLQIEISA-N 0 3 334.807 3.742 20 5 EHBDHN COc1ccc([C@H]2C[C@H](NCc3ccc([N+](=O)[O-])cc3F)C2)cc1F ZINC000500493663 1038828023 /nfs/dbraw/zinc/82/80/23/1038828023.db2.gz DUMPRYHDSZZTKB-HDJSIYSDSA-N 0 3 348.349 3.917 20 5 EHBDHN CCC[C@]1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCOC1 ZINC000512855696 1041116593 /nfs/dbraw/zinc/11/65/93/1041116593.db2.gz JAOOJUOZTHSQTI-SFHVURJKSA-N 0 3 330.384 3.904 20 5 EHBDHN CCC[C@@]1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCOC1 ZINC000512855694 1041117721 /nfs/dbraw/zinc/11/77/21/1041117721.db2.gz JAOOJUOZTHSQTI-GOSISDBHSA-N 0 3 330.384 3.904 20 5 EHBDHN CCn1nccc1C1CCN([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000278837762 1041574648 /nfs/dbraw/zinc/57/46/48/1041574648.db2.gz IZAYSLZUGVSQPH-CQSZACIVSA-N 0 3 328.416 3.752 20 5 EHBDHN CCC[C@@H](NCc1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000120337240 1042597087 /nfs/dbraw/zinc/59/70/87/1042597087.db2.gz ONGYAITWBKTXEJ-MRXNPFEDSA-N 0 3 328.368 3.955 20 5 EHBDHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032645 1042607393 /nfs/dbraw/zinc/60/73/93/1042607393.db2.gz SPQUPQLHOYTZMS-ZFWWWQNUSA-N 0 3 331.441 3.979 20 5 EHBDHN COCCNc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000343985121 1043065149 /nfs/dbraw/zinc/06/51/49/1043065149.db2.gz VQNCEPPAFHXXJF-CQSZACIVSA-N 0 3 329.400 3.504 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2cnn(CN(C3CC3)C3CCCC3)c2)cc1 ZINC000728896140 1043522676 /nfs/dbraw/zinc/52/26/76/1043522676.db2.gz DOSSABADMTYFCS-UHFFFAOYSA-N 0 3 326.400 3.823 20 5 EHBDHN C[C@@H]1C[C@@H](c2cccc(F)c2)N(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154373303 1122586582 /nfs/dbraw/zinc/58/65/82/1122586582.db2.gz RYXQVYFTNQFPSG-VMDGZTHMSA-N 0 3 344.386 3.850 20 5 EHBDHN CCCCCN(Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000734829519 1131282905 /nfs/dbraw/zinc/28/29/05/1131282905.db2.gz QFSSEELTZHBECZ-UHFFFAOYSA-N 0 3 331.420 3.711 20 5 EHBDHN CCOC(=O)CC[C@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255687112 1129180822 /nfs/dbraw/zinc/18/08/22/1129180822.db2.gz SBJSPKZBTVGACV-CXOKCQFOSA-N 0 3 346.427 3.663 20 5 EHBDHN Cc1cccc([C@H](C)N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000115602939 1129278060 /nfs/dbraw/zinc/27/80/60/1129278060.db2.gz OOZBPHORPQZRLD-GJZGRUSLSA-N 0 3 341.411 3.889 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)N2CC[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247736 1129371386 /nfs/dbraw/zinc/37/13/86/1129371386.db2.gz HYTRUVCPMJZSAN-UONOGXRCSA-N 0 3 333.432 3.598 20 5 EHBDHN CCOC(=O)CC[C@@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092073639 1129531978 /nfs/dbraw/zinc/53/19/78/1129531978.db2.gz SBJSPKZBTVGACV-FSNWXROXSA-N 0 3 346.427 3.663 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000327948572 1129539990 /nfs/dbraw/zinc/53/99/90/1129539990.db2.gz BLZQUFXLEHCQSE-RCCFBDPRSA-N 0 3 348.443 3.509 20 5 EHBDHN O=[N+]([O-])c1cccc(CCNCc2nc3ccc(F)cc3s2)c1 ZINC000428869126 1129556956 /nfs/dbraw/zinc/55/69/56/1129556956.db2.gz UCHJSRAQWFKWFN-UHFFFAOYSA-N 0 3 331.372 3.676 20 5 EHBDHN COC[C@@H](C)Oc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000922540460 1129568001 /nfs/dbraw/zinc/56/80/01/1129568001.db2.gz JHYGVEYSHYOILR-HUUCEWRRSA-N 0 3 344.411 3.859 20 5 EHBDHN CC[C@@H]1CCCC[C@@H]1N(C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304727 1129660050 /nfs/dbraw/zinc/66/00/50/1129660050.db2.gz UJLAKCPTEFGDAT-CABCVRRESA-N 0 3 333.432 3.742 20 5 EHBDHN CCOc1ccccc1OCCNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429232845 1130132704 /nfs/dbraw/zinc/13/27/04/1130132704.db2.gz CCLIWHNXIXRDBZ-UHFFFAOYSA-N 0 3 344.411 3.897 20 5 EHBDHN C[C@H](N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1cccc([N+](=O)[O-])c1 ZINC000173328717 1130207676 /nfs/dbraw/zinc/20/76/76/1130207676.db2.gz YVWLGZGODDJRDQ-STQMWFEESA-N 0 3 339.395 3.891 20 5 EHBDHN O=[N+]([O-])c1cccc2c1ccnc2NCC1CN(Cc2ccccc2)C1 ZINC000716191277 1131160613 /nfs/dbraw/zinc/16/06/13/1131160613.db2.gz ZGYJIFKJWLKXAG-UHFFFAOYSA-N 0 3 348.406 3.687 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC3(CCC3)CC2)c1F ZINC001173180472 1131992173 /nfs/dbraw/zinc/99/21/73/1131992173.db2.gz KZLXAAOJLHDGBP-ZDUSSCGKSA-N 0 3 336.407 3.940 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CCOc2cc(F)cc(F)c21 ZINC001173220258 1132004309 /nfs/dbraw/zinc/00/43/09/1132004309.db2.gz WSXKNVDYUIYDLT-ZBEGNZNMSA-N 0 3 348.349 3.917 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCOc2cc(F)cc(F)c21 ZINC001173220257 1132004323 /nfs/dbraw/zinc/00/43/23/1132004323.db2.gz WSXKNVDYUIYDLT-MEDUHNTESA-N 0 3 348.349 3.917 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(C)(C)C(=O)c1ccccc1 ZINC001173212346 1132013948 /nfs/dbraw/zinc/01/39/48/1132013948.db2.gz ZVDVDSVLUFCATB-CQSZACIVSA-N 0 3 326.396 3.777 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCC[C@]12CCCO2 ZINC001175688862 1132738391 /nfs/dbraw/zinc/73/83/91/1132738391.db2.gz QHOKSLPJFCKFNY-MSOLQXFVSA-N 0 3 334.416 3.573 20 5 EHBDHN COc1ccccc1CCN(C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768541871 1133153930 /nfs/dbraw/zinc/15/39/30/1133153930.db2.gz MDRNVWLBYFHXIU-UHFFFAOYSA-N 0 3 334.803 3.931 20 5 EHBDHN CCO[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2OC)C12CCCCC2 ZINC001170001420 1133241271 /nfs/dbraw/zinc/24/12/71/1133241271.db2.gz KODWAIVWIVCRNR-ZWKOTPCHSA-N 0 3 348.443 3.821 20 5 EHBDHN CCN(Cc1ccc(C)c([N+](=O)[O-])c1)C[C@H](O)c1ccc(C)cc1 ZINC000769483877 1133289321 /nfs/dbraw/zinc/28/93/21/1133289321.db2.gz QQJFNTVGECPOTR-IBGZPJMESA-N 0 3 328.412 3.767 20 5 EHBDHN CO[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000769446282 1133292908 /nfs/dbraw/zinc/29/29/08/1133292908.db2.gz LUIADKGRZAHMBF-GFCCVEGCSA-N 0 3 336.775 3.729 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC(CC2CCOCC2)C1 ZINC001183560896 1133823793 /nfs/dbraw/zinc/82/37/93/1133823793.db2.gz JJDWPKSTJUUGRR-DHDCSXOGSA-N 0 3 330.428 3.747 20 5 EHBDHN CC(C)[C@@H](NCc1ccc([N+](=O)[O-])cc1F)[C@H](O)c1ccccc1 ZINC000788537324 1134139197 /nfs/dbraw/zinc/13/91/97/1134139197.db2.gz JHXSKLJVBLQITR-QZTJIDSGSA-N 0 3 332.375 3.582 20 5 EHBDHN COC(=O)c1ccc([N+](=O)[O-])c(CN(C2CC2)C2CCC(C)CC2)c1 ZINC001190398836 1134690909 /nfs/dbraw/zinc/69/09/09/1134690909.db2.gz DBQAVPIZIITTLB-UHFFFAOYSA-N 0 3 346.427 3.925 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1COC2(CCCCC2)O1 ZINC000776169989 1136020557 /nfs/dbraw/zinc/02/05/57/1136020557.db2.gz HKDIOKNAVBVMNS-HOCLYGCPSA-N 0 3 334.416 3.630 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1C[C@H](OC(C)C)C1(C)C ZINC001201887874 1136070048 /nfs/dbraw/zinc/07/00/48/1136070048.db2.gz DGUPGSHSGKUGAR-IRXDYDNUSA-N 0 3 336.432 3.675 20 5 EHBDHN C[C@H]1CCCN(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811473922 1136095906 /nfs/dbraw/zinc/09/59/06/1136095906.db2.gz QTAJEAPOBLEXLW-NSHDSACASA-N 0 3 346.258 3.723 20 5 EHBDHN CN1CC[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@H]1c1ccccc1 ZINC000776254067 1136104719 /nfs/dbraw/zinc/10/47/19/1136104719.db2.gz QYEVCQLEMUGIGX-ZWKOTPCHSA-N 0 3 345.830 3.783 20 5 EHBDHN C[C@H](N)c1ncc(-c2ccccc2)n1-c1cc([N+](=O)[O-])cc2cc[nH]c21 ZINC001170681063 1136221729 /nfs/dbraw/zinc/22/17/29/1136221729.db2.gz DTQZLSWBOIZPLN-LBPRGKRZSA-N 0 3 347.378 3.949 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3COC4(CCC4)C3)o2)cc1 ZINC000850367544 1136242464 /nfs/dbraw/zinc/24/24/64/1136242464.db2.gz MSKUGQXXJPZVOM-AWEZNQCLSA-N 0 3 328.368 3.656 20 5 EHBDHN C[C@H](c1ccccc1)[C@H](O)CNCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000850411565 1136252699 /nfs/dbraw/zinc/25/26/99/1136252699.db2.gz FPXNOEVYJQMOJB-SJKOYZFVSA-N 0 3 334.803 3.502 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C)[C@H](O)c1ccc(F)cc1 ZINC000850437086 1136258689 /nfs/dbraw/zinc/25/86/89/1136258689.db2.gz ZCJWUWGRTRDVRM-PZROIBLQSA-N 0 3 348.374 3.515 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC[C@](C)(O)c1ccccc1 ZINC000850462397 1136264183 /nfs/dbraw/zinc/26/41/83/1136264183.db2.gz NYKQYMIBXZROPK-LIRRHRJNSA-N 0 3 344.411 3.552 20 5 EHBDHN CC(COC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)[N+](=O)[O-] ZINC000813101847 1136287857 /nfs/dbraw/zinc/28/78/57/1136287857.db2.gz JYGULIPIJPCRKL-CQSZACIVSA-N 0 3 341.363 3.525 20 5 EHBDHN CC(COC(=O)c1ccc(-c2ccc(Cl)cc2)s1)[N+](=O)[O-] ZINC000813108409 1136293904 /nfs/dbraw/zinc/29/39/04/1136293904.db2.gz YAHNLQLGONCQGD-VIFPVBQESA-N 0 3 325.773 3.891 20 5 EHBDHN C[C@@H]1CCCC[C@H]1N(C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000173190382 1136341385 /nfs/dbraw/zinc/34/13/85/1136341385.db2.gz OADQQRRUZPCSFL-IUODEOHRSA-N 0 3 330.388 3.655 20 5 EHBDHN Cc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(CN(C)C)c1 ZINC000114110706 1136774568 /nfs/dbraw/zinc/77/45/68/1136774568.db2.gz MPTLHGGCXVPKGD-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN CC[C@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000817414679 1136806536 /nfs/dbraw/zinc/80/65/36/1136806536.db2.gz ICZMXEJNNGWRTH-NEPJUHHUSA-N 0 3 333.215 3.949 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1c(C)ccc([N+](=O)[O-])c1C ZINC000820608500 1136999958 /nfs/dbraw/zinc/99/99/58/1136999958.db2.gz ISBFZICPZSOIQU-UHFFFAOYSA-N 0 3 341.411 3.834 20 5 EHBDHN Cc1cc(OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c(C)c(C)n1 ZINC000820695816 1137001780 /nfs/dbraw/zinc/00/17/80/1137001780.db2.gz KRZDTBMILYRDGK-UHFFFAOYSA-N 0 3 349.774 3.586 20 5 EHBDHN CN(Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@@](C)(O)c1ccccc1 ZINC000822516310 1137063886 /nfs/dbraw/zinc/06/38/86/1137063886.db2.gz KGRXZPJUEDXXFO-QGZVFWFLSA-N 0 3 334.803 3.588 20 5 EHBDHN CC([C@@H](OC(=O)CC1CCSCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845873586 1137316061 /nfs/dbraw/zinc/31/60/61/1137316061.db2.gz DDBPFMGZLVEMCC-MEDUHNTESA-N 0 3 341.404 3.609 20 5 EHBDHN CC([C@H](OC(=O)CCc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845874220 1137316206 /nfs/dbraw/zinc/31/62/06/1137316206.db2.gz YJZIRLBEZGCSOV-ACJLOTCBSA-N 0 3 331.343 3.708 20 5 EHBDHN COCc1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cc1 ZINC000845874180 1137316281 /nfs/dbraw/zinc/31/62/81/1137316281.db2.gz YARHHTROVQWPTO-PXAZEXFGSA-N 0 3 347.342 3.535 20 5 EHBDHN CC([C@H](OC(=O)CCCOC(C)(C)C)c1ccccc1F)[N+](=O)[O-] ZINC000845883826 1137317013 /nfs/dbraw/zinc/31/70/13/1137317013.db2.gz WFPMMFVMXQEKEK-WBMJQRKESA-N 0 3 341.379 3.671 20 5 EHBDHN CC([C@@H](OC(=O)c1ccoc1C1CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845882993 1137317035 /nfs/dbraw/zinc/31/70/35/1137317035.db2.gz QQGQHAZTJWZXBG-ZUZCIYMTSA-N 0 3 333.315 3.859 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCOCC(F)(F)F ZINC000872027118 1137565961 /nfs/dbraw/zinc/56/59/61/1137565961.db2.gz HNWCIETYYLIERA-SECBINFHSA-N 0 3 338.351 3.546 20 5 EHBDHN C[C@@H](NC[C@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872038694 1137566883 /nfs/dbraw/zinc/56/68/83/1137566883.db2.gz OZMBRPKQGUDYRT-HIFRSBDPSA-N 0 3 332.375 3.551 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](O)c1ccsc1 ZINC000872037787 1137566996 /nfs/dbraw/zinc/56/69/96/1137566996.db2.gz IEJCXHAIDRVGMU-IINYFYTJSA-N 0 3 338.454 3.762 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCCc2cn[nH]c21 ZINC000872047683 1137567725 /nfs/dbraw/zinc/56/77/25/1137567725.db2.gz COJRLOYNOCUDQC-IINYFYTJSA-N 0 3 332.429 3.768 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN[C@H](CCCO)c1ccccc1 ZINC000873059118 1137589050 /nfs/dbraw/zinc/58/90/50/1137589050.db2.gz NORCEBLIXYUQJH-GOSISDBHSA-N 0 3 328.412 3.815 20 5 EHBDHN Cc1c(CNC[C@H](O)c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000873060599 1137589276 /nfs/dbraw/zinc/58/92/76/1137589276.db2.gz JVYSJSABODVPNM-HNNXBMFYSA-N 0 3 338.766 3.519 20 5 EHBDHN O=[N+]([O-])c1cnn(C2CC(NCc3c(Cl)oc4ccccc43)C2)c1 ZINC000877652167 1137684445 /nfs/dbraw/zinc/68/44/45/1137684445.db2.gz DDQWVACSCKOFMW-UHFFFAOYSA-N 0 3 346.774 3.684 20 5 EHBDHN Cc1nc(C2CCN(Cc3cccc([N+](=O)[O-])c3C)CC2)[nH]c1C ZINC000886668146 1138111663 /nfs/dbraw/zinc/11/16/63/1138111663.db2.gz OAALUVTWQLCTHL-UHFFFAOYSA-N 0 3 328.416 3.623 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CC[C@H](COCc2ccccc2)C1 ZINC000075866244 1138128929 /nfs/dbraw/zinc/12/89/29/1138128929.db2.gz QUJKZRWZOPFAAZ-KRWDZBQOSA-N 0 3 326.396 3.634 20 5 EHBDHN CCC[C@H](NCC[S@@](=O)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000127423910 1138357113 /nfs/dbraw/zinc/35/71/13/1138357113.db2.gz TZWCMGNELWAFEP-NYHFZMIOSA-N 0 3 326.462 3.573 20 5 EHBDHN C[C@@H](c1ccccc1F)N(C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000336980791 1138440830 /nfs/dbraw/zinc/44/08/30/1138440830.db2.gz FEGGKQSZIGRLIE-ZDUSSCGKSA-N 0 3 345.374 3.756 20 5 EHBDHN CCC[C@@H]1CCCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000185865690 1140174614 /nfs/dbraw/zinc/17/46/14/1140174614.db2.gz GIMJCOKFJFJNJP-CQSZACIVSA-N 0 3 330.388 3.799 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000192024837 1140497872 /nfs/dbraw/zinc/49/78/72/1140497872.db2.gz JPDQFSMCKZKDQM-DOTOQJQBSA-N 0 3 332.787 3.868 20 5 EHBDHN C[C@H](O)c1ccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192723982 1140547098 /nfs/dbraw/zinc/54/70/98/1140547098.db2.gz HMAYABNBDWIFCQ-ORAYPTAESA-N 0 3 326.396 3.815 20 5 EHBDHN CC(C)(C)[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000270667643 1141253356 /nfs/dbraw/zinc/25/33/56/1141253356.db2.gz PUWIRWCJPKVYCF-DOMZBBRYSA-N 0 3 326.824 3.932 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891851 1141280576 /nfs/dbraw/zinc/28/05/76/1141280576.db2.gz PGJQAJVQSXMVLO-GXTWGEPZSA-N 0 3 341.415 3.531 20 5 EHBDHN CCOC(=O)C(C)(C)C1CCN(Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000510088135 1014939994 /nfs/dbraw/zinc/93/99/94/1014939994.db2.gz SLQXXSDYVWDQHR-UHFFFAOYSA-N 0 3 348.443 3.705 20 5 EHBDHN COc1ccc(-c2ccc(CN3CCC34CCC4)o2)c([N+](=O)[O-])c1 ZINC000536677802 1032120342 /nfs/dbraw/zinc/12/03/42/1032120342.db2.gz KNHPXYQMUJJOMN-UHFFFAOYSA-N 0 3 328.368 3.992 20 5 EHBDHN C[C@@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000246941315 1016159976 /nfs/dbraw/zinc/15/99/76/1016159976.db2.gz ZFYSHGAABDHQLO-OLZOCXBDSA-N 0 3 330.388 3.513 20 5 EHBDHN CC[C@@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000340152025 1016491429 /nfs/dbraw/zinc/49/14/29/1016491429.db2.gz IXEATXZKRJCMPF-RDTXWAMCSA-N 0 3 341.411 3.971 20 5 EHBDHN C[C@]1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCOC1 ZINC000120181212 1016746015 /nfs/dbraw/zinc/74/60/15/1016746015.db2.gz NHMDCPGZCXHYKK-INIZCTEOSA-N 0 3 336.775 3.777 20 5 EHBDHN O=[N+]([O-])c1ccccc1CCN[C@@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449167724 1032260556 /nfs/dbraw/zinc/26/05/56/1032260556.db2.gz KRMHVVMNSBNSJY-CYBMUJFWSA-N 0 3 336.313 3.832 20 5 EHBDHN C[C@@H](N[C@@H](C)Cc1ccccc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000459645383 1032367685 /nfs/dbraw/zinc/36/76/85/1032367685.db2.gz GKDWITWLUBHBKE-NWDGAFQWSA-N 0 3 331.441 3.822 20 5 EHBDHN COC[C@H](CNCc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000449482435 1032630316 /nfs/dbraw/zinc/63/03/16/1032630316.db2.gz YMOALJRKUUUIJV-ZDUSSCGKSA-N 0 3 340.832 3.830 20 5 EHBDHN Cc1ccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000136138210 1017264622 /nfs/dbraw/zinc/26/46/22/1017264622.db2.gz QIXMDUJCPJFPTE-INIZCTEOSA-N 0 3 338.766 3.519 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCO[C@H](c3ccncc3)C2)c(Cl)c1 ZINC000449544022 1032736794 /nfs/dbraw/zinc/73/67/94/1032736794.db2.gz VAWJUWVJTBOIIH-YOEHRIQHSA-N 0 3 347.802 3.653 20 5 EHBDHN COc1cc(F)cc(CNC/C(C)=C/c2cccc([N+](=O)[O-])c2)c1 ZINC000468615716 1018221137 /nfs/dbraw/zinc/22/11/37/1018221137.db2.gz QWURKSHBXWYRHV-AWNIVKPZSA-N 0 3 330.359 3.936 20 5 EHBDHN CC(C)c1ccc(CN2CCC[C@@H](c3ncc[nH]3)C2)cc1[N+](=O)[O-] ZINC000092072748 1032764069 /nfs/dbraw/zinc/76/40/69/1032764069.db2.gz KEAMYLBHTGPGTP-OAHLLOKOSA-N 0 3 328.416 3.821 20 5 EHBDHN CC[C@@H]1C[C@@H](C)CN1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000610410599 1018934022 /nfs/dbraw/zinc/93/40/22/1018934022.db2.gz VJCAACNBIZWXAK-ZYHUDNBSSA-N 0 3 344.358 3.825 20 5 EHBDHN CN(Cc1cc([N+](=O)[O-])ccc1OC(F)F)C1Cc2ccccc2C1 ZINC000511670556 1020757991 /nfs/dbraw/zinc/75/79/91/1020757991.db2.gz JDOCQZPQIVVATB-UHFFFAOYSA-N 0 3 348.349 3.795 20 5 EHBDHN CCOc1cc(CN2CCc3ccccc3CC2)ccc1[N+](=O)[O-] ZINC000519679655 1021604305 /nfs/dbraw/zinc/60/43/05/1021604305.db2.gz GRGYOCIZWMPZJQ-UHFFFAOYSA-N 0 3 326.396 3.594 20 5 EHBDHN COc1cc(C[NH2+]C2CC(c3ccccc3C)C2)c([N+](=O)[O-])cc1[O-] ZINC000341433488 1021879735 /nfs/dbraw/zinc/87/97/35/1021879735.db2.gz JAABATAVAHXACG-UHFFFAOYSA-N 0 3 342.395 3.653 20 5 EHBDHN COc1cccc2c1CCN(Cc1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000426577722 1021972232 /nfs/dbraw/zinc/97/22/32/1021972232.db2.gz DKGSESKSACQYLQ-UHFFFAOYSA-N 0 3 326.396 3.513 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNC[C@@H]3CCCC(F)(F)C3)nc2c1 ZINC000602652521 1033040809 /nfs/dbraw/zinc/04/08/09/1033040809.db2.gz MDGJPWWIVTXTDQ-SNVBAGLBSA-N 0 3 325.315 3.651 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CCC[C@@H](CCO)CC1 ZINC000602693291 1033074028 /nfs/dbraw/zinc/07/40/28/1033074028.db2.gz FJXRZFUUQHYYNG-GFCCVEGCSA-N 0 3 346.349 3.598 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000610818799 1023782351 /nfs/dbraw/zinc/78/23/51/1023782351.db2.gz SJTBIYJDLPQPAP-RYUDHWBXSA-N 0 3 340.383 3.897 20 5 EHBDHN C[C@H]1CN(C2CC2)C[C@@H]1Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000514176400 1024202100 /nfs/dbraw/zinc/20/21/00/1024202100.db2.gz PBOYEFHPLSBSDC-ZANVPECISA-N 0 3 329.322 3.508 20 5 EHBDHN C[C@@H]1CC[C@H](NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000248548762 1024299099 /nfs/dbraw/zinc/29/90/99/1024299099.db2.gz GXQJTLBXQIGZSW-XUJVJEKNSA-N 0 3 330.388 3.559 20 5 EHBDHN CCCN(CCN1CCCC1)C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000342216860 1024436676 /nfs/dbraw/zinc/43/66/76/1024436676.db2.gz VRLIRMLLRZPZIV-UHFFFAOYSA-N 0 3 347.459 3.666 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C ZINC000451480217 1025996826 /nfs/dbraw/zinc/99/68/26/1025996826.db2.gz PQUIVNNTUQBODP-NXHRZFHOSA-N 0 3 348.443 3.675 20 5 EHBDHN CC(C)(C)C[C@@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000452067682 1026461494 /nfs/dbraw/zinc/46/14/94/1026461494.db2.gz ANXGCSRRGIAFLO-ZDUSSCGKSA-N 0 3 344.415 3.903 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000531148227 1026633963 /nfs/dbraw/zinc/63/39/63/1026633963.db2.gz RYOIZHQJSOMKOP-MRXNPFEDSA-N 0 3 347.440 3.914 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN(CCCO)[C@@H]1CCCc2ccccc21 ZINC000531164059 1026636704 /nfs/dbraw/zinc/63/67/04/1026636704.db2.gz NHOVJQJFRLQHAR-HXUWFJFHSA-N 0 3 340.423 3.857 20 5 EHBDHN C[C@@H](NCc1ccccc1Cn1cccn1)c1ccc([N+](=O)[O-])cc1 ZINC000178640636 1026989160 /nfs/dbraw/zinc/98/91/60/1026989160.db2.gz WPWCMACWMDKNLB-OAHLLOKOSA-N 0 3 336.395 3.690 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN[C@@H](CC(F)F)c2ccccc2)c1 ZINC000421000853 1027981452 /nfs/dbraw/zinc/98/14/52/1027981452.db2.gz WOCSYYYPPLEVJL-INIZCTEOSA-N 0 3 336.338 3.960 20 5 EHBDHN CCO[C@@H]1C[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(CC)CC ZINC000444691015 1028162956 /nfs/dbraw/zinc/16/29/56/1028162956.db2.gz WRENWHMBJIWOAU-JKSUJKDBSA-N 0 3 346.431 3.545 20 5 EHBDHN COC[C@H]1CCCCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000467118633 1028206174 /nfs/dbraw/zinc/20/61/74/1028206174.db2.gz PCYQZFXXZNOEFF-HNNXBMFYSA-N 0 3 336.432 3.631 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H]1CCC[C@H](CO)C1 ZINC000840979887 1028471418 /nfs/dbraw/zinc/47/14/18/1028471418.db2.gz VHQVTOOIVPYRAR-JOYOIKCWSA-N 0 3 333.215 3.542 20 5 EHBDHN Cc1ccc(CCNCc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000523842187 1028669304 /nfs/dbraw/zinc/66/93/04/1028669304.db2.gz LQFATSJVYKBUDA-UHFFFAOYSA-N 0 3 336.338 3.837 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@@H]2CC[C@H]2O)ccc1Oc1ccccc1Cl ZINC000424195909 1028883746 /nfs/dbraw/zinc/88/37/46/1028883746.db2.gz DWFMAPHHPGOJLI-UKRRQHHQSA-N 0 3 348.786 3.653 20 5 EHBDHN O=[N+]([O-])c1cccc(CNCCOc2cccc(C(F)(F)F)c2)c1 ZINC000237850680 1029453596 /nfs/dbraw/zinc/45/35/96/1029453596.db2.gz HSIQPGIQIJXVNG-UHFFFAOYSA-N 0 3 340.301 3.782 20 5 EHBDHN CO[C@@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000550894737 1030774630 /nfs/dbraw/zinc/77/46/30/1030774630.db2.gz GOMVSSDVNMRYBR-RBUKOAKNSA-N 0 3 326.396 3.699 20 5 EHBDHN C[C@H](NC[C@@H](O)C(F)F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000484468945 1031587167 /nfs/dbraw/zinc/58/71/67/1031587167.db2.gz BWONYPJNWXYMHT-JOYOIKCWSA-N 0 3 342.367 3.600 20 5 EHBDHN C[C@@H]1C[C@H](C)[C@@H](C)N(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737963 1031705266 /nfs/dbraw/zinc/70/52/66/1031705266.db2.gz HERGFMCDWSRMQA-FRRDWIJNSA-N 0 3 330.388 3.511 20 5 EHBDHN CCO[C@@H]1C[C@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)C12CCC2 ZINC000595027125 1033649407 /nfs/dbraw/zinc/64/94/07/1033649407.db2.gz PZEJMXUMYVIQNR-AFAVFJNCSA-N 0 3 334.416 3.602 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](C)c1c(C)noc1C ZINC000595035038 1033655732 /nfs/dbraw/zinc/65/57/32/1033655732.db2.gz GMLKMSHAFHKRJQ-QWRGUYRKSA-N 0 3 333.388 3.663 20 5 EHBDHN COc1cc(CNCC2(C(F)(F)F)CCCC2)c([N+](=O)[O-])cc1O ZINC000599014044 1033662745 /nfs/dbraw/zinc/66/27/45/1033662745.db2.gz NQZQVARNNOMUPT-UHFFFAOYSA-N 0 3 348.321 3.521 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC(C)(C)C1(O)CCCC1 ZINC000595051807 1033667498 /nfs/dbraw/zinc/66/74/98/1033667498.db2.gz OGYGBWMJQSRXMX-CYBMUJFWSA-N 0 3 336.432 3.585 20 5 EHBDHN COc1ccc([C@@H](N[C@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000599093026 1033731217 /nfs/dbraw/zinc/73/12/17/1033731217.db2.gz MEDBTRPCEIIGQC-XIKOKIGWSA-N 0 3 327.384 3.800 20 5 EHBDHN CCOc1ccc([C@H](C)N[C@@H]2CCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000596649923 1034345476 /nfs/dbraw/zinc/34/54/76/1034345476.db2.gz DRMFZBROZBTYLG-YVEFUNNKSA-N 0 3 341.411 3.914 20 5 EHBDHN CN(C)[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1cccs1 ZINC000029871575 1035771399 /nfs/dbraw/zinc/77/13/99/1035771399.db2.gz UYJXSLKGWUVHFW-OAHLLOKOSA-N 0 3 342.424 3.919 20 5 EHBDHN CC(C)[C@@H]1CCCC[C@@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000460347101 1035923123 /nfs/dbraw/zinc/92/31/23/1035923123.db2.gz IKFXEFGSWKAAAK-HOTGVXAUSA-N 0 3 344.415 3.949 20 5 EHBDHN CCOc1cc(CN(C)[C@@H](C)CCSCC)ccc1[N+](=O)[O-] ZINC000492721854 1036230161 /nfs/dbraw/zinc/23/01/61/1036230161.db2.gz LQBHTZCCRJZGHQ-ZDUSSCGKSA-N 0 3 326.462 3.957 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C(C)C)[C@H](O)C(F)(F)F ZINC000589162657 1036288450 /nfs/dbraw/zinc/28/84/50/1036288450.db2.gz SIHFOKLGWQVUPA-SWHYSGLUSA-N 0 3 334.338 3.502 20 5 EHBDHN Cc1ccc(CNC[C@@]2(C)OCCc3sccc32)cc1[N+](=O)[O-] ZINC000589325777 1036343838 /nfs/dbraw/zinc/34/38/38/1036343838.db2.gz YBDBHLMVHGTSSF-QGZVFWFLSA-N 0 3 332.425 3.542 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000535414881 1036479867 /nfs/dbraw/zinc/47/98/67/1036479867.db2.gz IHDALAFAIFHIEF-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN NCc1nn(-c2ncnc3cc4ccccc4cc32)c2ccccc12 ZINC001167697028 1036662409 /nfs/dbraw/zinc/66/24/09/1036662409.db2.gz LYKFOERKHOKJAH-UHFFFAOYSA-N 0 3 325.375 3.581 20 5 EHBDHN CCC(O)(CC)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180330252 1036684667 /nfs/dbraw/zinc/68/46/67/1036684667.db2.gz OORUCXKQSPUUSG-GOSISDBHSA-N 0 3 328.412 3.825 20 5 EHBDHN CC(C)N(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCOCC1 ZINC000089912638 1036973211 /nfs/dbraw/zinc/97/32/11/1036973211.db2.gz FOFNQJOLZDTLOL-UHFFFAOYSA-N 0 3 345.399 3.639 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCc2cscn2)c2ccccc2)c1 ZINC000180790822 1037189861 /nfs/dbraw/zinc/18/98/61/1037189861.db2.gz ZDYAGHLFCHXPQP-SFHVURJKSA-N 0 3 339.420 3.973 20 5 EHBDHN COc1cc(CN(CC(C)C)C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000045751591 1037302587 /nfs/dbraw/zinc/30/25/87/1037302587.db2.gz GKYNSYWCLXJYIV-UHFFFAOYSA-N 0 3 344.358 3.825 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](C)Oc1ccc(F)cc1 ZINC000462738066 1037345352 /nfs/dbraw/zinc/34/53/52/1037345352.db2.gz KQZGJVDZFOZQHK-ZDUSSCGKSA-N 0 3 348.374 3.690 20 5 EHBDHN Cc1ccc([C@@H](CNc2ncc(C)cc2[N+](=O)[O-])N2CCCC2)cc1 ZINC000463051290 1037700219 /nfs/dbraw/zinc/70/02/19/1037700219.db2.gz ALMWSRZQENBKGE-GOSISDBHSA-N 0 3 340.427 3.856 20 5 EHBDHN C[C@H](CNCc1c(Cl)n[nH]c1C1CC1)c1ccccc1[N+](=O)[O-] ZINC000897458561 1037796358 /nfs/dbraw/zinc/79/63/58/1037796358.db2.gz BHQXRXLVYNTCIA-SNVBAGLBSA-N 0 3 334.807 3.742 20 5 EHBDHN Cc1cccc([C@H](C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC000540386800 1037877980 /nfs/dbraw/zinc/87/79/80/1037877980.db2.gz ZWRYDRZNOZLUHN-GJZGRUSLSA-N 0 3 341.411 3.889 20 5 EHBDHN COc1ccccc1C(C)(C)NCCOc1ccccc1[N+](=O)[O-] ZINC000103483774 1037888011 /nfs/dbraw/zinc/88/80/11/1037888011.db2.gz FDFKGTRPQBNBGU-UHFFFAOYSA-N 0 3 330.384 3.507 20 5 EHBDHN CC(C)[C@@H](c1ccccc1Cl)N(C)CCn1ccc([N+](=O)[O-])n1 ZINC000478044382 1039163846 /nfs/dbraw/zinc/16/38/46/1039163846.db2.gz CBGAOCHPYHLVGU-INIZCTEOSA-N 0 3 336.823 3.774 20 5 EHBDHN CC(C)[C@@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000029113009 1040138494 /nfs/dbraw/zinc/13/84/94/1040138494.db2.gz ROHJRKNRRDYQNL-LJQANCHMSA-N 0 3 341.411 3.545 20 5 EHBDHN CC[C@@H](N[C@H](C)c1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000192848855 1040594595 /nfs/dbraw/zinc/59/45/95/1040594595.db2.gz JRULVDWBAONMII-SJKOYZFVSA-N 0 3 342.399 3.887 20 5 EHBDHN CC1(C)CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCC[C@H]21 ZINC000555721022 1041043964 /nfs/dbraw/zinc/04/39/64/1041043964.db2.gz FJQLBDLEXLWSPX-HUUCEWRRSA-N 0 3 342.399 3.655 20 5 EHBDHN Cc1c(CN2CCC[C@]3(C2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000481699348 1041263546 /nfs/dbraw/zinc/26/35/46/1041263546.db2.gz VHYOQSVHSWWMPK-HXUWFJFHSA-N 0 3 338.407 3.925 20 5 EHBDHN O=[N+]([O-])c1cccc2c(NCCc3ccc4cn[nH]c4c3)ccnc21 ZINC000432137042 1041638028 /nfs/dbraw/zinc/63/80/28/1041638028.db2.gz RTKDDPIGBRKTJM-UHFFFAOYSA-N 0 3 333.351 3.674 20 5 EHBDHN CCC[C@@H](O)CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000112377573 1127184226 /nfs/dbraw/zinc/18/42/26/1127184226.db2.gz YTPJCIXTKITHIK-OAHLLOKOSA-N 0 3 348.374 3.777 20 5 EHBDHN CC(C)[C@@H](CO)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000554089111 1128615368 /nfs/dbraw/zinc/61/53/68/1128615368.db2.gz RNOIWMDGILABPR-IEBWSBKVSA-N 0 3 328.412 3.538 20 5 EHBDHN O=[N+]([O-])c1cccc(CCN[C@@H](c2ccccc2)c2ccccn2)c1 ZINC000495007012 1120930086 /nfs/dbraw/zinc/93/00/86/1120930086.db2.gz IDPDQHCFKSJJPH-FQEVSTJZSA-N 0 3 333.391 3.912 20 5 EHBDHN COc1ccc(OCCN(C)Cc2ccc(F)cc2C)c([N+](=O)[O-])c1 ZINC000487965410 1121390135 /nfs/dbraw/zinc/39/01/35/1121390135.db2.gz SMEQNMAOWKJACS-UHFFFAOYSA-N 0 3 348.374 3.562 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@H]2/C=C\c2ccccc2)cc1 ZINC000780400263 1121575341 /nfs/dbraw/zinc/57/53/41/1121575341.db2.gz UQZPVQNKRTVKJO-QQXWZLKESA-N 0 3 338.407 3.806 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC(OC3CCCCC3)CC2)c1 ZINC000125456682 1122317208 /nfs/dbraw/zinc/31/72/08/1122317208.db2.gz RDOXSWJOPYYIFC-UHFFFAOYSA-N 0 3 348.443 3.787 20 5 EHBDHN CC[C@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000610007996 1123712063 /nfs/dbraw/zinc/71/20/63/1123712063.db2.gz BRZZPFSCLQTDRO-KRWDZBQOSA-N 0 3 336.338 3.993 20 5 EHBDHN CC(C)N1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000068778142 1124027214 /nfs/dbraw/zinc/02/72/14/1124027214.db2.gz VJOJFXSJYRHIRU-UHFFFAOYSA-N 0 3 347.462 3.944 20 5 EHBDHN Cc1cc(NC[C@@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc2n1 ZINC000181523101 1124908256 /nfs/dbraw/zinc/90/82/56/1124908256.db2.gz NHXJIQACTKVSQI-HNNXBMFYSA-N 0 3 337.379 3.639 20 5 EHBDHN C[C@@H]1CCC[C@@H](C)N(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000131027257 1129376302 /nfs/dbraw/zinc/37/63/02/1129376302.db2.gz YSYQPZBNUGZPQI-CHWSQXEVSA-N 0 3 330.388 3.655 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)[C@H](C)c1ccco1 ZINC000069070380 1129420701 /nfs/dbraw/zinc/42/07/01/1129420701.db2.gz HACRBZABMGNPOG-CYBMUJFWSA-N 0 3 331.372 3.518 20 5 EHBDHN CC(C)c1ccc(CNCc2ccc3c(c2)ncn3C)cc1[N+](=O)[O-] ZINC000922482525 1129550697 /nfs/dbraw/zinc/55/06/97/1129550697.db2.gz NKEWRFYDFPMWTD-UHFFFAOYSA-N 0 3 338.411 3.895 20 5 EHBDHN Cc1cnn(CC2CCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)c1 ZINC000330735045 1129644337 /nfs/dbraw/zinc/64/43/37/1129644337.db2.gz VQVWIDRIQJDMRZ-MRXNPFEDSA-N 0 3 342.443 3.881 20 5 EHBDHN COC[C@H](N[C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000156534129 1129723001 /nfs/dbraw/zinc/72/30/01/1129723001.db2.gz YBPJBHAWOHZKHF-CJNGLKHVSA-N 0 3 332.400 3.795 20 5 EHBDHN Cc1n[nH]cc1CCCNc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000302183225 1129771866 /nfs/dbraw/zinc/77/18/66/1129771866.db2.gz OMBJVGJPAXJUPD-UHFFFAOYSA-N 0 3 325.372 3.528 20 5 EHBDHN O=[N+]([O-])c1ccc(CCNCc2ccccc2Br)cc1 ZINC000040675912 1130242625 /nfs/dbraw/zinc/24/26/25/1130242625.db2.gz BYIHYQBCDXZGLM-UHFFFAOYSA-N 0 3 335.201 3.690 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000245710536 1130297529 /nfs/dbraw/zinc/29/75/29/1130297529.db2.gz FGHSMVRJFPVCSV-SWLSCSKDSA-N 0 3 341.415 3.531 20 5 EHBDHN CC[C@H](C)[C@@H]1CCCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057486 1131461954 /nfs/dbraw/zinc/46/19/54/1131461954.db2.gz RJVNCKDXBOWOOH-YOEHRIQHSA-N 0 3 343.431 3.711 20 5 EHBDHN O=[N+]([O-])c1cccc2c(NCC3CN(Cc4ccccc4)C3)ccnc21 ZINC000716300966 1131547154 /nfs/dbraw/zinc/54/71/54/1131547154.db2.gz XUMDJORLYRFTMG-UHFFFAOYSA-N 0 3 348.406 3.687 20 5 EHBDHN COc1ccc(-c2ccc(CNCCOC3CCC3)o2)c([N+](=O)[O-])c1 ZINC000742386357 1131714178 /nfs/dbraw/zinc/71/41/78/1131714178.db2.gz BLCAMFVFZRYVJV-UHFFFAOYSA-N 0 3 346.383 3.522 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@@](C)(F)CC2)c1F ZINC001173178946 1131992629 /nfs/dbraw/zinc/99/26/29/1131992629.db2.gz CHZIUHQIWCWBSP-YVEFUNNKSA-N 0 3 342.386 3.888 20 5 EHBDHN CCCCC[C@@H]1CCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767761321 1133049157 /nfs/dbraw/zinc/04/91/57/1133049157.db2.gz JXOLTSQMKMJXOL-MRXNPFEDSA-N 0 3 343.431 3.856 20 5 EHBDHN CCO[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2OC)C12CCCCC2 ZINC001170001412 1133241169 /nfs/dbraw/zinc/24/11/69/1133241169.db2.gz KODWAIVWIVCRNR-MSOLQXFVSA-N 0 3 348.443 3.821 20 5 EHBDHN CCCCN(CCOC)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000769390002 1133275516 /nfs/dbraw/zinc/27/55/16/1133275516.db2.gz TWAXVYGQPYXLNK-UHFFFAOYSA-N 0 3 345.237 3.606 20 5 EHBDHN COc1cncc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC001181878489 1133545614 /nfs/dbraw/zinc/54/56/14/1133545614.db2.gz BCJVVKRWLAEECG-INIZCTEOSA-N 0 3 341.411 3.686 20 5 EHBDHN COc1c([O-])ccc(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)c1[N+](=O)[O-] ZINC001182771591 1133732022 /nfs/dbraw/zinc/73/20/22/1133732022.db2.gz AUELQTBUZBAGRF-CQSZACIVSA-N 0 3 334.416 3.711 20 5 EHBDHN COc1c([O-])ccc(C[N@H+]2CC[C@@H](C3CCCCC3)C2)c1[N+](=O)[O-] ZINC001182771591 1133732026 /nfs/dbraw/zinc/73/20/26/1133732026.db2.gz AUELQTBUZBAGRF-CQSZACIVSA-N 0 3 334.416 3.711 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CCC[C@H](N2CCCC2)C1 ZINC001184874888 1134001038 /nfs/dbraw/zinc/00/10/38/1134001038.db2.gz XCXGYCYZCFGVIP-NSHDSACASA-N 0 3 344.242 3.966 20 5 EHBDHN CO[C@@H](CN[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000788670164 1134159868 /nfs/dbraw/zinc/15/98/68/1134159868.db2.gz SQFUMQBDUUGQIR-GTNSWQLSSA-N 0 3 349.818 3.869 20 5 EHBDHN COc1cc2c(cc1F)CC[C@@H]2N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788815721 1134176060 /nfs/dbraw/zinc/17/60/60/1134176060.db2.gz DPAYQIPTXJRSAC-QFYYESIMSA-N 0 3 345.374 3.663 20 5 EHBDHN CC(C)C[C@H]1OCCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000775371662 1134674985 /nfs/dbraw/zinc/67/49/85/1134674985.db2.gz OUNKCLWCLPPAAA-JKSUJKDBSA-N 0 3 326.824 3.932 20 5 EHBDHN CC[C@](C)(NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000775389519 1134704640 /nfs/dbraw/zinc/70/46/40/1134704640.db2.gz GNOPUDKIGQKCPN-IBGZPJMESA-N 0 3 341.411 3.757 20 5 EHBDHN CCCCN(CCn1c(C)ncc1[N+](=O)[O-])[C@@H](C)c1ccc(C)o1 ZINC001190588760 1134723420 /nfs/dbraw/zinc/72/34/20/1134723420.db2.gz DUWGOTYWFCQKFE-AWEZNQCLSA-N 0 3 334.420 3.864 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCC[C@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC001170345842 1134759790 /nfs/dbraw/zinc/75/97/90/1134759790.db2.gz MXANIWHQPWSNIJ-KDOFPFPSSA-N 0 3 341.411 3.767 20 5 EHBDHN CO[C@@H]1[C@H](C)[C@@H](NCc2cc([N+](=O)[O-])ccc2OC(C)C)C1(C)C ZINC001170397971 1134764276 /nfs/dbraw/zinc/76/42/76/1134764276.db2.gz BWVPFEYDSAIGLM-CSMYWGQOSA-N 0 3 336.432 3.531 20 5 EHBDHN COC(=O)c1ccc([N+](=O)[O-])c(CN(C)[C@@H](C)Cc2cccs2)c1 ZINC001191465279 1134876105 /nfs/dbraw/zinc/87/61/05/1134876105.db2.gz YSDLGKBALDWXLN-LBPRGKRZSA-N 0 3 348.424 3.506 20 5 EHBDHN CC[C@@H](C)N[C@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804781935 1135199740 /nfs/dbraw/zinc/19/97/40/1135199740.db2.gz LBNHQALBKBOHIH-VXGBXAGGSA-N 0 3 348.359 3.637 20 5 EHBDHN CCC1(CC)[C@H](OC)C[C@@H]1NCc1ccc([N+](=O)[O-])cc1Cl ZINC001194091444 1135231428 /nfs/dbraw/zinc/23/14/28/1135231428.db2.gz MOPADTJBXWQUQK-LSDHHAIUSA-N 0 3 326.824 3.932 20 5 EHBDHN CO[C@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1(C)C ZINC000811483478 1136092130 /nfs/dbraw/zinc/09/21/30/1136092130.db2.gz JYKADJLSOLKYEW-RYUDHWBXSA-N 0 3 333.215 3.805 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@H]3COC4(CCC4)C3)o2)c1 ZINC000850367820 1136242297 /nfs/dbraw/zinc/24/22/97/1136242297.db2.gz QDMVYNGUCXGHON-CQSZACIVSA-N 0 3 328.368 3.656 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@@H]3COC4(CCC4)C3)o2)c1 ZINC000850367818 1136242418 /nfs/dbraw/zinc/24/24/18/1136242418.db2.gz QDMVYNGUCXGHON-AWEZNQCLSA-N 0 3 328.368 3.656 20 5 EHBDHN CC(C)[C@@H](O)[C@@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000850553738 1136284349 /nfs/dbraw/zinc/28/43/49/1136284349.db2.gz CACWDPNOHAMSAL-FASAQXTFSA-N 0 3 343.427 3.586 20 5 EHBDHN CC(COC(=O)c1cc(-c2ccccc2)nc2ccccc21)[N+](=O)[O-] ZINC000813104334 1136288143 /nfs/dbraw/zinc/28/81/43/1136288143.db2.gz MUVBFVBMWJMRPO-ZDUSSCGKSA-N 0 3 336.347 3.724 20 5 EHBDHN CC(COC(=O)c1ccccc1SCc1cccs1)[N+](=O)[O-] ZINC000813103027 1136288222 /nfs/dbraw/zinc/28/82/22/1136288222.db2.gz YKLCRDKKPNKJFC-NSHDSACASA-N 0 3 337.422 3.862 20 5 EHBDHN CC(COC(=O)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1)[N+](=O)[O-] ZINC000813104018 1136288463 /nfs/dbraw/zinc/28/84/63/1136288463.db2.gz WHKYUKHIAJPRJF-JHJVBQTASA-N 0 3 346.408 3.555 20 5 EHBDHN CC(COC(=O)CC(Cc1ccccc1)Cc1ccccc1)[N+](=O)[O-] ZINC000813107595 1136293945 /nfs/dbraw/zinc/29/39/45/1136293945.db2.gz OSXVQIUOZXOXLX-MRXNPFEDSA-N 0 3 341.407 3.687 20 5 EHBDHN CC(COC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)[N+](=O)[O-] ZINC000813111047 1136294086 /nfs/dbraw/zinc/29/40/86/1136294086.db2.gz BAJZACJUCKVFMQ-NCJLJLRUSA-N 0 3 337.681 3.580 20 5 EHBDHN CC(COC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)[N+](=O)[O-] ZINC000813107494 1136294110 /nfs/dbraw/zinc/29/41/10/1136294110.db2.gz RAKQLSKBHSHXOA-LUHPIMIVSA-N 0 3 335.356 3.636 20 5 EHBDHN CC(COC(=O)c1cc2cc(C(F)(F)F)ccc2s1)[N+](=O)[O-] ZINC000851036731 1136330459 /nfs/dbraw/zinc/33/04/59/1136330459.db2.gz MCBHSWIVHFSGCN-SSDOTTSWSA-N 0 3 333.287 3.742 20 5 EHBDHN O=[N+]([O-])c1ccc2cnn(CN3CCC[C@H](c4ccccc4)C3)c2c1 ZINC000814226333 1136425778 /nfs/dbraw/zinc/42/57/78/1136425778.db2.gz VIQITTZAYISYIL-KRWDZBQOSA-N 0 3 336.395 3.782 20 5 EHBDHN CCCN(Cc1ccccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580680 1136444919 /nfs/dbraw/zinc/44/49/19/1136444919.db2.gz YXEQQHWIAUNLAR-GOSISDBHSA-N 0 3 332.375 3.680 20 5 EHBDHN CC(C)OCc1ccccc1CN[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815566137 1136611776 /nfs/dbraw/zinc/61/17/76/1136611776.db2.gz JRVHDKWZJLNKDI-CQSZACIVSA-N 0 3 343.427 3.953 20 5 EHBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3ccc(Cl)o3)CC2)cc1 ZINC000776745854 1136622985 /nfs/dbraw/zinc/62/29/85/1136622985.db2.gz NLSYJEFLPDEIEX-UHFFFAOYSA-N 0 3 335.791 3.600 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000859830158 1137033290 /nfs/dbraw/zinc/03/32/90/1137033290.db2.gz NECOVKJHNUFIMG-LOKDSWTASA-N 0 3 333.215 3.803 20 5 EHBDHN CSCC1(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])CC1 ZINC000845875805 1137316169 /nfs/dbraw/zinc/31/61/69/1137316169.db2.gz CLFDFLNLEZHRIH-NHYWBVRUSA-N 0 3 341.404 3.609 20 5 EHBDHN O=[N+]([O-])c1cc2ccccc2nc1N[C@H]1CCN(Cc2ccccc2)C1 ZINC001649160324 1137479570 /nfs/dbraw/zinc/47/95/70/1137479570.db2.gz XEZRRVDWFPADKS-KRWDZBQOSA-N 0 3 348.406 3.829 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](c1ccco1)N(C)C ZINC000872018794 1137564853 /nfs/dbraw/zinc/56/48/53/1137564853.db2.gz PPHUCPMLPOTHPX-SWLSCSKDSA-N 0 3 349.456 3.863 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCCC(F)(F)[C@H]1O ZINC000872080355 1137570166 /nfs/dbraw/zinc/57/01/66/1137570166.db2.gz PVTNVBWNTJZXOM-BHYNMZESSA-N 0 3 346.399 3.516 20 5 EHBDHN C[C@@H](N[C@@H](C)CC(=O)Nc1cccc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000872129597 1137573099 /nfs/dbraw/zinc/57/30/99/1137573099.db2.gz REMXLQIKFZEWMM-QWHCGFSZSA-N 0 3 345.374 3.802 20 5 EHBDHN Cc1c(CNC[C@@H](O)c2cc(F)cc(Cl)c2)cccc1[N+](=O)[O-] ZINC000873116214 1137590520 /nfs/dbraw/zinc/59/05/20/1137590520.db2.gz YINXKXNGZLCSGF-MRXNPFEDSA-N 0 3 338.766 3.519 20 5 EHBDHN CC[C@H](NC1CC(n2cc([N+](=O)[O-])cn2)C1)c1cc(F)ccc1F ZINC000877054821 1137668836 /nfs/dbraw/zinc/66/88/36/1137668836.db2.gz LHMLOTIPWKXUCZ-PPUFBPAQSA-N 0 3 336.342 3.514 20 5 EHBDHN CSC(C)(C)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000877064619 1137669185 /nfs/dbraw/zinc/66/91/85/1137669185.db2.gz CDUMEOJLGVTCDV-UHFFFAOYSA-N 0 3 339.280 3.650 20 5 EHBDHN C[C@@]1(CCNCc2nc3cc([N+](=O)[O-])ccc3o2)C[C@]1(F)Cl ZINC000877610955 1137682790 /nfs/dbraw/zinc/68/27/90/1137682790.db2.gz MRZOESBOUUGAMA-ZIAGYGMSSA-N 0 3 327.743 3.530 20 5 EHBDHN CCCCN(CC)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000131875168 1137860883 /nfs/dbraw/zinc/86/08/83/1137860883.db2.gz VXQMRMAWRQLSFH-LLVKDONJSA-N 0 3 327.812 3.697 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCCCOCC3CC3)cs2)c1 ZINC000113315456 1137912533 /nfs/dbraw/zinc/91/25/33/1137912533.db2.gz DRUSLYXLUDORDG-UHFFFAOYSA-N 0 3 347.440 3.625 20 5 EHBDHN CCC[C@@H](CCO)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000080524346 1138163149 /nfs/dbraw/zinc/16/31/49/1138163149.db2.gz UADUISCVNFAMLS-ZDUSSCGKSA-N 0 3 349.456 3.607 20 5 EHBDHN C[C@H](O)C1CCN(Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000264733575 1138620888 /nfs/dbraw/zinc/62/08/88/1138620888.db2.gz QHLYZUCTZANMBH-AWEZNQCLSA-N 0 3 337.419 3.539 20 5 EHBDHN CC(C)(CO)CCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174426002 1139419165 /nfs/dbraw/zinc/41/91/65/1139419165.db2.gz BWXAOOVOPKAAPZ-UHFFFAOYSA-N 0 3 349.456 3.607 20 5 EHBDHN Cc1ccc(CNC2(c3cccc(F)c3)CCOCC2)cc1[N+](=O)[O-] ZINC000174645683 1139432772 /nfs/dbraw/zinc/43/27/72/1139432772.db2.gz YXMDBFNBVXOVDN-UHFFFAOYSA-N 0 3 344.386 3.838 20 5 EHBDHN CC(C)(O)c1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000193305005 1140571237 /nfs/dbraw/zinc/57/12/37/1140571237.db2.gz WNZSBCHJPYRMKR-IBGZPJMESA-N 0 3 340.423 3.989 20 5 EHBDHN C[C@H]1C[C@H](CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000271258090 1141334970 /nfs/dbraw/zinc/33/49/70/1141334970.db2.gz ACNPFXXMGUQUQT-QWHCGFSZSA-N 0 3 347.440 3.623 20 5 EHBDHN COc1ccc(COCCN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000091741005 1015640532 /nfs/dbraw/zinc/64/05/32/1015640532.db2.gz MUJOEPCSLYGEIR-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN CC(C)[C@@H]1N(C/C=C\c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414527944 1016954197 /nfs/dbraw/zinc/95/41/97/1016954197.db2.gz NJYBVTZHILJHEM-YEODSOHDSA-N 0 3 330.428 3.745 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593517 1032314890 /nfs/dbraw/zinc/31/48/90/1032314890.db2.gz VOYBOPWMXNVOAE-ACJLOTCBSA-N 0 3 334.416 3.710 20 5 EHBDHN CC[C@H](NC[C@@H](O)c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000090078925 1032570404 /nfs/dbraw/zinc/57/04/04/1032570404.db2.gz ZNZWKGDZISYYFF-JKSUJKDBSA-N 0 3 336.338 3.647 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCCNC2(c3nccs3)CCCC2)cc1 ZINC000177167792 1017593985 /nfs/dbraw/zinc/59/39/85/1017593985.db2.gz WQDXIPGINFVBIK-UHFFFAOYSA-N 0 3 347.440 3.879 20 5 EHBDHN COc1ccc(CNC[C@H]2CC[C@H](c3ccccc3)O2)cc1[N+](=O)[O-] ZINC000377401327 1017751443 /nfs/dbraw/zinc/75/14/43/1017751443.db2.gz IQOFDNMBQIISFO-SJLPKXTDSA-N 0 3 342.395 3.613 20 5 EHBDHN COc1cc(C)ccc1[C@H](C)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000536861833 1019374057 /nfs/dbraw/zinc/37/40/57/1019374057.db2.gz DSCGGCMCAZBWOA-AWEZNQCLSA-N 0 3 330.384 3.641 20 5 EHBDHN CN1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2cc3ccccc3cc2c1 ZINC001270139439 1021365230 /nfs/dbraw/zinc/36/52/30/1021365230.db2.gz ACDHOFHILPMGQL-SFTDATJTSA-N 0 3 330.431 3.912 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c(Cl)c1 ZINC000322895820 1021373949 /nfs/dbraw/zinc/37/39/49/1021373949.db2.gz BSPBGKWGCYTILD-USXIJHARSA-N 0 3 338.835 3.764 20 5 EHBDHN COc1cc(CN(C)CCCOCc2ccccc2)ccc1[N+](=O)[O-] ZINC000439478874 1021471602 /nfs/dbraw/zinc/47/16/02/1021471602.db2.gz PADBZKCQPWUSLI-UHFFFAOYSA-N 0 3 344.411 3.642 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCC[C@@H]1CCCCO1 ZINC000602595505 1032990930 /nfs/dbraw/zinc/99/09/30/1032990930.db2.gz BNGQLVXSZUFKOS-ZDUSSCGKSA-N 0 3 332.322 3.662 20 5 EHBDHN COc1cc(CN2CC(C)(C)[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000516670755 1021640248 /nfs/dbraw/zinc/64/02/48/1021640248.db2.gz RHBUNVPQVBMEIP-KBPBESRZSA-N 0 3 334.416 3.623 20 5 EHBDHN Cc1ccc([C@H](CNc2ncccc2[N+](=O)[O-])N2CCCC2)cc1 ZINC000141071334 1033011967 /nfs/dbraw/zinc/01/19/67/1033011967.db2.gz XQEOJCIXURNGFB-KRWDZBQOSA-N 0 3 326.400 3.547 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCCC[C@H]3CCOC3)cs2)c1 ZINC000449682493 1033033585 /nfs/dbraw/zinc/03/35/85/1033033585.db2.gz LPQFJPQQOBXAGE-ZDUSSCGKSA-N 0 3 347.440 3.625 20 5 EHBDHN CN(CCCCO)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000471812112 1022328592 /nfs/dbraw/zinc/32/85/92/1022328592.db2.gz UQGRCTXQWIHNSJ-UHFFFAOYSA-N 0 3 343.427 3.567 20 5 EHBDHN CC1(C2(NCc3cc(Br)c([N+](=O)[O-])s3)CC2)CC1 ZINC000602683301 1033083286 /nfs/dbraw/zinc/08/32/86/1033083286.db2.gz VFTWMHOULWGUAH-UHFFFAOYSA-N 0 3 331.235 3.841 20 5 EHBDHN CCO[C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000610930483 1023877315 /nfs/dbraw/zinc/87/73/15/1023877315.db2.gz SMUSNBJDDDJKOQ-MRXNPFEDSA-N 0 3 330.384 3.856 20 5 EHBDHN COc1ccc([C@H]2CCCN2CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000065208804 1023916011 /nfs/dbraw/zinc/91/60/11/1023916011.db2.gz CVDHJCWXCLDDMP-LJQANCHMSA-N 0 3 342.395 3.819 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](c2nccs2)C1 ZINC000895581237 1024638678 /nfs/dbraw/zinc/63/86/78/1024638678.db2.gz MNEWZKZQSMPCEW-UZGISAJGSA-N 0 3 329.425 3.944 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](c2nccs2)C1 ZINC000895581231 1024639163 /nfs/dbraw/zinc/63/91/63/1024639163.db2.gz MNEWZKZQSMPCEW-BMQCOBNYSA-N 0 3 329.425 3.944 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000065535761 1024660904 /nfs/dbraw/zinc/66/09/04/1024660904.db2.gz YYTAKNUEFDFEIT-SFHVURJKSA-N 0 3 330.359 3.950 20 5 EHBDHN C[C@H]1CCC[C@@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478221 1025659138 /nfs/dbraw/zinc/65/91/38/1025659138.db2.gz HEEKVOKEPUDIPW-GXTWGEPZSA-N 0 3 330.388 3.655 20 5 EHBDHN CC(=O)c1ccc(N[C@H](C)[C@H](c2ccccc2)N(C)C)c([N+](=O)[O-])c1 ZINC000439128815 1025789492 /nfs/dbraw/zinc/78/94/92/1025789492.db2.gz PKKNKPZHMUKKLE-BFUOFWGJSA-N 0 3 341.411 3.901 20 5 EHBDHN COc1ccc(CN2CCC[C@H]2Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000520041892 1026680374 /nfs/dbraw/zinc/68/03/74/1026680374.db2.gz SPEZHJMTPANVMC-KRWDZBQOSA-N 0 3 344.386 3.950 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@H]1Cn1cnc2ccccc21 ZINC000339905658 1026734092 /nfs/dbraw/zinc/73/40/92/1026734092.db2.gz ACRSNBYAROOWAZ-INIZCTEOSA-N 0 3 336.395 3.609 20 5 EHBDHN Cc1csc(C2(N[C@@H](C)Cc3ccccc3[N+](=O)[O-])CCC2)n1 ZINC000453173636 1027495211 /nfs/dbraw/zinc/49/52/11/1027495211.db2.gz KVCOSQPUOCCVFA-LBPRGKRZSA-N 0 3 331.441 3.960 20 5 EHBDHN O=C(CCN(Cc1ccc([N+](=O)[O-])cc1)C1CC1)Nc1ccccc1 ZINC000130194120 1028367261 /nfs/dbraw/zinc/36/72/61/1028367261.db2.gz UKXUDUNRSXDLQX-UHFFFAOYSA-N 0 3 339.395 3.588 20 5 EHBDHN COc1ccc([C@H]2CCN(Cc3cc([N+](=O)[O-])ccc3OC)C2)cc1 ZINC000504521289 1028710017 /nfs/dbraw/zinc/71/00/17/1028710017.db2.gz KECRQWJUEYAWFG-HNNXBMFYSA-N 0 3 342.395 3.602 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCOc2cccc(C(F)(F)F)c2)cc1 ZINC000237850597 1029454328 /nfs/dbraw/zinc/45/43/28/1029454328.db2.gz GZVIORDTPGKGQE-UHFFFAOYSA-N 0 3 340.301 3.782 20 5 EHBDHN Cc1c(CN(C)[C@H](C)[C@@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000441042870 1029660249 /nfs/dbraw/zinc/66/02/49/1029660249.db2.gz GECBPPXFLXQJQY-KUHUBIRLSA-N 0 3 326.396 3.727 20 5 EHBDHN C[C@@H]1CC[C@H](NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000248540693 1031908806 /nfs/dbraw/zinc/90/88/06/1031908806.db2.gz BKIHHQNVFDFWMQ-XUJVJEKNSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)F)nc1 ZINC000595019155 1033612890 /nfs/dbraw/zinc/61/28/90/1033612890.db2.gz IYVYAEUYMLSNJE-NSHDSACASA-N 0 3 337.326 3.657 20 5 EHBDHN Cc1ccc(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1[N+](=O)[O-] ZINC000061110780 1033642514 /nfs/dbraw/zinc/64/25/14/1033642514.db2.gz NWOOFOXVYGSQFU-ZDUSSCGKSA-N 0 3 339.395 3.639 20 5 EHBDHN O=[N+]([O-])c1ccc2[nH]cc(CCN[C@H]3CCCc4scnc43)c2c1 ZINC000599047531 1033675046 /nfs/dbraw/zinc/67/50/46/1033675046.db2.gz ZUFWWIOMGXPOGZ-HNNXBMFYSA-N 0 3 342.424 3.742 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NC[C@H](CO)CC2CC2)c2ccccc2)c1 ZINC000595089278 1033698982 /nfs/dbraw/zinc/69/89/82/1033698982.db2.gz NBWMPSDUGGHEPQ-UZLBHIALSA-N 0 3 340.423 3.682 20 5 EHBDHN C[C@@H](COCC1CC1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000593682191 1033751202 /nfs/dbraw/zinc/75/12/02/1033751202.db2.gz QIMTUDDPJBBAHV-ZDUSSCGKSA-N 0 3 330.384 3.760 20 5 EHBDHN CC[C@@H]1CCC[C@H](C)N1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000595867716 1034032846 /nfs/dbraw/zinc/03/28/46/1034032846.db2.gz OXNOOOMTYAQDKQ-GXTWGEPZSA-N 0 3 330.388 3.798 20 5 EHBDHN COc1ccccc1CN(C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012364 1034135825 /nfs/dbraw/zinc/13/58/25/1034135825.db2.gz IVTQMBPVALLDMG-UHFFFAOYSA-N 0 3 330.384 3.504 20 5 EHBDHN CN(c1ccccc1)c1ccc(CN[C@]2(C)CCOC2)cc1[N+](=O)[O-] ZINC000534455290 1034578946 /nfs/dbraw/zinc/57/89/46/1034578946.db2.gz LNIOGCAJUJUDLT-LJQANCHMSA-N 0 3 341.411 3.631 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@@H]1CCC[C@H]1OCc1ccccc1 ZINC000450975255 1034974908 /nfs/dbraw/zinc/97/49/08/1034974908.db2.gz XMDWBJDPGIUIPV-IEBWSBKVSA-N 0 3 326.396 3.822 20 5 EHBDHN CCC[C@](C)(O)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492223240 1035511409 /nfs/dbraw/zinc/51/14/09/1035511409.db2.gz KJPKBMVZVVPMOW-MOPGFXCFSA-N 0 3 328.412 3.825 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@H]2c2cccnc2)cc1 ZINC000588203883 1035821076 /nfs/dbraw/zinc/82/10/76/1035821076.db2.gz MQKPJKMNLNSHDR-SFHVURJKSA-N 0 3 327.384 3.596 20 5 EHBDHN C[C@H](NCCC(=O)Nc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000180446328 1036840581 /nfs/dbraw/zinc/84/05/81/1036840581.db2.gz XCISZVNMBRDMSX-LBPRGKRZSA-N 0 3 347.802 3.928 20 5 EHBDHN C[C@@H](NCc1ccc(Cn2cccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000180888066 1037285500 /nfs/dbraw/zinc/28/55/00/1037285500.db2.gz BUJXNGGBVBRQRP-OAHLLOKOSA-N 0 3 336.395 3.690 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000532470202 1037414785 /nfs/dbraw/zinc/41/47/85/1037414785.db2.gz CFUNJGIUYAJXOM-FDQGKXFDSA-N 0 3 345.443 3.742 20 5 EHBDHN CC(C)N(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCOC1 ZINC000462879862 1037509166 /nfs/dbraw/zinc/50/91/66/1037509166.db2.gz ZXISFSIMGZXSBO-CQSZACIVSA-N 0 3 330.384 3.854 20 5 EHBDHN C=Cc1ccc(CCNCc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000462915690 1037545199 /nfs/dbraw/zinc/54/51/99/1037545199.db2.gz YUHBXIMCEAHSGG-UHFFFAOYSA-N 0 3 342.395 3.587 20 5 EHBDHN COc1cc(F)c([C@H](C)NCCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000540150522 1037621808 /nfs/dbraw/zinc/62/18/08/1037621808.db2.gz GKDSVGXZMXYZBZ-LBPRGKRZSA-N 0 3 348.374 3.644 20 5 EHBDHN CC(C)[C@H](c1ccccc1Cl)N(C)CCn1ccc([N+](=O)[O-])n1 ZINC000478044383 1039164448 /nfs/dbraw/zinc/16/44/48/1039164448.db2.gz CBGAOCHPYHLVGU-MRXNPFEDSA-N 0 3 336.823 3.774 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@@H]2SCCc3ccccc32)c(F)c1 ZINC000478246055 1039319562 /nfs/dbraw/zinc/31/95/62/1039319562.db2.gz BCWSLXDAGHUURG-KRWDZBQOSA-N 0 3 332.400 3.854 20 5 EHBDHN Cc1c(CNCc2ccc(F)c3cccnc23)cccc1[N+](=O)[O-] ZINC000480456457 1039559846 /nfs/dbraw/zinc/55/98/46/1039559846.db2.gz QIUIXUCISKIXSH-UHFFFAOYSA-N 0 3 325.343 3.880 20 5 EHBDHN CC[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CC1(C)C ZINC000419314209 1041252289 /nfs/dbraw/zinc/25/22/89/1041252289.db2.gz HOLVBZFZVWIMCZ-KBPBESRZSA-N 0 3 330.388 3.559 20 5 EHBDHN CN(C)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000047452767 1041643020 /nfs/dbraw/zinc/64/30/20/1041643020.db2.gz NKTRMIPFKBVVHY-UHFFFAOYSA-N 0 3 333.775 3.562 20 5 EHBDHN Cc1ccc(Sc2ccc(CNC3(CO)CC3)cc2[N+](=O)[O-])cc1 ZINC000120358726 1042647239 /nfs/dbraw/zinc/64/72/39/1042647239.db2.gz QZLRFNMCRMHUMN-UHFFFAOYSA-N 0 3 344.436 3.669 20 5 EHBDHN Cc1c([C@H](C)N[C@@H](C)c2ccc(NC(N)=O)cc2)cccc1[N+](=O)[O-] ZINC000165434996 1042814525 /nfs/dbraw/zinc/81/45/25/1042814525.db2.gz SEUBGSDNDNVAGX-STQMWFEESA-N 0 3 342.399 3.806 20 5 EHBDHN CC[C@@H]1CCC[C@@H]1N[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000279239359 1043639907 /nfs/dbraw/zinc/63/99/07/1043639907.db2.gz JWOLGSLRJKRMCZ-JMSVASOKSA-N 0 3 330.388 3.874 20 5 EHBDHN CCS[C@H]1CCCCN(Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765009861 1127564893 /nfs/dbraw/zinc/56/48/93/1127564893.db2.gz FCWOHAVZQLIJAZ-HNNXBMFYSA-N 0 3 348.472 3.818 20 5 EHBDHN C[C@H](N[C@@H](C)C1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172171389 1127799044 /nfs/dbraw/zinc/79/90/44/1127799044.db2.gz UHIUAKVAROPBOS-RYUDHWBXSA-N 0 3 330.388 3.874 20 5 EHBDHN CC(C)[C@@H](CO)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000554089112 1128615389 /nfs/dbraw/zinc/61/53/89/1128615389.db2.gz RNOIWMDGILABPR-MJGOQNOKSA-N 0 3 328.412 3.538 20 5 EHBDHN CC[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000194014063 1121752861 /nfs/dbraw/zinc/75/28/61/1121752861.db2.gz FYTVYQZDXQHHIN-HNNXBMFYSA-N 0 3 327.384 3.583 20 5 EHBDHN C[C@@H]1CCCC[C@@H]1N(C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143281 1121784371 /nfs/dbraw/zinc/78/43/71/1121784371.db2.gz OXLCSTUULHJZSO-DOMZBBRYSA-N 0 3 330.388 3.655 20 5 EHBDHN CC[C@H](C)[C@@H]1CCCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001844 1123710545 /nfs/dbraw/zinc/71/05/45/1123710545.db2.gz DSIHTARBBOQNJP-GUYCJALGSA-N 0 3 334.416 3.862 20 5 EHBDHN C[C@@H](C(=O)Nc1cccc(CN(C)C)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182644361 1125349109 /nfs/dbraw/zinc/34/91/09/1125349109.db2.gz CLHKKHHYGPSZDA-GFCCVEGCSA-N 0 3 345.374 3.538 20 5 EHBDHN Cc1cc(C)cc([C@H](C)NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000182917038 1125400828 /nfs/dbraw/zinc/40/08/28/1125400828.db2.gz WYNOSICQFAETKU-HNNXBMFYSA-N 0 3 341.411 3.525 20 5 EHBDHN C[C@H](NC[C@H](c1ccco1)N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000154964471 1129602054 /nfs/dbraw/zinc/60/20/54/1129602054.db2.gz WOADWVKXAQVIIQ-WMLDXEAASA-N 0 3 329.400 3.676 20 5 EHBDHN CN(CCn1cccn1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000125251158 1129674081 /nfs/dbraw/zinc/67/40/81/1129674081.db2.gz KAHOIZYLBTWDJJ-UHFFFAOYSA-N 0 3 342.424 3.652 20 5 EHBDHN CCC[C@H](N[C@@H]1CCCc2nn(C)cc21)c1cccc([N+](=O)[O-])c1 ZINC000282509049 1129974533 /nfs/dbraw/zinc/97/45/33/1129974533.db2.gz SQGZRWBBRNFERJ-DLBZAZTESA-N 0 3 328.416 3.837 20 5 EHBDHN CN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCCC1 ZINC000039536600 1130139741 /nfs/dbraw/zinc/13/97/41/1130139741.db2.gz VRTYTRAFFISYBO-UHFFFAOYSA-N 0 3 339.823 3.841 20 5 EHBDHN CCN(CC)[C@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000173363647 1130219271 /nfs/dbraw/zinc/21/92/71/1130219271.db2.gz MYYMDQJYYMCLPG-RHSMWYFYSA-N 0 3 331.416 3.922 20 5 EHBDHN C[C@@H]1C[C@@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)O1 ZINC000245557744 1130237542 /nfs/dbraw/zinc/23/75/42/1130237542.db2.gz AZYCNJAXBFQCSM-DABQJJPHSA-N 0 3 347.440 3.764 20 5 EHBDHN CC(=O)[C@@H](N[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172901661 1131884542 /nfs/dbraw/zinc/88/45/42/1131884542.db2.gz PRNYAYTUACMKCI-AZUAARDMSA-N 0 3 338.407 3.762 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H](c1ncccc1F)C1CC1 ZINC001173230557 1132009279 /nfs/dbraw/zinc/00/92/79/1132009279.db2.gz RXMFQNAMAZRWFE-SJCJKPOMSA-N 0 3 329.375 3.801 20 5 EHBDHN CC(C)CCN(Cn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCCC1 ZINC000746064581 1132362574 /nfs/dbraw/zinc/36/25/74/1132362574.db2.gz NDZDMMMTDGLLTC-UHFFFAOYSA-N 0 3 347.415 3.751 20 5 EHBDHN CN(C)[C@H]1CCOc2c(Nc3cc([N+](=O)[O-])ccc3F)cccc21 ZINC001175737410 1132748991 /nfs/dbraw/zinc/74/89/91/1132748991.db2.gz SFNROOFLRQHVOF-INIZCTEOSA-N 0 3 331.347 3.863 20 5 EHBDHN C[C@H]1CCC[C@@H]1CNCc1c(Br)cccc1[N+](=O)[O-] ZINC001178558036 1133181132 /nfs/dbraw/zinc/18/11/32/1133181132.db2.gz WZZVXNVXEDJJGQ-WDEREUQCSA-N 0 3 327.222 3.883 20 5 EHBDHN C[C@@H]1COCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000769455710 1133294635 /nfs/dbraw/zinc/29/46/35/1133294635.db2.gz JLWATHFTVWMJCA-ZDUSSCGKSA-N 0 3 332.425 3.792 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CNC1CC(c2ccc(F)cc2F)C1 ZINC001180311258 1133355432 /nfs/dbraw/zinc/35/54/32/1133355432.db2.gz ZQIQZWJGCNDPMQ-UHFFFAOYSA-N 0 3 348.349 3.917 20 5 EHBDHN Cc1ccc(CNC[C@@H](O)c2cc(F)cc(Cl)c2)cc1[N+](=O)[O-] ZINC000785608243 1133726309 /nfs/dbraw/zinc/72/63/09/1133726309.db2.gz FUJJEOMZLWVXMW-MRXNPFEDSA-N 0 3 338.766 3.519 20 5 EHBDHN O=[N+]([O-])c1cc2ccccc2nc1NC[C@H]1CCN1C1CCCC1 ZINC001187243209 1134313505 /nfs/dbraw/zinc/31/35/05/1134313505.db2.gz SYDBUOMRSHOJPN-OAHLLOKOSA-N 0 3 326.400 3.572 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H](c2ccc(F)cc2F)C2CC2)c1 ZINC001192617518 1135041093 /nfs/dbraw/zinc/04/10/93/1135041093.db2.gz UPOSFOPNHBMSFY-ZWKOTPCHSA-N 0 3 348.349 3.647 20 5 EHBDHN CCC1(CC)[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1OC ZINC001194091443 1135231929 /nfs/dbraw/zinc/23/19/29/1135231929.db2.gz MOPADTJBXWQUQK-HUUCEWRRSA-N 0 3 326.824 3.932 20 5 EHBDHN CCC[C@H](N[C@@H]1COc2ccccc2[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000808728428 1135723807 /nfs/dbraw/zinc/72/38/07/1135723807.db2.gz DUCARYJTAXLGNT-YQVWRLOYSA-N 0 3 342.395 3.520 20 5 EHBDHN C[C@H](CO)N(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CCC1 ZINC000809999426 1135912435 /nfs/dbraw/zinc/91/24/35/1135912435.db2.gz HLFBNPMPKMLSDK-SNVBAGLBSA-N 0 3 347.242 3.885 20 5 EHBDHN C[C@]1(CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCCC[C@@H]1O ZINC000811483105 1136091277 /nfs/dbraw/zinc/09/12/77/1136091277.db2.gz BWNCBPXZKNGYLH-DZGCQCFKSA-N 0 3 347.242 3.932 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCC2SCCS2)o1 ZINC000850401528 1136249981 /nfs/dbraw/zinc/24/99/81/1136249981.db2.gz IGWGTMYNXWOWBE-UHFFFAOYSA-N 0 3 336.438 3.751 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C)[C@H](O)c1ccc(C)cc1 ZINC000850468342 1136265320 /nfs/dbraw/zinc/26/53/20/1136265320.db2.gz BOMPPMDNXVNXJC-NJSLBKSFSA-N 0 3 344.411 3.685 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C)[C@](C)(O)c1ccccc1 ZINC000850477247 1136266914 /nfs/dbraw/zinc/26/69/14/1136266914.db2.gz RVHFBJJGKQXJLT-KSMMKXTCSA-N 0 3 344.411 3.550 20 5 EHBDHN CC(COC(=O)c1sc(-c2ccccc2)nc1C(F)F)[N+](=O)[O-] ZINC000813100569 1136287696 /nfs/dbraw/zinc/28/76/96/1136287696.db2.gz UOLHGQRJFPNKOK-MRVPVSSYSA-N 0 3 342.323 3.570 20 5 EHBDHN CC(COC(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1)[N+](=O)[O-] ZINC000813104309 1136288426 /nfs/dbraw/zinc/28/84/26/1136288426.db2.gz MEXHXBYMUMZHQV-LLVKDONJSA-N 0 3 345.317 3.726 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@H]1CCN(c2ccccc2F)C1 ZINC000813792391 1136363129 /nfs/dbraw/zinc/36/31/29/1136363129.db2.gz XYPWABKATJMUGU-AWEZNQCLSA-N 0 3 349.793 3.756 20 5 EHBDHN C[C@@H]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000776589713 1136452950 /nfs/dbraw/zinc/45/29/50/1136452950.db2.gz VUPNDISZUILLIL-COXVUDFISA-N 0 3 330.384 3.694 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CNC2(c3ccc(Cl)cc3)CC2)cc1 ZINC000776606715 1136469783 /nfs/dbraw/zinc/46/97/83/1136469783.db2.gz ZZOKUGQEBBXDAF-INIZCTEOSA-N 0 3 332.787 3.561 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])c1 ZINC000843840497 1137185683 /nfs/dbraw/zinc/18/56/83/1137185683.db2.gz CSUPOPJWGQAMKU-UHFFFAOYSA-N 0 3 345.374 3.665 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CNC2(c3ccccc3Cl)CCC2)cc1 ZINC000844350516 1137214147 /nfs/dbraw/zinc/21/41/47/1137214147.db2.gz HBTVHXVDICBIDH-KRWDZBQOSA-N 0 3 346.814 3.951 20 5 EHBDHN CC([C@@H](OC(=O)CCCC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845872960 1137316121 /nfs/dbraw/zinc/31/61/21/1137316121.db2.gz AYGJOZCIBRRYQN-TVQRCGJNSA-N 0 3 337.269 3.808 20 5 EHBDHN COCc1cccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845873775 1137316181 /nfs/dbraw/zinc/31/61/81/1137316181.db2.gz VWOGENYVKHXHNM-YVEFUNNKSA-N 0 3 347.342 3.535 20 5 EHBDHN CSCCCCC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881445 1137316899 /nfs/dbraw/zinc/31/68/99/1137316899.db2.gz ZTCMPFOSWJGHPN-XHDPSFHLSA-N 0 3 329.393 3.609 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@]34CCC[C@H]3OCC4)o2)c1 ZINC000865860272 1137317352 /nfs/dbraw/zinc/31/73/52/1137317352.db2.gz UHGXTCCEZBEDKX-MSOLQXFVSA-N 0 3 328.368 3.656 20 5 EHBDHN C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCc2ccccc21 ZINC001171740043 1137511343 /nfs/dbraw/zinc/51/13/43/1137511343.db2.gz ARGUWPFDJFFWPP-CYBMUJFWSA-N 0 3 341.367 3.665 20 5 EHBDHN CC1(C)CCCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878132507 1137703881 /nfs/dbraw/zinc/70/38/81/1137703881.db2.gz XOBLBVZQILNYSI-UHFFFAOYSA-N 0 3 330.388 3.657 20 5 EHBDHN CCC(CC)CN(CC)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000076650763 1138133416 /nfs/dbraw/zinc/13/34/16/1138133416.db2.gz JDGILBBULNRHCU-UHFFFAOYSA-N 0 3 332.404 3.903 20 5 EHBDHN CC[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000302092477 1138711321 /nfs/dbraw/zinc/71/13/21/1138711321.db2.gz FEKLVSBBTSXTAX-GXTWGEPZSA-N 0 3 337.420 3.549 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000152743776 1139106216 /nfs/dbraw/zinc/10/62/16/1139106216.db2.gz NXZPLSONPVDFBG-SJKOYZFVSA-N 0 3 348.374 3.517 20 5 EHBDHN CCOc1ccc([C@@H](C)NCc2cccc(N(C)C)c2)cc1[N+](=O)[O-] ZINC000153573840 1139142275 /nfs/dbraw/zinc/14/22/75/1139142275.db2.gz AXAQCAYVNXTYNM-CQSZACIVSA-N 0 3 343.427 3.910 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@H](O)c2ccccc2C)cc1[N+](=O)[O-] ZINC000153749896 1139150962 /nfs/dbraw/zinc/15/09/62/1139150962.db2.gz GQFIYOVMVJDOFD-KDOFPFPSSA-N 0 3 344.411 3.686 20 5 EHBDHN C[C@@H](CN(C)Cc1ccc(Cl)c([N+](=O)[O-])c1)c1nccs1 ZINC000183969225 1140070387 /nfs/dbraw/zinc/07/03/87/1140070387.db2.gz MTEKMBKLVLBYKU-JTQLQIEISA-N 0 3 325.821 3.940 20 5 EHBDHN Cc1ccc([C@H](C)NCc2ccc(C(C)(C)O)cc2)cc1[N+](=O)[O-] ZINC000186617386 1140213800 /nfs/dbraw/zinc/21/38/00/1140213800.db2.gz OCXWBTMQYISGIV-AWEZNQCLSA-N 0 3 328.412 3.981 20 5 EHBDHN CC[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000271669382 1141415647 /nfs/dbraw/zinc/41/56/47/1141415647.db2.gz MSOSIWPZBKKUTA-INIZCTEOSA-N 0 3 327.384 3.583 20 5 EHBDHN CN(C/C=C/c1ccccc1[N+](=O)[O-])CCOCc1ccccc1 ZINC000535820336 1015016485 /nfs/dbraw/zinc/01/64/85/1015016485.db2.gz QEQGBOHBUQOJKT-YRNVUSSQSA-N 0 3 326.396 3.757 20 5 EHBDHN C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cn[nH]c1 ZINC000339791006 1015675474 /nfs/dbraw/zinc/67/54/74/1015675474.db2.gz FXBMHRQAXRQKDB-NSHDSACASA-N 0 3 328.397 3.897 20 5 EHBDHN CN(C)[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)c1ccsc1 ZINC000026720218 1032396319 /nfs/dbraw/zinc/39/63/19/1032396319.db2.gz OIEWVVZTFXLRCG-QGZVFWFLSA-N 0 3 342.424 3.919 20 5 EHBDHN CC[C@]1(CNCc2csc([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000573253471 1032604792 /nfs/dbraw/zinc/60/47/92/1032604792.db2.gz PAUMFAWSEIFHGA-QGZVFWFLSA-N 0 3 332.425 3.624 20 5 EHBDHN Cc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c(CN(C)C)c1 ZINC000134948792 1017733270 /nfs/dbraw/zinc/73/32/70/1017733270.db2.gz XMSSMWZBJATGFU-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)c1 ZINC000580676924 1019830437 /nfs/dbraw/zinc/83/04/37/1019830437.db2.gz FWWBKDXYKUMXIE-HYVNUMGLSA-N 0 3 346.333 3.624 20 5 EHBDHN CN(Cc1ccccc1[N+](=O)[O-])C[C@H]1CCN(c2ccccc2)C1 ZINC000602440625 1032890473 /nfs/dbraw/zinc/89/04/73/1032890473.db2.gz QNHYCXNBOCGUQN-MRXNPFEDSA-N 0 3 325.412 3.553 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN(C)[C@H](C)Cc1ccc(C)cc1 ZINC001167453972 1020659148 /nfs/dbraw/zinc/65/91/48/1020659148.db2.gz PKACUIPBTDIAQD-OAHLLOKOSA-N 0 3 328.412 3.975 20 5 EHBDHN C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000518562180 1021319991 /nfs/dbraw/zinc/31/99/91/1021319991.db2.gz BHSTZGIQJXBDNX-BLPFDFMYSA-N 0 3 344.436 3.670 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CCCN(C)c2ccccc21 ZINC000449654021 1032978946 /nfs/dbraw/zinc/97/89/46/1032978946.db2.gz UTHLDUFSPLXUGM-GOSISDBHSA-N 0 3 325.412 3.964 20 5 EHBDHN Cc1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507714656 1021467692 /nfs/dbraw/zinc/46/76/92/1021467692.db2.gz PEBGDKCOWBTJAN-QGZVFWFLSA-N 0 3 326.396 3.804 20 5 EHBDHN Cc1ccc(CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000602551050 1032985796 /nfs/dbraw/zinc/98/57/96/1032985796.db2.gz LKGRBWHNDVVEIK-UHFFFAOYSA-N 0 3 339.317 3.649 20 5 EHBDHN O=[N+]([O-])c1sc(CNCCC2(F)CCC2)cc1Br ZINC000602667858 1033066145 /nfs/dbraw/zinc/06/61/45/1033066145.db2.gz VBMJTTZSVJIMDB-UHFFFAOYSA-N 0 3 337.214 3.791 20 5 EHBDHN CC[C@](C)(O)CN(Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000439262692 1024066236 /nfs/dbraw/zinc/06/62/36/1024066236.db2.gz PSDDLPZWYRTDEL-IBGZPJMESA-N 0 3 328.412 3.758 20 5 EHBDHN CCCn1ccnc1CCCN(C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000277247228 1024326871 /nfs/dbraw/zinc/32/68/71/1024326871.db2.gz PYUYPHVJQZWDDH-OAHLLOKOSA-N 0 3 330.432 3.827 20 5 EHBDHN O=[N+]([O-])c1sc(CNC2(C3CC3)CCC2)cc1Br ZINC000895902380 1024959946 /nfs/dbraw/zinc/95/99/46/1024959946.db2.gz YEPMWABEAQQHJX-UHFFFAOYSA-N 0 3 331.235 3.841 20 5 EHBDHN CC[C@@H](N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000121056652 1025620891 /nfs/dbraw/zinc/62/08/91/1025620891.db2.gz BCTYOOSJPPJNRL-GOEBONIOSA-N 0 3 341.411 3.971 20 5 EHBDHN COCC1(CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCC1 ZINC000281926218 1025714888 /nfs/dbraw/zinc/71/48/88/1025714888.db2.gz HCPTYUCBINIRFA-UHFFFAOYSA-N 0 3 347.440 3.625 20 5 EHBDHN CCOc1cc(CN(C)CCc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000492460727 1026131704 /nfs/dbraw/zinc/13/17/04/1026131704.db2.gz JARZEHVSUUIYQT-UHFFFAOYSA-N 0 3 332.375 3.807 20 5 EHBDHN CCO[C@@H]1CCC[C@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000452015105 1026436574 /nfs/dbraw/zinc/43/65/74/1026436574.db2.gz JIWMFGYOIRWWJL-ZIAGYGMSSA-N 0 3 332.322 3.661 20 5 EHBDHN Cc1cccc([C@H](C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000452074972 1026464488 /nfs/dbraw/zinc/46/44/88/1026464488.db2.gz BKEKHZNAJPECQP-KBPBESRZSA-N 0 3 327.384 3.581 20 5 EHBDHN Cc1c(CN(C)[C@@H](C)[C@@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000441042873 1029660935 /nfs/dbraw/zinc/66/09/35/1029660935.db2.gz GECBPPXFLXQJQY-LIRRHRJNSA-N 0 3 326.396 3.727 20 5 EHBDHN CC[C@@H](O)CN(Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000441059129 1029719973 /nfs/dbraw/zinc/71/99/73/1029719973.db2.gz IJGYMGYUABMCMK-GOSISDBHSA-N 0 3 328.412 3.676 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000282059892 1029721467 /nfs/dbraw/zinc/72/14/67/1029721467.db2.gz MOUVGIPNKBJTIM-INIZCTEOSA-N 0 3 340.427 3.507 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@@H](OC)C(C)C)o2)c([N+](=O)[O-])c1 ZINC000525289940 1029781656 /nfs/dbraw/zinc/78/16/56/1029781656.db2.gz DVZDSHSEZPQLSY-GOSISDBHSA-N 0 3 348.399 3.624 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCCN(c2ccccc2)CC1 ZINC000441215842 1030009812 /nfs/dbraw/zinc/00/98/12/1030009812.db2.gz GBDNGXBYHKZIFV-MRXNPFEDSA-N 0 3 325.412 3.868 20 5 EHBDHN O=[N+]([O-])c1ccccc1C[C@H](NCc1cnc(C2CC2)o1)C1CC1 ZINC000453380190 1030202811 /nfs/dbraw/zinc/20/28/11/1030202811.db2.gz ZELNETKONSDMFI-INIZCTEOSA-N 0 3 327.384 3.571 20 5 EHBDHN C[C@@H](N[C@H](C)c1ccc(-n2ccnn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000159865495 1030395139 /nfs/dbraw/zinc/39/51/39/1030395139.db2.gz LXZZZZREEDBHIW-ZIAGYGMSSA-N 0 3 337.383 3.587 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000760189991 1031990363 /nfs/dbraw/zinc/99/03/63/1031990363.db2.gz SJGQMLSUEOABSP-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN CSCC(C)(C)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000898304309 1033445916 /nfs/dbraw/zinc/44/59/16/1033445916.db2.gz BSMIBPNGQHPRCX-UHFFFAOYSA-N 0 3 339.280 3.650 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@H]3COC(C)(C)C3)o2)c([N+](=O)[O-])c1 ZINC000594962798 1033603448 /nfs/dbraw/zinc/60/34/48/1033603448.db2.gz KGDNFEHEYRMVGY-GFCCVEGCSA-N 0 3 346.383 3.521 20 5 EHBDHN CCC(F)(F)C(C)(C)CNCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000599001366 1033634246 /nfs/dbraw/zinc/63/42/46/1033634246.db2.gz RZTZMAQXJGVUNO-UHFFFAOYSA-N 0 3 344.358 3.527 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CO[C@H](C4CC4)C3)o2)cc1 ZINC000599007611 1033640998 /nfs/dbraw/zinc/64/09/98/1033640998.db2.gz QPLRZCUXFOCPRO-KSSFIOAISA-N 0 3 328.368 3.512 20 5 EHBDHN CCO[C@H]1C[C@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000595071433 1033646330 /nfs/dbraw/zinc/64/63/30/1033646330.db2.gz ZBLQSUIHUACVBM-WDSOQIARSA-N 0 3 326.396 3.841 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H](C)c1ncc(C)s1 ZINC000595034327 1033656188 /nfs/dbraw/zinc/65/61/88/1033656188.db2.gz VGFYUMZYGMYGBS-ZYHUDNBSSA-N 0 3 335.429 3.823 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCc1ncc(C)cc1C ZINC000595046705 1033664796 /nfs/dbraw/zinc/66/47/96/1033664796.db2.gz NILCKYRHCIQSMM-CQSZACIVSA-N 0 3 329.400 3.509 20 5 EHBDHN Cc1csc([C@H](C)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000599046701 1033678359 /nfs/dbraw/zinc/67/83/59/1033678359.db2.gz KQQYNGHVANYEKC-NSHDSACASA-N 0 3 330.413 3.734 20 5 EHBDHN COc1cccc([C@@H](CN[C@@H](C)c2cccc([N+](=O)[O-])c2)OC)c1 ZINC000599060973 1033700740 /nfs/dbraw/zinc/70/07/40/1033700740.db2.gz ICONOWLMTAMBHD-SCLBCKFNSA-N 0 3 330.384 3.642 20 5 EHBDHN Cc1c(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000593013119 1033802666 /nfs/dbraw/zinc/80/26/66/1033802666.db2.gz CWLHBEJIAMLPKN-MNOVXSKESA-N 0 3 346.305 3.589 20 5 EHBDHN C[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CCc2ccccc21 ZINC000593094820 1033932625 /nfs/dbraw/zinc/93/26/25/1033932625.db2.gz IJGQHBOYITZDCI-CYBMUJFWSA-N 0 3 337.379 3.898 20 5 EHBDHN Cc1nccc([C@@H]2CCCN([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834321 1033959944 /nfs/dbraw/zinc/95/99/44/1033959944.db2.gz QNUWPUOEJHIVET-CZUORRHYSA-N 0 3 326.400 3.634 20 5 EHBDHN CCC(CC)CN(CC)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000603849850 1033973168 /nfs/dbraw/zinc/97/31/68/1033973168.db2.gz WPKXTOBAPKVGLJ-UHFFFAOYSA-N 0 3 332.404 3.903 20 5 EHBDHN Cc1ccc([C@@H](C)NCCC(=O)Nc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000411471834 1034892067 /nfs/dbraw/zinc/89/20/67/1034892067.db2.gz GCZRAAAREBTDJP-CYBMUJFWSA-N 0 3 345.374 3.722 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCCO[C@@H](c2ccccc2)C1 ZINC000612577378 1035072583 /nfs/dbraw/zinc/07/25/83/1035072583.db2.gz BZDOYKPCWPCTSW-LJQANCHMSA-N 0 3 326.396 3.867 20 5 EHBDHN CN1CC[C@@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000571573348 1035539375 /nfs/dbraw/zinc/53/93/75/1035539375.db2.gz RJBZRLUDQCVAFT-AEFFLSMTSA-N 0 3 345.830 3.783 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000056201739 1036140319 /nfs/dbraw/zinc/14/03/19/1036140319.db2.gz YEWDODNKXBSBLW-KGLIPLIRSA-N 0 3 327.384 3.581 20 5 EHBDHN CCC(CC)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000165334908 1036413867 /nfs/dbraw/zinc/41/38/67/1036413867.db2.gz CWEZICQQSDWWSA-UHFFFAOYSA-N 0 3 339.823 3.840 20 5 EHBDHN COC(=O)c1ccc([N+](=O)[O-])c(CN(C)C[C@H](C)c2ccccc2)c1 ZINC000589497026 1036438260 /nfs/dbraw/zinc/43/82/60/1036438260.db2.gz GUNLPVIMUAKAFK-AWEZNQCLSA-N 0 3 342.395 3.617 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)N2CC[C@@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000443651845 1036940541 /nfs/dbraw/zinc/94/05/41/1036940541.db2.gz JXVZIURJJKLCLL-IPYPFGDCSA-N 0 3 333.432 3.598 20 5 EHBDHN O=[N+]([O-])c1cccc(CN[C@@H]2CCC[C@@H]3C[C@@H]32)c1Br ZINC000694621365 1036968915 /nfs/dbraw/zinc/96/89/15/1036968915.db2.gz FIYYYVXASVXHOT-ADEWGFFLSA-N 0 3 325.206 3.636 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(Cc3n[nH]c4ccccc43)C2)cc1 ZINC000590659590 1036996005 /nfs/dbraw/zinc/99/60/05/1036996005.db2.gz QWZVOJQKOKWIPB-OAHLLOKOSA-N 0 3 336.395 3.851 20 5 EHBDHN Cc1c(CN[C@H](C)c2cccc(-n3ccnc3)c2)cccc1[N+](=O)[O-] ZINC000180645858 1037034649 /nfs/dbraw/zinc/03/46/49/1037034649.db2.gz HHVWGSZXOVECPZ-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN C[C@H](NCc1cn(C)nc1-c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000181033619 1037400671 /nfs/dbraw/zinc/40/06/71/1037400671.db2.gz ULLBQGQGAUAUTG-AWEZNQCLSA-N 0 3 336.395 3.846 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000532470207 1037413907 /nfs/dbraw/zinc/41/39/07/1037413907.db2.gz CFUNJGIUYAJXOM-XCRHUMRWSA-N 0 3 345.443 3.742 20 5 EHBDHN O=C(CN[C@@H](c1ccccc1)C1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC000104701884 1038489320 /nfs/dbraw/zinc/48/93/20/1038489320.db2.gz NEAYWTWCQRIPSG-IBGZPJMESA-N 0 3 339.395 3.664 20 5 EHBDHN O=[N+]([O-])c1cccc(CNC[C@H](O)c2ccc(Cl)cc2Cl)c1 ZINC000111394796 1039728810 /nfs/dbraw/zinc/72/88/10/1039728810.db2.gz PZBJLLVHAIIACN-HNNXBMFYSA-N 0 3 341.194 3.725 20 5 EHBDHN COc1c([O-])ccc(C[NH2+][C@@H](C)CCCC(F)(F)F)c1[N+](=O)[O-] ZINC000894028787 1039995862 /nfs/dbraw/zinc/99/58/62/1039995862.db2.gz JHLBJNPGJSLHEY-VIFPVBQESA-N 0 3 336.310 3.520 20 5 EHBDHN C[C@H](N[C@H]1CC2CCC1CC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000433062301 1040583982 /nfs/dbraw/zinc/58/39/82/1040583982.db2.gz SUIZOFDZNNGMAK-ITDKRANNSA-N 0 3 342.399 3.874 20 5 EHBDHN C[C@@H](NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccn1 ZINC000181771141 1042082420 /nfs/dbraw/zinc/08/24/20/1042082420.db2.gz BVVWNHMFLIEBCQ-CYBMUJFWSA-N 0 3 338.367 3.538 20 5 EHBDHN Cc1csc([C@H](C)CNCc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000893563026 1042662576 /nfs/dbraw/zinc/66/25/76/1042662576.db2.gz HNNRSGPMAUBIJS-SECBINFHSA-N 0 3 325.821 3.906 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(NCCN3CCSCC3)cc2)cc1 ZINC001167836732 1043043014 /nfs/dbraw/zinc/04/30/14/1043043014.db2.gz FTLRLKMTYQEXRE-UHFFFAOYSA-N 0 3 343.452 3.723 20 5 EHBDHN CC(C)CCN(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CC1 ZINC000728896180 1043523201 /nfs/dbraw/zinc/52/32/01/1043523201.db2.gz FBEFKDARYBEEGE-UHFFFAOYSA-N 0 3 328.416 3.926 20 5 EHBDHN CC[C@@H]1CCC[C@@H]1N[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000279239365 1043639550 /nfs/dbraw/zinc/63/95/50/1043639550.db2.gz JWOLGSLRJKRMCZ-ZOWXZIJZSA-N 0 3 330.388 3.874 20 5 EHBDHN COCC[C@H](Cc1ccco1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000344321934 1043662478 /nfs/dbraw/zinc/66/24/78/1043662478.db2.gz GDSISAWILKIQDB-CYBMUJFWSA-N 0 3 338.791 3.579 20 5 EHBDHN O=[N+]([O-])c1cccc(CNC[C@H](c2ccco2)N2CCCCC2)c1 ZINC000072726067 1126867811 /nfs/dbraw/zinc/86/78/11/1126867811.db2.gz GGJZMWXXDLVTLV-QGZVFWFLSA-N 0 3 329.400 3.505 20 5 EHBDHN Cc1nn(CN(C)CCCc2ccccc2)c2ccc([N+](=O)[O-])cc12 ZINC000764888595 1127545932 /nfs/dbraw/zinc/54/59/32/1127545932.db2.gz HFIMVEWUAQMVHU-UHFFFAOYSA-N 0 3 338.411 3.775 20 5 EHBDHN CN1CCC[C@H](CNc2ncccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301443287 1128077062 /nfs/dbraw/zinc/07/70/62/1128077062.db2.gz VAJAUWOWVMEJHE-DOMZBBRYSA-N 0 3 332.429 3.546 20 5 EHBDHN Cc1cc([N+](=O)[O-])cnc1NC[C@H](c1ccc(Cl)cc1)N(C)C ZINC000301477348 1128468225 /nfs/dbraw/zinc/46/82/25/1128468225.db2.gz PFICKRBIHJXWEU-OAHLLOKOSA-N 0 3 334.807 3.666 20 5 EHBDHN COc1cccc([C@H](CNc2cc(C)ccc2[N+](=O)[O-])N(C)C)c1 ZINC000301586502 1128499549 /nfs/dbraw/zinc/49/95/49/1128499549.db2.gz VSNUGEPOUQCGCV-SFHVURJKSA-N 0 3 329.400 3.627 20 5 EHBDHN CCCN(CCN1CCCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000554050129 1128605908 /nfs/dbraw/zinc/60/59/08/1128605908.db2.gz FRMGKSRJQGFETI-UHFFFAOYSA-N 0 3 348.447 3.633 20 5 EHBDHN CC(C)N(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1CCC1 ZINC000193207787 1120983338 /nfs/dbraw/zinc/98/33/38/1120983338.db2.gz AUWFFLQFAUWMFL-UHFFFAOYSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H]1CC2(CCC2)CN1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000762138263 1121125941 /nfs/dbraw/zinc/12/59/41/1121125941.db2.gz LECXIYFIUCFQEN-AWEZNQCLSA-N 0 3 326.400 3.680 20 5 EHBDHN CCN1CCN(c2ccc(Nc3ccc([N+](=O)[O-])cc3F)cc2)CC1 ZINC000915212298 1121248983 /nfs/dbraw/zinc/24/89/83/1121248983.db2.gz ONSVOGSSKKBNFR-UHFFFAOYSA-N 0 3 344.390 3.619 20 5 EHBDHN Cc1csc(CCNc2cc(C)nc3ccc([N+](=O)[O-])cc32)n1 ZINC000322376026 1121645441 /nfs/dbraw/zinc/64/54/41/1121645441.db2.gz KMQHMJXOEOMWTA-UHFFFAOYSA-N 0 3 328.397 3.871 20 5 EHBDHN O=[N+]([O-])c1ccccc1CNCCCOc1cccc2cccnc21 ZINC000113342965 1129003057 /nfs/dbraw/zinc/00/30/57/1129003057.db2.gz PHNAMTDRYSDCIY-UHFFFAOYSA-N 0 3 337.379 3.702 20 5 EHBDHN COc1cccc(C[C@@H]2CCCN2Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000917087090 1122490979 /nfs/dbraw/zinc/49/09/79/1122490979.db2.gz QDNOISIUONMIMZ-KRWDZBQOSA-N 0 3 344.386 3.950 20 5 EHBDHN Cc1cccc(NC(=O)C[C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000556162142 1122849122 /nfs/dbraw/zinc/84/91/22/1122849122.db2.gz IOYLJKHELNBHNU-CABCVRRESA-N 0 3 341.411 3.971 20 5 EHBDHN CN(C)[C@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000301794644 1129084142 /nfs/dbraw/zinc/08/41/42/1129084142.db2.gz PWNPQHPBVMUTAL-OAHLLOKOSA-N 0 3 339.317 3.727 20 5 EHBDHN C[C@@H](CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000735077182 1131307143 /nfs/dbraw/zinc/30/71/43/1131307143.db2.gz GZNGZIZNYXLWQS-INIZCTEOSA-N 0 3 325.412 3.521 20 5 EHBDHN Cc1cc(NCCCOCC(F)(F)F)c2cc([N+](=O)[O-])ccc2n1 ZINC000181455418 1124854449 /nfs/dbraw/zinc/85/44/49/1124854449.db2.gz YKOHHXHZGDULQA-UHFFFAOYSA-N 0 3 343.305 3.832 20 5 EHBDHN C[C@@]1(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO[C@H]1C1CC1 ZINC000543242306 1129365787 /nfs/dbraw/zinc/36/57/87/1129365787.db2.gz JYRCIKWWZPTKFE-RBUKOAKNSA-N 0 3 342.395 3.902 20 5 EHBDHN C[C@@H](NCc1ccc(O[C@@H]2CCOC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000922540143 1129568247 /nfs/dbraw/zinc/56/82/47/1129568247.db2.gz GTRFHDNWSGEFDH-AUUYWEPGSA-N 0 3 342.395 3.613 20 5 EHBDHN CCC1(CO)CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000093591941 1129595166 /nfs/dbraw/zinc/59/51/66/1129595166.db2.gz YZVRXYPMPYJHPE-UHFFFAOYSA-N 0 3 344.411 3.839 20 5 EHBDHN CN(CCn1cccn1)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000125279316 1129676241 /nfs/dbraw/zinc/67/62/41/1129676241.db2.gz VLRWAAOWJNATJB-UHFFFAOYSA-N 0 3 342.424 3.652 20 5 EHBDHN CCCN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000021819960 1129736019 /nfs/dbraw/zinc/73/60/19/1129736019.db2.gz DDUONRJPJUFCCH-MRXNPFEDSA-N 0 3 347.802 3.928 20 5 EHBDHN Cc1cc(NC[C@H]2CSCCS2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302078303 1129766570 /nfs/dbraw/zinc/76/65/70/1129766570.db2.gz KGDBNUGCNYYVOW-LBPRGKRZSA-N 0 3 335.454 3.712 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1N[C@H]1CCN(Cc2ccccc2)C1 ZINC000302755985 1129789867 /nfs/dbraw/zinc/78/98/67/1129789867.db2.gz GDPGUKBJAMHOOU-HNNXBMFYSA-N 0 3 331.803 3.935 20 5 EHBDHN Cc1cc(NCC2(c3ccccn3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302852172 1129795315 /nfs/dbraw/zinc/79/53/15/1129795315.db2.gz JHQSKFRUYFXLPD-UHFFFAOYSA-N 0 3 334.379 3.990 20 5 EHBDHN CC[C@H](N[C@H](C)CNC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000305881270 1129929985 /nfs/dbraw/zinc/92/99/85/1129929985.db2.gz BDWYJZWJJGBRCF-DOMZBBRYSA-N 0 3 337.420 3.549 20 5 EHBDHN C[C@H](CN(C)C(=O)OC(C)(C)C)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000701880043 1130178007 /nfs/dbraw/zinc/17/80/07/1130178007.db2.gz UYPJRTDGDDNNFP-OLZOCXBDSA-N 0 3 337.420 3.501 20 5 EHBDHN CC[C@@H](C)[C@H]1CCCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057474 1131461767 /nfs/dbraw/zinc/46/17/67/1131461767.db2.gz RJVNCKDXBOWOOH-RHSMWYFYSA-N 0 3 343.431 3.711 20 5 EHBDHN CC[C@H]1CCCN(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000738253924 1131464634 /nfs/dbraw/zinc/46/46/34/1131464634.db2.gz JGKOCTGGKYHMCV-HNNXBMFYSA-N 0 3 328.416 3.928 20 5 EHBDHN NCc1nn([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c2ccccc12 ZINC001172902124 1131885495 /nfs/dbraw/zinc/88/54/95/1131885495.db2.gz VQIHHMQTEXPCLE-HNNXBMFYSA-N 0 3 336.395 3.523 20 5 EHBDHN COc1cc(F)c(CN[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC001173216377 1132001798 /nfs/dbraw/zinc/00/17/98/1132001798.db2.gz IYUBHZIPYCHNAE-LLVKDONJSA-N 0 3 336.338 3.602 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(C)C[C@H]1c1ccccc1 ZINC001173223477 1132004967 /nfs/dbraw/zinc/00/49/67/1132004967.db2.gz ANFJYUGABFRLNS-JXFKEZNVSA-N 0 3 339.439 3.515 20 5 EHBDHN CC(C)C[C@@H](N)c1nc2ccccc2n1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168990236 1132634876 /nfs/dbraw/zinc/63/48/76/1132634876.db2.gz YUOIIIBSAMEHOZ-RBSFLKMASA-N 0 3 330.432 3.700 20 5 EHBDHN O=[N+]([O-])c1cc2c(cc1NCc1c(Cl)cncc1Cl)CNC2 ZINC001169186317 1132686997 /nfs/dbraw/zinc/68/69/97/1132686997.db2.gz XRJSFESDTMLEHC-UHFFFAOYSA-N 0 3 339.182 3.512 20 5 EHBDHN CN(CCc1ccc2c(c1)OCO2)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001176184241 1132859011 /nfs/dbraw/zinc/85/90/11/1132859011.db2.gz HIRORSRPHMCHFQ-UHFFFAOYSA-N 0 3 348.786 3.651 20 5 EHBDHN C[C@@H]1CCc2nc(CNCCc3ccccc3[N+](=O)[O-])sc2C1 ZINC001178609604 1133185534 /nfs/dbraw/zinc/18/55/34/1133185534.db2.gz IMMNCLDZLQESON-GFCCVEGCSA-N 0 3 331.441 3.508 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1cccc2c1OCCO2 ZINC000786815415 1133910329 /nfs/dbraw/zinc/91/03/29/1133910329.db2.gz SJQMVCNKDDOMBM-GXDHUFHOSA-N 0 3 340.379 3.559 20 5 EHBDHN COc1ccccc1C[C@@H]1CCCN1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746707730 1134038322 /nfs/dbraw/zinc/03/83/22/1134038322.db2.gz NMUMDBXPINZIEH-KRWDZBQOSA-N 0 3 344.386 3.950 20 5 EHBDHN CC[C@@H](C)N1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC001170316299 1134745451 /nfs/dbraw/zinc/74/54/51/1134745451.db2.gz WGMSFYCLZNMNMT-GFCCVEGCSA-N 0 3 345.365 3.530 20 5 EHBDHN CC1(C)CCC[C@@](CO)(NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001196219484 1135534069 /nfs/dbraw/zinc/53/40/69/1135534069.db2.gz YQBZILIHYXLWTF-MRXNPFEDSA-N 0 3 326.824 3.669 20 5 EHBDHN CCc1ccc([C@H](O)CNCc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809689231 1135871789 /nfs/dbraw/zinc/87/17/89/1135871789.db2.gz LGLGQEMGSLVEOT-QGZVFWFLSA-N 0 3 334.803 3.634 20 5 EHBDHN C[C@@H]1CCCCN1CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473614 1136095703 /nfs/dbraw/zinc/09/57/03/1136095703.db2.gz FMLBPMLWTSDUBB-LLVKDONJSA-N 0 3 346.258 3.866 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H]1CCCC[C@H]1O ZINC000811480848 1136097681 /nfs/dbraw/zinc/09/76/81/1136097681.db2.gz IBKAHRZSDRZNSD-TVQRCGJNSA-N 0 3 333.215 3.542 20 5 EHBDHN CO[C@](C)(CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000812772950 1136244936 /nfs/dbraw/zinc/24/49/36/1136244936.db2.gz SXDZGPROOBCXOI-CQSZACIVSA-N 0 3 333.215 3.806 20 5 EHBDHN CC(COC(=O)c1ccc(-c2ccc(Cl)cc2)s1)[N+](=O)[O-] ZINC000813108408 1136294243 /nfs/dbraw/zinc/29/42/43/1136294243.db2.gz YAHNLQLGONCQGD-SECBINFHSA-N 0 3 325.773 3.891 20 5 EHBDHN CC(COC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)[N+](=O)[O-] ZINC000813107496 1136294270 /nfs/dbraw/zinc/29/42/70/1136294270.db2.gz RAKQLSKBHSHXOA-ZECSTPGPSA-N 0 3 335.356 3.636 20 5 EHBDHN CC(C)[C@@H](NCc1ccc(F)cc1[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000852034815 1136428450 /nfs/dbraw/zinc/42/84/50/1136428450.db2.gz JFHDHUVTBJXUFX-MSOLQXFVSA-N 0 3 332.375 3.582 20 5 EHBDHN CC(C)N(Cc1ccccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580029 1136444546 /nfs/dbraw/zinc/44/45/46/1136444546.db2.gz QPEQVZPXECSFCO-SFHVURJKSA-N 0 3 332.375 3.678 20 5 EHBDHN C[C@@H](NCc1cc2c(s1)CCCC2)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815570302 1136617451 /nfs/dbraw/zinc/61/74/51/1136617451.db2.gz YPMHLHKKHDMPEA-LLVKDONJSA-N 0 3 331.441 3.968 20 5 EHBDHN CC(C)C[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000776948689 1136883706 /nfs/dbraw/zinc/88/37/06/1136883706.db2.gz GMRINRDAIPFDSG-HIFRSBDPSA-N 0 3 326.824 3.932 20 5 EHBDHN CC([C@@H](OC(=O)CCCC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845872954 1137316135 /nfs/dbraw/zinc/31/61/35/1137316135.db2.gz AYGJOZCIBRRYQN-NOZJJQNGSA-N 0 3 337.269 3.808 20 5 EHBDHN Cc1ccc(CCC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845873385 1137316272 /nfs/dbraw/zinc/31/62/72/1137316272.db2.gz CXMUUOIHUXHXRM-PXAZEXFGSA-N 0 3 335.331 3.609 20 5 EHBDHN CC([C@H](OC(=O)[C@H](C)CC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845883763 1137317114 /nfs/dbraw/zinc/31/71/14/1137317114.db2.gz VUFKYQPCMOTCJO-PTRXPTGYSA-N 0 3 337.269 3.664 20 5 EHBDHN CC([C@H](OC(=O)[C@@H]1C[C@H]1c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882205 1137317190 /nfs/dbraw/zinc/31/71/90/1137317190.db2.gz NWJZSXCVXTXKJA-PTOXDTDZSA-N 0 3 343.354 3.879 20 5 EHBDHN CC(=O)Nc1ccc([C@@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000866541077 1137363113 /nfs/dbraw/zinc/36/31/13/1137363113.db2.gz VVOXQYOJJOEOFA-CYBMUJFWSA-N 0 3 327.384 3.712 20 5 EHBDHN C[C@H](NCCCCNc1ccccn1)c1c(F)cccc1[N+](=O)[O-] ZINC000872032434 1137566579 /nfs/dbraw/zinc/56/65/79/1137566579.db2.gz TZSFDNOULYBPDG-ZDUSSCGKSA-N 0 3 332.379 3.672 20 5 EHBDHN C[C@@H](NC[C@H](C[C@H](C)O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872043223 1137567357 /nfs/dbraw/zinc/56/73/57/1137567357.db2.gz HPAYUNWATDAJJP-LZWOXQAQSA-N 0 3 346.402 3.939 20 5 EHBDHN CC1(C)C[C@@H](NCc2cc(N)cc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000873288603 1137596513 /nfs/dbraw/zinc/59/65/13/1137596513.db2.gz JHBSDZJMMHPILD-QGZVFWFLSA-N 0 3 329.375 3.828 20 5 EHBDHN CC(C)c1cc([C@H]2CCCN(Cc3ccccc3[N+](=O)[O-])C2)[nH]n1 ZINC000877783877 1137689487 /nfs/dbraw/zinc/68/94/87/1137689487.db2.gz JIAWHZLGUSCPCL-AWEZNQCLSA-N 0 3 328.416 3.821 20 5 EHBDHN CC(C)c1cc([C@H]2CCCN(Cc3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC000877783877 1137689488 /nfs/dbraw/zinc/68/94/88/1137689488.db2.gz JIAWHZLGUSCPCL-AWEZNQCLSA-N 0 3 328.416 3.821 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000079324882 1138155155 /nfs/dbraw/zinc/15/51/55/1138155155.db2.gz MBNRSNNKAQZDDM-KGLIPLIRSA-N 0 3 327.384 3.581 20 5 EHBDHN CCOc1ccc([C@@H](C)NCc2ccc(COC)cc2)cc1[N+](=O)[O-] ZINC000152735786 1139106796 /nfs/dbraw/zinc/10/67/96/1139106796.db2.gz STVINMOGGWVGAB-CQSZACIVSA-N 0 3 344.411 3.991 20 5 EHBDHN Cc1c([C@H](C)NC[C@@H]2COC3(CCC(C)CC3)O2)cccc1[N+](=O)[O-] ZINC000777311271 1139566734 /nfs/dbraw/zinc/56/67/34/1139566734.db2.gz AYOJDMNMENZCKH-QHZMEWJKSA-N 0 3 348.443 3.876 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000177317385 1139611929 /nfs/dbraw/zinc/61/19/29/1139611929.db2.gz LVFHQFVWKVEHHC-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN CC[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000179627607 1139769396 /nfs/dbraw/zinc/76/93/96/1139769396.db2.gz QCOJKNZTCZWMNS-SJORKVTESA-N 0 3 336.338 3.647 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000270399727 1141218055 /nfs/dbraw/zinc/21/80/55/1141218055.db2.gz VTIRCFZBPHNVRP-UHFFFAOYSA-N 0 3 341.411 3.536 20 5 EHBDHN CC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000271669385 1141415360 /nfs/dbraw/zinc/41/53/60/1141415360.db2.gz MSOSIWPZBKKUTA-MRXNPFEDSA-N 0 3 327.384 3.583 20 5 EHBDHN CNC(=O)CC[C@H]1CCCCN1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000348836522 1141592746 /nfs/dbraw/zinc/59/27/46/1141592746.db2.gz CTTFELHQISFOJS-MRXNPFEDSA-N 0 3 347.459 3.599 20 5 EHBDHN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384731 1016122009 /nfs/dbraw/zinc/12/20/09/1016122009.db2.gz KDLXXJFYCIOTSV-LFPIHBKWSA-N 0 3 346.452 3.568 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC(c2ccncn2)CC1 ZINC000414473817 1016768440 /nfs/dbraw/zinc/76/84/40/1016768440.db2.gz WJACBSLIIBQEOG-PTNGSMBKSA-N 0 3 338.411 3.668 20 5 EHBDHN Cc1c([C@H](C)N[C@@H](CN(C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368979 1032251821 /nfs/dbraw/zinc/25/18/21/1032251821.db2.gz PVQVZKDNOAOGGV-KSSFIOAISA-N 0 3 345.418 3.996 20 5 EHBDHN CCC[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCC1 ZINC000459803688 1032482599 /nfs/dbraw/zinc/48/25/99/1032482599.db2.gz NXAGBNWPQCQUQR-HNNXBMFYSA-N 0 3 330.388 3.703 20 5 EHBDHN COc1c(O)cccc1CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449500151 1032678264 /nfs/dbraw/zinc/67/82/64/1032678264.db2.gz NKLYPTNCHVCFLC-OAHLLOKOSA-N 0 3 342.395 3.689 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1 ZINC000118837576 1017627802 /nfs/dbraw/zinc/62/78/02/1017627802.db2.gz QBYGMVSTOJODBN-UHFFFAOYSA-N 0 3 336.395 3.851 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000177346746 1017649254 /nfs/dbraw/zinc/64/92/54/1017649254.db2.gz ZIEXWGQQUGEBKB-DHZHZOJOSA-N 0 3 339.395 3.617 20 5 EHBDHN Cc1c(CN2CCC(c3ccc(O)cc3)CC2)cccc1[N+](=O)[O-] ZINC000052467497 1018960598 /nfs/dbraw/zinc/96/05/98/1018960598.db2.gz RFKRXEYHGFBMGW-UHFFFAOYSA-N 0 3 326.396 3.988 20 5 EHBDHN CC[C@](C)(O)CN(Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000439261148 1021284898 /nfs/dbraw/zinc/28/48/98/1021284898.db2.gz QKVDIVRMHFPURT-IBGZPJMESA-N 0 3 328.412 3.758 20 5 EHBDHN O=[N+]([O-])c1ccc(C(F)(F)F)c(CNC2([C@H]3CCCCO3)CC2)c1 ZINC000933375687 1021561023 /nfs/dbraw/zinc/56/10/23/1021561023.db2.gz MFSLYEWPJOWNCD-CQSZACIVSA-N 0 3 344.333 3.805 20 5 EHBDHN CO[C@H]1CCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602601391 1032995167 /nfs/dbraw/zinc/99/51/67/1032995167.db2.gz KSACGIJXUOUYTI-ZDUSSCGKSA-N 0 3 332.322 3.615 20 5 EHBDHN C[C@H](NC[C@@H](c1c(F)cccc1F)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000120776994 1022147623 /nfs/dbraw/zinc/14/76/23/1022147623.db2.gz WGQQNTBSFAUFHA-SJCJKPOMSA-N 0 3 349.381 3.827 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nc(CN3CC[C@H](CC4CC4)C3)co2)cc1 ZINC000550405561 1022813564 /nfs/dbraw/zinc/81/35/64/1022813564.db2.gz UDYKVXZHCNIJSD-CQSZACIVSA-N 0 3 327.384 3.872 20 5 EHBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCCO1 ZINC000506438193 1023140196 /nfs/dbraw/zinc/14/01/96/1023140196.db2.gz HAWNXVDHYGHUJC-OAHLLOKOSA-N 0 3 332.425 3.934 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNCC3([C@@H]4CCCCO4)CCC3)nc2c1 ZINC000602744184 1033111004 /nfs/dbraw/zinc/11/10/04/1033111004.db2.gz YYFKXTMTVCPDDH-INIZCTEOSA-N 0 3 345.399 3.565 20 5 EHBDHN CCOC(=O)C(C)(C)C1CCN([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000510967794 1023540949 /nfs/dbraw/zinc/54/09/49/1023540949.db2.gz MAQYVKWTHCGQCF-AWEZNQCLSA-N 0 3 348.443 3.957 20 5 EHBDHN C[C@@H](CN1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 ZINC000522664118 1024157600 /nfs/dbraw/zinc/15/76/00/1024157600.db2.gz JHMUDXNISKBJAE-INIZCTEOSA-N 0 3 325.412 3.521 20 5 EHBDHN CC(C)[C@@H](O)C1(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000538488154 1024397133 /nfs/dbraw/zinc/39/71/33/1024397133.db2.gz RJSDUQXHEYPKQK-GOSISDBHSA-N 0 3 344.411 3.742 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC34CC(O)C4)o2)c(Cl)c1 ZINC000897851104 1033210295 /nfs/dbraw/zinc/21/02/95/1033210295.db2.gz PHJMXVIIMUZYEX-PCHQZIJMSA-N 0 3 348.786 3.511 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@H](c2nccs2)C1 ZINC000895581233 1024638296 /nfs/dbraw/zinc/63/82/96/1024638296.db2.gz MNEWZKZQSMPCEW-CTXBLAANSA-N 0 3 329.425 3.944 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CN[C@@H]3C[C@@H]4CCC[C@H]34)cs2)c1 ZINC000897952466 1033259573 /nfs/dbraw/zinc/25/95/73/1033259573.db2.gz GRIRILLYCPDBSO-KNXALSJPSA-N 0 3 329.425 3.997 20 5 EHBDHN COC1CCC(N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000265216815 1025133573 /nfs/dbraw/zinc/13/35/73/1025133573.db2.gz NLKVEYJLYLOVEX-UHFFFAOYSA-N 0 3 336.432 3.771 20 5 EHBDHN C[C@@H]1CCC[C@@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467874 1025467182 /nfs/dbraw/zinc/46/71/82/1025467182.db2.gz OHVOOXVKXRUJFQ-VXGBXAGGSA-N 0 3 339.823 3.697 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(CN2CC[C@@H]3CCC[C@@H]32)o1 ZINC000934338649 1025527394 /nfs/dbraw/zinc/52/73/94/1025527394.db2.gz DRCQEDKJOUAMPP-GWCFXTLKSA-N 0 3 348.790 3.673 20 5 EHBDHN CCc1nc(C)c(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451543465 1026090716 /nfs/dbraw/zinc/09/07/16/1026090716.db2.gz BWBWRMHGOSQJMI-OAHLLOKOSA-N 0 3 329.400 3.833 20 5 EHBDHN CC(C)c1ccc(CN(CCn2ccc([N+](=O)[O-])n2)C2CC2)cc1 ZINC000478430602 1026116116 /nfs/dbraw/zinc/11/61/16/1026116116.db2.gz GZBHKSIWFOPJCM-UHFFFAOYSA-N 0 3 328.416 3.579 20 5 EHBDHN COCCOc1ccc([C@H](C)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000478492542 1026125986 /nfs/dbraw/zinc/12/59/86/1026125986.db2.gz NZVFPWOJHFVHDN-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN[C@H]3CCSC4(CCC4)C3)nc2c1 ZINC000896951495 1026150236 /nfs/dbraw/zinc/15/02/36/1026150236.db2.gz PJNPHFFJKNAOHE-NSHDSACASA-N 0 3 333.413 3.644 20 5 EHBDHN Cc1ccc(C(=O)CCN(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000583191915 1029178506 /nfs/dbraw/zinc/17/85/06/1029178506.db2.gz NKBMFJHRLYUCIX-UHFFFAOYSA-N 0 3 326.396 3.651 20 5 EHBDHN CC[C@@H](C)N[C@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000343248212 1029883549 /nfs/dbraw/zinc/88/35/49/1029883549.db2.gz IVWJELPYHMRMLP-MLGOLLRUSA-N 0 3 345.399 3.932 20 5 EHBDHN CC[C@H](C)N[C@@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000343248211 1029883878 /nfs/dbraw/zinc/88/38/78/1029883878.db2.gz IVWJELPYHMRMLP-LRDDRELGSA-N 0 3 345.399 3.932 20 5 EHBDHN CN(C)C[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000583574592 1030168877 /nfs/dbraw/zinc/16/88/77/1030168877.db2.gz DPBUGARPYHYUIA-ZWKOTPCHSA-N 0 3 343.402 3.614 20 5 EHBDHN CC(C)c1ccc(CN[C@@H]2CCO[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000343409857 1030741114 /nfs/dbraw/zinc/74/11/14/1030741114.db2.gz SVSCQPVYFFNTKP-MJGOQNOKSA-N 0 3 341.411 3.733 20 5 EHBDHN CCOc1ccc([C@@H](C)NCc2ccc([C@H](C)O)cc2)cc1[N+](=O)[O-] ZINC000179406810 1030826233 /nfs/dbraw/zinc/82/62/33/1030826233.db2.gz LUEIYBIKKWIFHM-KGLIPLIRSA-N 0 3 344.411 3.898 20 5 EHBDHN C[C@H](NC[C@@H]1CCC[C@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC000926916526 1031275003 /nfs/dbraw/zinc/27/50/03/1031275003.db2.gz QDUBSAUDZWPPOT-COPLHBTASA-N 0 3 332.322 3.745 20 5 EHBDHN COc1cccc([C@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000059372105 1033588982 /nfs/dbraw/zinc/58/89/82/1033588982.db2.gz PVBGRNJSXJXQEA-QGZVFWFLSA-N 0 3 342.395 3.819 20 5 EHBDHN CCSC1(CNCc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000594987126 1033621413 /nfs/dbraw/zinc/62/14/13/1033621413.db2.gz SLACPYPYTHAGJQ-UHFFFAOYSA-N 0 3 332.372 3.572 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]23)c(Cl)c1 ZINC000594996625 1033624204 /nfs/dbraw/zinc/62/42/04/1033624204.db2.gz UIAFHETXJPGVEM-USXIJHARSA-N 0 3 332.762 3.815 20 5 EHBDHN COc1ccc([C@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])C2CC2)cn1 ZINC000599095556 1033731744 /nfs/dbraw/zinc/73/17/44/1033731744.db2.gz GXGZCFZBSHKVNZ-VQIMIIECSA-N 0 3 339.395 3.727 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN[C@H](Cc3ccccc3)C3CC3)nc2c1 ZINC000612465510 1034962995 /nfs/dbraw/zinc/96/29/95/1034962995.db2.gz MNTSUPUHBSTKBR-MRXNPFEDSA-N 0 3 337.379 3.847 20 5 EHBDHN O=[N+]([O-])c1ccn(CCN2CCCCC[C@@H]2/C=C\c2cccs2)n1 ZINC000542131643 1035075928 /nfs/dbraw/zinc/07/59/28/1035075928.db2.gz NKZDUSHJMZKCTR-ZPIQOJFGSA-N 0 3 346.456 3.811 20 5 EHBDHN CCO[C@H]1C[C@@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000414153274 1035802999 /nfs/dbraw/zinc/80/29/99/1035802999.db2.gz ZBLQSUIHUACVBM-UHOSZYNNSA-N 0 3 326.396 3.841 20 5 EHBDHN NCc1nn(-c2cc3cccnc3c3ncccc23)c2ccccc12 ZINC001167698087 1036886581 /nfs/dbraw/zinc/88/65/81/1036886581.db2.gz MBLRMILKIZUCQY-UHFFFAOYSA-N 0 3 325.375 3.581 20 5 EHBDHN C[C@@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)Oc1ccccc1F ZINC000761526610 1037100537 /nfs/dbraw/zinc/10/05/37/1037100537.db2.gz PCCWADCHRHTIQH-NSHDSACASA-N 0 3 338.766 3.944 20 5 EHBDHN CC[C@H](O)CN(C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850727 1037281246 /nfs/dbraw/zinc/28/12/46/1037281246.db2.gz OVBWTWHPUMFJCJ-ICEKFOEVSA-N 0 3 340.423 3.881 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1C[C@@H](OCC)C12CCCC2 ZINC000462756707 1037371690 /nfs/dbraw/zinc/37/16/90/1037371690.db2.gz OXUOOZRISIISOS-QZTJIDSGSA-N 0 3 348.443 3.821 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@H]2CCc3c2c(F)ccc3F)cc1 ZINC000540183208 1037666787 /nfs/dbraw/zinc/66/67/87/1037666787.db2.gz YTURRHSWQGGEBX-INIZCTEOSA-N 0 3 334.322 3.529 20 5 EHBDHN CC[C@H](O)CCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494004001 1037768389 /nfs/dbraw/zinc/76/83/89/1037768389.db2.gz NJAOAEYCPAZWEV-RBUKOAKNSA-N 0 3 328.412 3.825 20 5 EHBDHN CO[C@@H]1CCC[C@@H]1CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000540328652 1037828042 /nfs/dbraw/zinc/82/80/42/1037828042.db2.gz OWBCTZQYDFUUMM-CZUORRHYSA-N 0 3 347.440 3.623 20 5 EHBDHN COc1ccc(CN[C@@]2(C)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000538707803 1038483512 /nfs/dbraw/zinc/48/35/12/1038483512.db2.gz ZHBCCTQTSQUUEQ-IBGZPJMESA-N 0 3 326.396 3.945 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@H]2SCCc3ccccc32)c(F)c1 ZINC000478246056 1039319375 /nfs/dbraw/zinc/31/93/75/1039319375.db2.gz BCWSLXDAGHUURG-QGZVFWFLSA-N 0 3 332.400 3.854 20 5 EHBDHN Cc1c(CNCc2ccc(OCC3CC3)cc2)cccc1[N+](=O)[O-] ZINC000480483655 1039588267 /nfs/dbraw/zinc/58/82/67/1039588267.db2.gz WRPCAONKEWAXHJ-UHFFFAOYSA-N 0 3 326.396 3.982 20 5 EHBDHN CN(C)c1ccc(CN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)cn1 ZINC000417309898 1039664134 /nfs/dbraw/zinc/66/41/34/1039664134.db2.gz GMMTXTPSLHTSBR-GOSISDBHSA-N 0 3 340.427 3.613 20 5 EHBDHN C[C@H]1CC(C)(C)CC[C@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000481111348 1040354966 /nfs/dbraw/zinc/35/49/66/1040354966.db2.gz OUIJSUANTCOZSD-SWLSCSKDSA-N 0 3 344.415 3.949 20 5 EHBDHN CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCCOC1 ZINC000571448075 1041295753 /nfs/dbraw/zinc/29/57/53/1041295753.db2.gz QHPWVFHGWZYTHI-ZDUSSCGKSA-N 0 3 332.425 3.934 20 5 EHBDHN COc1cc(CN2CC[C@H](C(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000552488451 1127758388 /nfs/dbraw/zinc/75/83/88/1127758388.db2.gz BUHOVWSTAQUONE-NSHDSACASA-N 0 3 344.358 3.683 20 5 EHBDHN CN1CCC[C@H](CNc2ncccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301443288 1127936087 /nfs/dbraw/zinc/93/60/87/1127936087.db2.gz VAJAUWOWVMEJHE-IUODEOHRSA-N 0 3 332.429 3.546 20 5 EHBDHN COc1ccc([C@H](C)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1C ZINC000273018399 1128432609 /nfs/dbraw/zinc/43/26/09/1128432609.db2.gz CESZKXDDZOUSLP-ZDUSSCGKSA-N 0 3 330.384 3.771 20 5 EHBDHN C[C@H]1CN(CCCCNc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000301580726 1128499765 /nfs/dbraw/zinc/49/97/65/1128499765.db2.gz SHSZWXCDCQVXLW-STQMWFEESA-N 0 3 341.839 3.550 20 5 EHBDHN CO[C@H](c1ccccc1F)[C@H](C)NCc1ccc([N+](=O)[O-])cc1C ZINC000542725233 1128563233 /nfs/dbraw/zinc/56/32/33/1128563233.db2.gz ZOPHUXMGXXLCBB-UGSOOPFHSA-N 0 3 332.375 3.908 20 5 EHBDHN CCN(CC(C)C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000153737822 1128661319 /nfs/dbraw/zinc/66/13/19/1128661319.db2.gz JAKKLFPIYPWRSH-LLVKDONJSA-N 0 3 327.812 3.553 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@@H](O)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000153114313 1120691314 /nfs/dbraw/zinc/69/13/14/1120691314.db2.gz MDSPIIGBWVPNLZ-RDTXWAMCSA-N 0 3 344.411 3.686 20 5 EHBDHN C[C@@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000487955958 1121360256 /nfs/dbraw/zinc/36/02/56/1121360256.db2.gz VGZAPVCEQUTVRV-GFCCVEGCSA-N 0 3 347.802 3.928 20 5 EHBDHN CC(C)COCCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113315636 1129000310 /nfs/dbraw/zinc/00/03/10/1129000310.db2.gz PEJRHTMJQUOYTO-UHFFFAOYSA-N 0 3 349.456 3.871 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H](c1ccccc1)C1CC1 ZINC000194552460 1122739799 /nfs/dbraw/zinc/73/97/99/1122739799.db2.gz PZYVCUKEUVWPNK-LJQANCHMSA-N 0 3 339.395 3.583 20 5 EHBDHN Cc1ccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c(CN(C)C)c1 ZINC000113911590 1129090058 /nfs/dbraw/zinc/09/00/58/1129090058.db2.gz AZLMYLIZWKASSB-YRNVUSSQSA-N 0 3 339.395 3.617 20 5 EHBDHN CC(C)C[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000155112548 1123189796 /nfs/dbraw/zinc/18/97/96/1123189796.db2.gz VUBXMDMGPPBSPE-CQSZACIVSA-N 0 3 347.440 3.972 20 5 EHBDHN Cc1ccc([C@@H](CNCc2ccc(C)c([N+](=O)[O-])c2)N2CCCC2)o1 ZINC000237884749 1123898586 /nfs/dbraw/zinc/89/85/86/1123898586.db2.gz CCDRABYAWPKYKM-GOSISDBHSA-N 0 3 343.427 3.731 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000078989280 1129220483 /nfs/dbraw/zinc/22/04/83/1129220483.db2.gz CNCWZPNQNDTMET-OLZOCXBDSA-N 0 3 328.368 3.778 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2cnc(CCN3Cc4ccccc4C3)o2)c1 ZINC000155461871 1129640159 /nfs/dbraw/zinc/64/01/59/1129640159.db2.gz YVYAZUBPHIJQOX-UHFFFAOYSA-N 0 3 335.363 3.808 20 5 EHBDHN Cc1cnn(CC2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)c1 ZINC000330735044 1129644182 /nfs/dbraw/zinc/64/41/82/1129644182.db2.gz VQVWIDRIQJDMRZ-INIZCTEOSA-N 0 3 342.443 3.881 20 5 EHBDHN C[C@@H]1CCC[C@@H](C)N(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000125235622 1129672487 /nfs/dbraw/zinc/67/24/87/1129672487.db2.gz QCRDQFUORISOLM-CHWSQXEVSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H](Cc1ccc(O)cc1)N(C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000125513985 1129699497 /nfs/dbraw/zinc/69/94/97/1129699497.db2.gz FSZHYAAOAMYHLE-GFCCVEGCSA-N 0 3 341.367 3.505 20 5 EHBDHN CC(C)C[C@@H]1CCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000134132137 1129981387 /nfs/dbraw/zinc/98/13/87/1129981387.db2.gz YOPFZZMUHCVHHI-HNNXBMFYSA-N 0 3 330.388 3.655 20 5 EHBDHN CC(C)C[C@H]1CCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000134132361 1129981560 /nfs/dbraw/zinc/98/15/60/1129981560.db2.gz YOPFZZMUHCVHHI-OAHLLOKOSA-N 0 3 330.388 3.655 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@@H](C)c2cc(C)ccn2)c1F ZINC001173179272 1131992581 /nfs/dbraw/zinc/99/25/81/1131992581.db2.gz OPKKVJXXZSMCEE-STQMWFEESA-N 0 3 347.390 3.728 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCOC[C@@H]1C1CCCCC1 ZINC001173231062 1132009260 /nfs/dbraw/zinc/00/92/60/1132009260.db2.gz JGKGABKPWVFJSP-DNVCBOLYSA-N 0 3 332.444 3.807 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)NCc1cc(-c2ccccc2)no1 ZINC001173212998 1132014321 /nfs/dbraw/zinc/01/43/21/1132014321.db2.gz FEPCYIYXYDPVPQ-CQSZACIVSA-N 0 3 337.379 3.971 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCOC12CCCC2 ZINC001176823943 1133003224 /nfs/dbraw/zinc/00/32/24/1133003224.db2.gz ZTTUPVDOGPOQHA-QGZVFWFLSA-N 0 3 334.416 3.573 20 5 EHBDHN CC(C)c1ccc(CNCCOc2ncccc2Cl)cc1[N+](=O)[O-] ZINC001177976268 1133126284 /nfs/dbraw/zinc/12/62/84/1133126284.db2.gz DBSWYRQDMUCQFQ-UHFFFAOYSA-N 0 3 349.818 3.935 20 5 EHBDHN C[C@@H]1CCC[C@@H]1CNCc1c(Br)cccc1[N+](=O)[O-] ZINC001178558033 1133181046 /nfs/dbraw/zinc/18/10/46/1133181046.db2.gz WZZVXNVXEDJJGQ-GHMZBOCLSA-N 0 3 327.222 3.883 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCC[C@H]1COc2ccccc2O1 ZINC001182432610 1133656017 /nfs/dbraw/zinc/65/60/17/1133656017.db2.gz AYMODBJHDIUVST-AWEZNQCLSA-N 0 3 348.786 3.568 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCC[C@@H]1COc2ccccc2O1 ZINC001182432611 1133656118 /nfs/dbraw/zinc/65/61/18/1133656118.db2.gz AYMODBJHDIUVST-CQSZACIVSA-N 0 3 348.786 3.568 20 5 EHBDHN Cc1cc(N[C@H]2CCN(Cc3cccc(C)c3)C2)c([N+](=O)[O-])s1 ZINC001187190977 1134307980 /nfs/dbraw/zinc/30/79/80/1134307980.db2.gz WWCKNDGWGXYITH-HNNXBMFYSA-N 0 3 331.441 3.960 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCc3ccc(C)cc3C2)c([N+](=O)[O-])c1 ZINC001170327191 1134748334 /nfs/dbraw/zinc/74/83/34/1134748334.db2.gz FMLUCGAMKMCSCZ-OAHLLOKOSA-N 0 3 340.423 3.901 20 5 EHBDHN CC[C@H](NCc1ccccc1CC(=O)OC)c1cccc([N+](=O)[O-])c1 ZINC000775537561 1135034290 /nfs/dbraw/zinc/03/42/90/1135034290.db2.gz AJIYMRBJLJFLKX-SFHVURJKSA-N 0 3 342.395 3.551 20 5 EHBDHN COc1cc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c([N+](=O)[O-])cc1[O-] ZINC001199053504 1135876253 /nfs/dbraw/zinc/87/62/53/1135876253.db2.gz ZZWVRQRXCPJPNJ-GZBFAFLISA-N 0 3 334.416 3.758 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC1(CO)CCCCC1 ZINC000811484265 1136092086 /nfs/dbraw/zinc/09/20/86/1136092086.db2.gz XWCQONWENLEONO-UHFFFAOYSA-N 0 3 347.242 3.934 20 5 EHBDHN Cc1ncc(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])s1 ZINC000811484597 1136092429 /nfs/dbraw/zinc/09/24/29/1136092429.db2.gz CVEFBFUUSNSLGZ-UHFFFAOYSA-N 0 3 346.239 3.999 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC[C@](C)(O)c1ccccc1 ZINC000850462396 1136264046 /nfs/dbraw/zinc/26/40/46/1136264046.db2.gz NYKQYMIBXZROPK-KUHUBIRLSA-N 0 3 344.411 3.552 20 5 EHBDHN CCc1ccc([C@@H](O)CN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850470241 1136265314 /nfs/dbraw/zinc/26/53/14/1136265314.db2.gz ZVKFZCPSWDFQDQ-ACJLOTCBSA-N 0 3 344.411 3.550 20 5 EHBDHN CC(=O)c1ccc(Oc2ccc(C(=O)OCC(C)[N+](=O)[O-])cc2)cc1 ZINC000813109430 1136294000 /nfs/dbraw/zinc/29/40/00/1136294000.db2.gz SBWBHRWCMLKJAS-GFCCVEGCSA-N 0 3 343.335 3.504 20 5 EHBDHN CCOc1cc(-c2ccccc2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813111221 1136294785 /nfs/dbraw/zinc/29/47/85/1136294785.db2.gz DBICJZMNRLHYDS-NSHDSACASA-N 0 3 335.381 3.636 20 5 EHBDHN CC([C@@H](OC(=O)C1CC2(CC2(F)F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000851109415 1136338266 /nfs/dbraw/zinc/33/82/66/1136338266.db2.gz XXMZUCFPZKFCNF-RSSUCFIBSA-N 0 3 343.301 3.511 20 5 EHBDHN CC(C)Oc1cccc(CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815561730 1136611293 /nfs/dbraw/zinc/61/12/93/1136611293.db2.gz OMZLELRTNHDHOR-ZDUSSCGKSA-N 0 3 329.400 3.815 20 5 EHBDHN C[C@H](NC[C@@H]1COC2(CCCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776741652 1136617807 /nfs/dbraw/zinc/61/78/07/1136617807.db2.gz WKBSWZTXHPAWDV-WMLDXEAASA-N 0 3 334.416 3.711 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2cccc([N+](=O)[O-])c2Cl)c1 ZINC000816955704 1136766674 /nfs/dbraw/zinc/76/66/74/1136766674.db2.gz LDWAEYXQIYFQPA-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN CC[C@@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000817414680 1136806719 /nfs/dbraw/zinc/80/67/19/1136806719.db2.gz ICZMXEJNNGWRTH-NWDGAFQWSA-N 0 3 333.215 3.949 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(CN(C)C)cc1F ZINC000823576709 1137104806 /nfs/dbraw/zinc/10/48/06/1137104806.db2.gz JPJYYBIZEHZQAE-UHFFFAOYSA-N 0 3 345.374 3.665 20 5 EHBDHN CC([C@@H](OC(=O)CCc1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000845874289 1137316226 /nfs/dbraw/zinc/31/62/26/1137316226.db2.gz YSBVCYNRDAHMMI-BDJLRTHQSA-N 0 3 337.372 3.770 20 5 EHBDHN Cc1oc(C2CC2)nc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845883768 1137317173 /nfs/dbraw/zinc/31/71/73/1137317173.db2.gz VXEFJGPQQUKXHM-BJOHPYRUSA-N 0 3 348.330 3.563 20 5 EHBDHN Cc1ccccc1NC(=O)C[C@@H](C)NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000866538596 1137362831 /nfs/dbraw/zinc/36/28/31/1137362831.db2.gz CPYRACVLQGETCZ-OAHLLOKOSA-N 0 3 341.411 3.719 20 5 EHBDHN CC[C@H](C[C@H](C)O)N[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000866635270 1137371580 /nfs/dbraw/zinc/37/15/80/1137371580.db2.gz OJXSGBHXYIOVLJ-YJLNNSPDSA-N 0 3 328.412 3.823 20 5 EHBDHN O=[N+]([O-])c1cc2ccccc2nc1N[C@@H]1CCN(Cc2ccccc2)C1 ZINC001649160325 1137479536 /nfs/dbraw/zinc/47/95/36/1137479536.db2.gz XEZRRVDWFPADKS-QGZVFWFLSA-N 0 3 348.406 3.829 20 5 EHBDHN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCCC2(CCCC2)CC1 ZINC001171911649 1137518104 /nfs/dbraw/zinc/51/81/04/1137518104.db2.gz TWRAJFFSTYZJCP-OAHLLOKOSA-N 0 3 345.443 3.968 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](O)c1ccsc1 ZINC000872037788 1137566924 /nfs/dbraw/zinc/56/69/24/1137566924.db2.gz IEJCXHAIDRVGMU-QMTHXVAHSA-N 0 3 338.454 3.762 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](O)c1ccsc1 ZINC000872037786 1137566937 /nfs/dbraw/zinc/56/69/37/1137566937.db2.gz IEJCXHAIDRVGMU-HZMBPMFUSA-N 0 3 338.454 3.762 20 5 EHBDHN C[C@@H]1CCC[C@@H](NCc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1C ZINC000878446552 1137716389 /nfs/dbraw/zinc/71/63/89/1137716389.db2.gz GNYSIRQZZLGKCH-YRGRVCCFSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@@H](NC(C)(C)c1cccs1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000348306218 1137924738 /nfs/dbraw/zinc/92/47/38/1137924738.db2.gz CPLYIJYKNYXWSY-LLVKDONJSA-N 0 3 333.413 3.508 20 5 EHBDHN CC(C)(C)[C@@H]1CCCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000332128109 1137932627 /nfs/dbraw/zinc/93/26/27/1137932627.db2.gz MYNZGYISBVNNQF-AWEZNQCLSA-N 0 3 330.388 3.655 20 5 EHBDHN Cc1c([C@@H](C)NCc2ccc(F)c(CN(C)C)c2)cccc1[N+](=O)[O-] ZINC000120910887 1137953520 /nfs/dbraw/zinc/95/35/20/1137953520.db2.gz HLIHLVNFQSVONP-CQSZACIVSA-N 0 3 345.418 3.955 20 5 EHBDHN Cc1nc(C2CCN([C@H](C)c3ccccc3[N+](=O)[O-])CC2)[nH]c1C ZINC000886665542 1138111573 /nfs/dbraw/zinc/11/15/73/1138111573.db2.gz AOTVICFYYZIKLV-CQSZACIVSA-N 0 3 328.416 3.875 20 5 EHBDHN CCN(CCN[C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000301643158 1138611783 /nfs/dbraw/zinc/61/17/83/1138611783.db2.gz NJTPRPBDWPOEPA-ZDUSSCGKSA-N 0 3 337.420 3.502 20 5 EHBDHN CC[C@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000302092482 1138711189 /nfs/dbraw/zinc/71/11/89/1138711189.db2.gz FEKLVSBBTSXTAX-TZMCWYRMSA-N 0 3 337.420 3.549 20 5 EHBDHN C[C@H](CN(C)Cc1ccc(Cl)c([N+](=O)[O-])c1)c1nccs1 ZINC000183969239 1140070317 /nfs/dbraw/zinc/07/03/17/1140070317.db2.gz MTEKMBKLVLBYKU-SNVBAGLBSA-N 0 3 325.821 3.940 20 5 EHBDHN COCCC(C)(C)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000185285663 1140143248 /nfs/dbraw/zinc/14/32/48/1140143248.db2.gz CFPSDJCMWSKUIP-UHFFFAOYSA-N 0 3 349.456 3.871 20 5 EHBDHN Cc1c(CN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000192120645 1140504334 /nfs/dbraw/zinc/50/43/34/1140504334.db2.gz GCZYCLLWXAZZHM-WMZOPIPTSA-N 0 3 348.349 3.801 20 5 EHBDHN Cc1ccc([C@@H](C)NC[C@H](O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000268776817 1140989022 /nfs/dbraw/zinc/98/90/22/1140989022.db2.gz WBSPZSVYHIVADF-DIFFPNOSSA-N 0 3 336.338 3.566 20 5 EHBDHN C[C@H](c1ccc(F)c(F)c1)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269636323 1141130141 /nfs/dbraw/zinc/13/01/41/1141130141.db2.gz AOPCBQVRUAMYFF-DIFFPNOSSA-N 0 3 336.338 3.599 20 5 EHBDHN CC[C@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000340153737 1016507260 /nfs/dbraw/zinc/50/72/60/1016507260.db2.gz BKZUJMQUUZUVBB-KSSFIOAISA-N 0 3 341.411 3.971 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2noc([C@H]3CCCN3C3CCCC3)n2)c1 ZINC000275420256 1016733516 /nfs/dbraw/zinc/73/35/16/1016733516.db2.gz HHCPFBBMBUCEME-OAHLLOKOSA-N 0 3 328.372 3.724 20 5 EHBDHN C[C@H]1CCCC[C@]1(C)NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000459622519 1032335073 /nfs/dbraw/zinc/33/50/73/1032335073.db2.gz YKHNGMOLPDLXTB-SJCJKPOMSA-N 0 3 330.388 3.703 20 5 EHBDHN Cn1cc([C@@H](NC/C=C\c2ccccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000538430307 1032358924 /nfs/dbraw/zinc/35/89/24/1032358924.db2.gz VALJVPTZZLATLY-NBEHIINDSA-N 0 3 328.416 3.719 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H](c1ccccc1)C(C)C ZINC000008002822 1017318033 /nfs/dbraw/zinc/31/80/33/1017318033.db2.gz HXKAKZIYJYBJCK-GOSISDBHSA-N 0 3 341.411 3.829 20 5 EHBDHN COCc1ccc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000449502976 1032684118 /nfs/dbraw/zinc/68/41/18/1032684118.db2.gz SKXOIUCLSDJHTH-OAHLLOKOSA-N 0 3 330.384 3.714 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000177359870 1017643223 /nfs/dbraw/zinc/64/32/23/1017643223.db2.gz RRUBYOYMKNNUEY-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2nccnc2c1 ZINC000602438603 1032889701 /nfs/dbraw/zinc/88/97/01/1032889701.db2.gz GIAJZBMHPDHUOC-UHFFFAOYSA-N 0 3 336.395 3.949 20 5 EHBDHN C[C@H](CCc1ccccc1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602504461 1032938081 /nfs/dbraw/zinc/93/80/81/1032938081.db2.gz QMZHDYZZYFHZFX-CYBMUJFWSA-N 0 3 325.368 3.847 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN(CCC(F)(F)F)CC2CC2)c1 ZINC000084137793 1021005931 /nfs/dbraw/zinc/00/59/31/1021005931.db2.gz KDVQNXBEHYIRIR-UHFFFAOYSA-N 0 3 332.322 3.638 20 5 EHBDHN CCOc1ccccc1[C@H](C)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000537966560 1021026393 /nfs/dbraw/zinc/02/63/93/1021026393.db2.gz ROOGKMMOOOFYCS-AWEZNQCLSA-N 0 3 330.384 3.723 20 5 EHBDHN CC(C)(C)[C@H]1OCCC[C@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602549541 1032959915 /nfs/dbraw/zinc/95/99/15/1032959915.db2.gz DKFQMDQCTKHNJU-SJCJKPOMSA-N 0 3 347.415 3.667 20 5 EHBDHN CO[C@H]([C@@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000449633669 1032965168 /nfs/dbraw/zinc/96/51/68/1032965168.db2.gz UQPIZIORFVPSQV-KZULUSFZSA-N 0 3 330.384 3.758 20 5 EHBDHN CCN(CCC1CC1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000546230112 1021379330 /nfs/dbraw/zinc/37/93/30/1021379330.db2.gz SSKWKZUPDRIBKM-LLVKDONJSA-N 0 3 339.823 3.697 20 5 EHBDHN CCSCCCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602650677 1033040151 /nfs/dbraw/zinc/04/01/51/1033040151.db2.gz GDRFMDHNAMZLRB-UHFFFAOYSA-N 0 3 339.280 3.652 20 5 EHBDHN C[C@@H](CCCC(F)(F)F)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602634744 1033047480 /nfs/dbraw/zinc/04/74/80/1033047480.db2.gz PDRSSHWEOVTTFR-VIFPVBQESA-N 0 3 331.294 3.947 20 5 EHBDHN C[C@H]1CCC[C@@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000026468225 1033054420 /nfs/dbraw/zinc/05/44/20/1033054420.db2.gz UUHSYJINJVXCEZ-WCQYABFASA-N 0 3 339.823 3.697 20 5 EHBDHN Cc1c(CNCc2ccc(OCC(F)F)cc2)cccc1[N+](=O)[O-] ZINC000480461844 1033070391 /nfs/dbraw/zinc/07/03/91/1033070391.db2.gz BBSYTMGPDGZGHM-UHFFFAOYSA-N 0 3 336.338 3.837 20 5 EHBDHN CN(C)[C@H](CNCc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000060774003 1022913377 /nfs/dbraw/zinc/91/33/77/1022913377.db2.gz AEIJURWKNADNGA-QGZVFWFLSA-N 0 3 333.819 3.641 20 5 EHBDHN O=C(C[C@H]1CCCN1CCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000431002494 1023098192 /nfs/dbraw/zinc/09/81/92/1023098192.db2.gz ZFKSRTKKPUJPJE-MRXNPFEDSA-N 0 3 344.436 3.936 20 5 EHBDHN CCOc1cc(CN(C)C[C@H](C)c2nccs2)ccc1[N+](=O)[O-] ZINC000276938792 1023426495 /nfs/dbraw/zinc/42/64/95/1023426495.db2.gz RXPZCEVYVUWWIA-LBPRGKRZSA-N 0 3 335.429 3.686 20 5 EHBDHN CCOC(=O)C(C)(C)C1CCN([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000510967795 1023540918 /nfs/dbraw/zinc/54/09/18/1023540918.db2.gz MAQYVKWTHCGQCF-CQSZACIVSA-N 0 3 348.443 3.957 20 5 EHBDHN Cc1ccc([C@@H](C)NCC(=O)Nc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000610831082 1023781484 /nfs/dbraw/zinc/78/14/84/1023781484.db2.gz WYWCGVFOHRYAFX-CQSZACIVSA-N 0 3 327.384 3.501 20 5 EHBDHN CN(C)[C@@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)c1cccs1 ZINC000075469830 1024199454 /nfs/dbraw/zinc/19/94/54/1024199454.db2.gz MFMPLLPGXQCCOR-HNNXBMFYSA-N 0 3 342.424 3.919 20 5 EHBDHN COc1ccc(CN(C)C/C=C/c2ccccc2[N+](=O)[O-])cc1OC ZINC000611252208 1024322278 /nfs/dbraw/zinc/32/22/78/1024322278.db2.gz OLPXBTQRGJNIDE-SOFGYWHQSA-N 0 3 342.395 3.757 20 5 EHBDHN Cc1ccc(CN2CC3(CCC3)[C@@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000425368574 1024882077 /nfs/dbraw/zinc/88/20/77/1024882077.db2.gz FDTPUMWNZKDBSX-SFHVURJKSA-N 0 3 330.428 3.684 20 5 EHBDHN CSC1CCC(CNCc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000896256772 1025287859 /nfs/dbraw/zinc/28/78/59/1025287859.db2.gz ZKOZVFIEEHFKLV-UHFFFAOYSA-N 0 3 335.429 3.747 20 5 EHBDHN Cc1c([C@H](C)NCc2ccc(-n3ccnc3)cc2)cccc1[N+](=O)[O-] ZINC000158414756 1026449943 /nfs/dbraw/zinc/44/99/43/1026449943.db2.gz BSTQTWPMVMMZKH-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN Cc1cccc([C@H](C)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000452096759 1026475189 /nfs/dbraw/zinc/47/51/89/1026475189.db2.gz XMIYLXIBGQRBKS-UONOGXRCSA-N 0 3 327.384 3.581 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C(C)C)C1CC(C)(C)C1 ZINC000452102636 1026497006 /nfs/dbraw/zinc/49/70/06/1026497006.db2.gz IORCYVBQAORZIL-UHFFFAOYSA-N 0 3 333.432 3.741 20 5 EHBDHN CC[C@@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000340152022 1026873905 /nfs/dbraw/zinc/87/39/05/1026873905.db2.gz IXEATXZKRJCMPF-KBXCAEBGSA-N 0 3 341.411 3.971 20 5 EHBDHN CCC(C)(C)N(C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000548755529 1027015728 /nfs/dbraw/zinc/01/57/28/1027015728.db2.gz JQFSPDBZNQVCCP-UHFFFAOYSA-N 0 3 332.347 3.825 20 5 EHBDHN COCCC1(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCC1 ZINC000475497740 1027421239 /nfs/dbraw/zinc/42/12/39/1027421239.db2.gz RKTPXDMMMYJBOQ-UHFFFAOYSA-N 0 3 347.440 3.767 20 5 EHBDHN CCO[C@H]1C[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(CC)CC ZINC000444691012 1028163448 /nfs/dbraw/zinc/16/34/48/1028163448.db2.gz WRENWHMBJIWOAU-CVEARBPZSA-N 0 3 346.431 3.545 20 5 EHBDHN COC[C@@H]1CCCCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000467118634 1028223897 /nfs/dbraw/zinc/22/38/97/1028223897.db2.gz PCYQZFXXZNOEFF-OAHLLOKOSA-N 0 3 336.432 3.631 20 5 EHBDHN CCC[C@@]1(CO)CCCN1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000444764444 1028251295 /nfs/dbraw/zinc/25/12/95/1028251295.db2.gz BESVWZLVJPCVKH-SFHVURJKSA-N 0 3 336.432 3.509 20 5 EHBDHN CC[C@@H]1C[C@@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000421391339 1028367078 /nfs/dbraw/zinc/36/70/78/1028367078.db2.gz UAFNQWCTPWXDCW-XJKSGUPXSA-N 0 3 347.440 3.766 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)N(C)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000532755659 1028799047 /nfs/dbraw/zinc/79/90/47/1028799047.db2.gz IWKMMVPETHRMAP-AWEZNQCLSA-N 0 3 333.432 3.742 20 5 EHBDHN O=[N+]([O-])c1ccccc1CNCCOc1ccc(C(F)(F)F)cc1 ZINC000237844940 1029458379 /nfs/dbraw/zinc/45/83/79/1029458379.db2.gz DAZJOIRQPLVCSK-UHFFFAOYSA-N 0 3 340.301 3.782 20 5 EHBDHN CC[C@H](C)[C@H](C)N(CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288260 1029580621 /nfs/dbraw/zinc/58/06/21/1029580621.db2.gz WUFPQVPSYZPABD-JSGCOSHPSA-N 0 3 333.432 3.741 20 5 EHBDHN CCn1nc(C)c(CNC/C(C)=C/c2cccc([N+](=O)[O-])c2)c1C ZINC000527038642 1030587131 /nfs/dbraw/zinc/58/71/31/1030587131.db2.gz RBOYTODWGFNRQX-UKTHLTGXSA-N 0 3 328.416 3.621 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CC[C@H](c2ccc(F)cc2)C1 ZINC000483101749 1030956486 /nfs/dbraw/zinc/95/64/86/1030956486.db2.gz DFXZDIHAVQUJFQ-HNNXBMFYSA-N 0 3 330.359 3.602 20 5 EHBDHN CC1(C)OC[C@H]2C[C@]21NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000598986596 1033612374 /nfs/dbraw/zinc/61/23/74/1033612374.db2.gz DFMBOEGIRWIPJH-ACJLOTCBSA-N 0 3 328.368 3.512 20 5 EHBDHN CCC(F)(F)C(C)(C)CNCc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000599001916 1033638543 /nfs/dbraw/zinc/63/85/43/1033638543.db2.gz ZDEJGCRDDXCRHZ-UHFFFAOYSA-N 0 3 346.374 3.773 20 5 EHBDHN C[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCC(F)CC1 ZINC000595819084 1033994129 /nfs/dbraw/zinc/99/41/29/1033994129.db2.gz MEHNICQQNSHIMS-DCBWTQNWSA-N 0 3 348.378 3.651 20 5 EHBDHN COc1ccc(C[C@H](C)CN(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000537620059 1034197009 /nfs/dbraw/zinc/19/70/09/1034197009.db2.gz OTKPILRHYDIZJA-HNNXBMFYSA-N 0 3 328.412 3.914 20 5 EHBDHN COCCC1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000597183565 1034586912 /nfs/dbraw/zinc/58/69/12/1034586912.db2.gz LHPFKOJVQKWTRW-UHFFFAOYSA-N 0 3 332.425 3.792 20 5 EHBDHN O=[N+]([O-])c1cccc(Cl)c1CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 ZINC000450855932 1034898819 /nfs/dbraw/zinc/89/88/19/1034898819.db2.gz HRVJMHHUWWDRGR-IUIKQTSFSA-N 0 3 336.819 3.686 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000548991602 1035405184 /nfs/dbraw/zinc/40/51/84/1035405184.db2.gz KFOLMEAFDBFBQY-SFHVURJKSA-N 0 3 347.846 3.949 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1ccnc(OC(F)F)c1 ZINC000581503389 1035513678 /nfs/dbraw/zinc/51/36/78/1035513678.db2.gz HEBXGJWCJOXEKA-KPKJPENVSA-N 0 3 349.337 3.784 20 5 EHBDHN CC[C@@H](C)N(CC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000595592926 1035650012 /nfs/dbraw/zinc/65/00/12/1035650012.db2.gz KXJKTUIYUOBWSH-SNVBAGLBSA-N 0 3 332.347 3.825 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@H]2CCCOc3cc(F)ccc32)cc1 ZINC000540990517 1035886350 /nfs/dbraw/zinc/88/63/50/1035886350.db2.gz RHRWNOMWNZXUBH-KRWDZBQOSA-N 0 3 346.358 3.616 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000589200170 1036306950 /nfs/dbraw/zinc/30/69/50/1036306950.db2.gz VQUVAWFZZFZSGV-GGVHLCNSSA-N 0 3 330.428 3.747 20 5 EHBDHN C[C@]1(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO[C@@H]1C1CC1 ZINC000542316381 1037282761 /nfs/dbraw/zinc/28/27/61/1037282761.db2.gz UHBSMFFDGTYYBX-MOPGFXCFSA-N 0 3 342.395 3.902 20 5 EHBDHN O=[N+]([O-])c1ccc2[nH]c(CNCCc3ccc(F)cc3Cl)nc2c1 ZINC000573650435 1037670996 /nfs/dbraw/zinc/67/09/96/1037670996.db2.gz DYBSOHFBHMPROU-UHFFFAOYSA-N 0 3 348.765 3.596 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@]3(C)CCCO3)o2)c([N+](=O)[O-])c1 ZINC000152936972 1037864721 /nfs/dbraw/zinc/86/47/21/1037864721.db2.gz OMJXIYYRNOIAGB-SFHVURJKSA-N 0 3 346.383 3.522 20 5 EHBDHN C[C@@H]1CC(C)(C)CC[C@@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000481117026 1038153959 /nfs/dbraw/zinc/15/39/59/1038153959.db2.gz QFPHWJQJMOTNLO-DOMZBBRYSA-N 0 3 344.415 3.949 20 5 EHBDHN C/C(=C\c1ccccc1)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737320 1038500778 /nfs/dbraw/zinc/50/07/78/1038500778.db2.gz VVQCPKXQVUSWFV-JMPLCFMRSA-N 0 3 338.411 3.580 20 5 EHBDHN Cc1cc(N[C@H]2CCN(C3CC3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461777580 1038603648 /nfs/dbraw/zinc/60/36/48/1038603648.db2.gz GAZOAXQHFAARTN-JTQLQIEISA-N 0 3 329.322 3.571 20 5 EHBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1cc2c(c(Cl)c1)OCO2 ZINC000552142444 1039021058 /nfs/dbraw/zinc/02/10/58/1039021058.db2.gz FOKNMMYHHIHIHX-UHFFFAOYSA-N 0 3 348.786 3.651 20 5 EHBDHN O=[N+]([O-])c1ccn(CCN(Cc2ccccc2F)C2CCCCC2)n1 ZINC000478012754 1039117817 /nfs/dbraw/zinc/11/78/17/1039117817.db2.gz BUIPEOWQQPTXDH-UHFFFAOYSA-N 0 3 346.406 3.765 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ccc(CO)c(F)c1)CCCC2 ZINC000417342493 1039705399 /nfs/dbraw/zinc/70/53/99/1039705399.db2.gz PBSVVUDTRTXPJA-LJQANCHMSA-N 0 3 344.386 3.784 20 5 EHBDHN O=[N+]([O-])c1cccc(CNC[C@@H](O)c2ccc(Cl)cc2Cl)c1 ZINC000111394798 1039726573 /nfs/dbraw/zinc/72/65/73/1039726573.db2.gz PZBJLLVHAIIACN-OAHLLOKOSA-N 0 3 341.194 3.725 20 5 EHBDHN CC(C)[C@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000029113011 1040139492 /nfs/dbraw/zinc/13/94/92/1040139492.db2.gz ROHJRKNRRDYQNL-IBGZPJMESA-N 0 3 341.411 3.545 20 5 EHBDHN CN(C)Cc1ccccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000573724821 1040200625 /nfs/dbraw/zinc/20/06/25/1040200625.db2.gz PPKUIISMSCANSX-UHFFFAOYSA-N 0 3 333.775 3.562 20 5 EHBDHN O=[N+]([O-])c1cccc(CCNCc2cscc2Br)c1 ZINC000512050344 1043041173 /nfs/dbraw/zinc/04/11/73/1043041173.db2.gz BOLUGRMVJWZSIT-UHFFFAOYSA-N 0 3 341.230 3.751 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@@H]1CC=CCC1 ZINC000344030524 1043125009 /nfs/dbraw/zinc/12/50/09/1043125009.db2.gz BUJRFLLTAWBUPM-ZIAGYGMSSA-N 0 3 342.399 3.994 20 5 EHBDHN COc1ccc(CNC/C=C\c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000512087391 1043174433 /nfs/dbraw/zinc/17/44/33/1043174433.db2.gz JJTRDOYWJXQJNI-IHWYPQMZSA-N 0 3 334.322 3.685 20 5 EHBDHN Cc1cccc([C@H](C)NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1C ZINC000183720566 1125742678 /nfs/dbraw/zinc/74/26/78/1125742678.db2.gz FJBVPPFXFNFFMM-HNNXBMFYSA-N 0 3 341.411 3.809 20 5 EHBDHN COc1cc(NC[C@@H](c2ccc(Cl)cc2)N(C)C)ccc1[N+](=O)[O-] ZINC000301464535 1128457534 /nfs/dbraw/zinc/45/75/34/1128457534.db2.gz GRCKRABRBRMXNI-INIZCTEOSA-N 0 3 349.818 3.972 20 5 EHBDHN CC[C@H](NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(C)cc1 ZINC000194014194 1121752669 /nfs/dbraw/zinc/75/26/69/1121752669.db2.gz LNMFOWWXAFEGCZ-KRWDZBQOSA-N 0 3 341.411 3.891 20 5 EHBDHN Cc1ccc(N2CCCN(Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000917088570 1122486470 /nfs/dbraw/zinc/48/64/70/1122486470.db2.gz MLZZWMVMMTVTQC-UHFFFAOYSA-N 0 3 325.412 3.616 20 5 EHBDHN CCC1(CC)[C@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)[C@H](C)[C@@H]1OC ZINC000617549835 1124648606 /nfs/dbraw/zinc/64/86/06/1124648606.db2.gz NKVAACKMBDSRIP-JECHBYEQSA-N 0 3 347.415 3.665 20 5 EHBDHN C[C@H](N[C@@H](C)c1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000078989274 1129220646 /nfs/dbraw/zinc/22/06/46/1129220646.db2.gz CNCWZPNQNDTMET-STQMWFEESA-N 0 3 328.368 3.778 20 5 EHBDHN C[C@@H](N[C@H](c1ccccc1)C1CC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000012674630 1129451528 /nfs/dbraw/zinc/45/15/28/1129451528.db2.gz PCHGDBFDYKENHJ-FZKQIMNGSA-N 0 3 339.395 3.663 20 5 EHBDHN Cn1cc(CN2CCC[C@H]3CCC[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092485398 1129548518 /nfs/dbraw/zinc/54/85/18/1129548518.db2.gz OHBGQELCUQLXGE-KDOFPFPSSA-N 0 3 340.427 3.760 20 5 EHBDHN C[C@@H](NC[C@@H](c1ccco1)N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000154964368 1129601909 /nfs/dbraw/zinc/60/19/09/1129601909.db2.gz WOADWVKXAQVIIQ-PBHICJAKSA-N 0 3 329.400 3.676 20 5 EHBDHN C[C@@H](NC[C@H](c1c(F)cccc1F)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173419174 1130228581 /nfs/dbraw/zinc/22/85/81/1130228581.db2.gz SLTHKKUGMNNEBO-SJKOYZFVSA-N 0 3 349.381 3.827 20 5 EHBDHN C[C@H](O)C[C@H](C)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000246055806 1130338906 /nfs/dbraw/zinc/33/89/06/1130338906.db2.gz YRPNWGWIWNQGAB-YZVOILCLSA-N 0 3 328.412 3.681 20 5 EHBDHN C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000174987150 1130394730 /nfs/dbraw/zinc/39/47/30/1130394730.db2.gz ILYCMPHIXDWONU-KUHUBIRLSA-N 0 3 339.395 3.616 20 5 EHBDHN CC[C@@H](C)[C@H]1CCCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059328 1131462052 /nfs/dbraw/zinc/46/20/52/1131462052.db2.gz XKSQBTZGXBOLFE-RHSMWYFYSA-N 0 3 343.431 3.711 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2cnn(CN3CCc4ccccc4CC3)c2)cc1 ZINC000738227643 1131464056 /nfs/dbraw/zinc/46/40/56/1131464056.db2.gz XJBLXKBEUJGQDU-UHFFFAOYSA-N 0 3 348.406 3.517 20 5 EHBDHN O=C1CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@@H]2CCCC[C@@H]12 ZINC001172908395 1131887382 /nfs/dbraw/zinc/88/73/82/1131887382.db2.gz MDOITLZGSHBJDY-BHIYHBOVSA-N 0 3 342.439 3.676 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@H](C)c2cc(C)ccn2)c1F ZINC001173179269 1131992408 /nfs/dbraw/zinc/99/24/08/1131992408.db2.gz OPKKVJXXZSMCEE-QWHCGFSZSA-N 0 3 347.390 3.728 20 5 EHBDHN Cc1cccc(N2CCN([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173224692 1132005645 /nfs/dbraw/zinc/00/56/45/1132005645.db2.gz GLAMPWFWQZLWPB-KRWDZBQOSA-N 0 3 339.439 3.656 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H](CO)C1CCCCC1 ZINC000809974244 1132660297 /nfs/dbraw/zinc/66/02/97/1132660297.db2.gz QGDZZNBAFVTBQZ-AWEZNQCLSA-N 0 3 347.242 3.932 20 5 EHBDHN Cc1noc(CN2CC[C@H](c3ccc(C)cc3)C2(C)C)c1[N+](=O)[O-] ZINC001175714360 1132741335 /nfs/dbraw/zinc/74/13/35/1132741335.db2.gz HAEDTJJUXFPHAU-OAHLLOKOSA-N 0 3 329.400 3.968 20 5 EHBDHN CCN1CCN(c2ccc(Nc3cc([N+](=O)[O-])ccc3F)cc2)CC1 ZINC001175736987 1132749518 /nfs/dbraw/zinc/74/95/18/1132749518.db2.gz QFHDBHDKHMVIIA-UHFFFAOYSA-N 0 3 344.390 3.619 20 5 EHBDHN Cc1ccc(CN[C@@H](C)COc2c(F)cccc2F)cc1[N+](=O)[O-] ZINC001179123614 1133230017 /nfs/dbraw/zinc/23/00/17/1133230017.db2.gz VZLVHPUCGADJFB-LBPRGKRZSA-N 0 3 336.338 3.739 20 5 EHBDHN CC(C)CC[C@H](CO)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179154648 1133232420 /nfs/dbraw/zinc/23/24/20/1133232420.db2.gz ZTDZYDJUPUQYAD-CQSZACIVSA-N 0 3 332.400 3.742 20 5 EHBDHN Cc1ccc(CN2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246255 1133250650 /nfs/dbraw/zinc/25/06/50/1133250650.db2.gz YOWMXNWIGUYFLE-ICSRJNTNSA-N 0 3 340.423 3.991 20 5 EHBDHN CO[C@H](CN[C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000788670165 1134159908 /nfs/dbraw/zinc/15/99/08/1134159908.db2.gz SQFUMQBDUUGQIR-PIGZYNQJSA-N 0 3 349.818 3.869 20 5 EHBDHN CCOC(=O)C[C@@](C)(NCc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000775376254 1134686313 /nfs/dbraw/zinc/68/63/13/1134686313.db2.gz ZMMKTBVURIZBDA-MRXNPFEDSA-N 0 3 342.823 3.706 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCC(F)(F)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC001170335493 1134752025 /nfs/dbraw/zinc/75/20/25/1134752025.db2.gz OOKZWXWHLAQASX-LBPRGKRZSA-N 0 3 342.386 3.902 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350559 1134760755 /nfs/dbraw/zinc/76/07/55/1134760755.db2.gz BCKOBKZPJAPXAH-RDTXWAMCSA-N 0 3 326.396 3.981 20 5 EHBDHN CC(C)Oc1cccc(CN(C)CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC001192954795 1135076093 /nfs/dbraw/zinc/07/60/93/1135076093.db2.gz BTJKCCTVHRGMCK-UHFFFAOYSA-N 0 3 344.411 3.893 20 5 EHBDHN Cc1ccc([C@H](O)[C@H](C)NCc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809701713 1135874140 /nfs/dbraw/zinc/87/41/40/1135874140.db2.gz JCOUALUGGMOFFB-YVEFUNNKSA-N 0 3 334.803 3.768 20 5 EHBDHN CCC(CC)(CCO)NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000810004132 1135912709 /nfs/dbraw/zinc/91/27/09/1135912709.db2.gz JITYGDGUVLVHJN-UHFFFAOYSA-N 0 3 335.231 3.932 20 5 EHBDHN O=[N+]([O-])c1cc([O-])cc(Nc2ccc(CC[NH+]3CCCC3)cc2)c1 ZINC001201223177 1135999583 /nfs/dbraw/zinc/99/95/83/1135999583.db2.gz VXPIMGBJWZYKPA-UHFFFAOYSA-N 0 3 327.384 3.682 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1COC2(CCCCC2)O1 ZINC000776169990 1136020667 /nfs/dbraw/zinc/02/06/67/1136020667.db2.gz HKDIOKNAVBVMNS-ZBFHGGJFSA-N 0 3 334.416 3.630 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H]1CCC[C@@H](O)C1 ZINC000811481531 1136091522 /nfs/dbraw/zinc/09/15/22/1136091522.db2.gz FDWSICKOMNCOQE-BXKDBHETSA-N 0 3 333.215 3.542 20 5 EHBDHN C[C@H]1CCCCN1CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473615 1136095767 /nfs/dbraw/zinc/09/57/67/1136095767.db2.gz FMLBPMLWTSDUBB-NSHDSACASA-N 0 3 346.258 3.866 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C)C[C@@H](O)c1ccccc1 ZINC000850442020 1136259186 /nfs/dbraw/zinc/25/91/86/1136259186.db2.gz JRAKJLXVSXCYGZ-SUNYJGFJSA-N 0 3 344.411 3.766 20 5 EHBDHN CC(COC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)[N+](=O)[O-] ZINC000813105340 1136288123 /nfs/dbraw/zinc/28/81/23/1136288123.db2.gz XRIQUZKIDPAXCD-JTQLQIEISA-N 0 3 337.278 3.579 20 5 EHBDHN CC(COC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)[N+](=O)[O-] ZINC000813107493 1136294044 /nfs/dbraw/zinc/29/40/44/1136294044.db2.gz RAKQLSKBHSHXOA-HOXUKUGESA-N 0 3 335.356 3.636 20 5 EHBDHN CC(COC(=O)COc1ccc(-c2ccccc2)cc1Cl)[N+](=O)[O-] ZINC000813113616 1136294777 /nfs/dbraw/zinc/29/47/77/1136294777.db2.gz RUFCWTQRDUFTEU-LBPRGKRZSA-N 0 3 349.770 3.594 20 5 EHBDHN Cc1ccc([C@H](C)NCCC(=O)OCc2ccccc2)cc1[N+](=O)[O-] ZINC000776606176 1136471343 /nfs/dbraw/zinc/47/13/43/1136471343.db2.gz SVOCKDCWUVLEQO-HNNXBMFYSA-N 0 3 342.395 3.687 20 5 EHBDHN CC(COC(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1)[N+](=O)[O-] ZINC000816090948 1136671881 /nfs/dbraw/zinc/67/18/81/1136671881.db2.gz DYZXTCKLGMLTHD-SECBINFHSA-N 0 3 343.257 3.787 20 5 EHBDHN Cc1cc(C)nc(NC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000777256857 1137142420 /nfs/dbraw/zinc/14/24/20/1137142420.db2.gz UDXZKSYSCFZNIA-UHFFFAOYSA-N 0 3 326.400 3.688 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCC[C@H]3CCSC3)cs2)c1 ZINC000865654740 1137302252 /nfs/dbraw/zinc/30/22/52/1137302252.db2.gz UHTGBNQOPOAPKW-LBPRGKRZSA-N 0 3 349.481 3.951 20 5 EHBDHN CC([C@@H](OC(=O)CCc1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000845874293 1137316299 /nfs/dbraw/zinc/31/62/99/1137316299.db2.gz YSBVCYNRDAHMMI-MEDUHNTESA-N 0 3 337.372 3.770 20 5 EHBDHN COCc1cccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845873773 1137316326 /nfs/dbraw/zinc/31/63/26/1137316326.db2.gz VWOGENYVKHXHNM-SJCJKPOMSA-N 0 3 347.342 3.535 20 5 EHBDHN CC([C@@H](OC(=O)CC1CC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845878653 1137316539 /nfs/dbraw/zinc/31/65/39/1137316539.db2.gz IASKAGDJRAWQBB-LKFCYVNXSA-N 0 3 331.290 3.511 20 5 EHBDHN CC([C@H](OC(=O)c1coc(C2CCC2)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845879980 1137316758 /nfs/dbraw/zinc/31/67/58/1137316758.db2.gz JJUDXWKXMIJTRG-BONVTDFDSA-N 0 3 348.330 3.645 20 5 EHBDHN C[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)[C@@](C)(O)c1ccccc1 ZINC000846040883 1137328996 /nfs/dbraw/zinc/32/89/96/1137328996.db2.gz XRFBEITZJGTOBL-SJKOYZFVSA-N 0 3 334.803 3.634 20 5 EHBDHN C[C@H]1CCC[C@H](C)N(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878128346 1137703591 /nfs/dbraw/zinc/70/35/91/1137703591.db2.gz CNZLIJAJKLBCMY-STQMWFEESA-N 0 3 330.388 3.655 20 5 EHBDHN CC[C@@H](C)[C@@H](C)NCc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878365896 1137712862 /nfs/dbraw/zinc/71/28/62/1137712862.db2.gz GBDINKNRDGSTPV-NXEZZACHSA-N 0 3 338.795 3.822 20 5 EHBDHN Cc1ccc(CN2CC[C@H](c3ccc4cccnc4n3)C2)cc1[N+](=O)[O-] ZINC000878904334 1137731597 /nfs/dbraw/zinc/73/15/97/1137731597.db2.gz LJALWGDTVZAHQZ-KRWDZBQOSA-N 0 3 348.406 3.836 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[C@H](C)CC1 ZINC000063308695 1138069891 /nfs/dbraw/zinc/06/98/91/1138069891.db2.gz RXSDBQYYTWVLNO-STQMWFEESA-N 0 3 330.388 3.828 20 5 EHBDHN Cc1c(CNCc2ccc(-c3cnn(C)c3)s2)cccc1[N+](=O)[O-] ZINC000337841860 1138680422 /nfs/dbraw/zinc/68/04/22/1138680422.db2.gz ZUTDSMZTXVQSJS-UHFFFAOYSA-N 0 3 342.424 3.655 20 5 EHBDHN Cc1noc([C@H]2CCCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000182685667 1139986211 /nfs/dbraw/zinc/98/62/11/1139986211.db2.gz RLFWDKNBSQVDCM-OCCSQVGLSA-N 0 3 330.388 3.535 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(O)(c2ccccc2)CC1 ZINC000185466107 1140151499 /nfs/dbraw/zinc/15/14/99/1140151499.db2.gz ZNODVLBQGPZHQX-INIZCTEOSA-N 0 3 340.423 3.948 20 5 EHBDHN COCc1ccccc1CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192632664 1140541911 /nfs/dbraw/zinc/54/19/11/1140541911.db2.gz NSSSMMMSRWWAOY-IBGZPJMESA-N 0 3 326.396 3.908 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ccc(-n3cccn3)cc1)CCC2 ZINC000192675980 1140543391 /nfs/dbraw/zinc/54/33/91/1140543391.db2.gz MODXAWYDCSWBQF-HXUWFJFHSA-N 0 3 348.406 3.948 20 5 EHBDHN C[C@@H](NC[C@H](O)c1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000266781848 1140724261 /nfs/dbraw/zinc/72/42/61/1140724261.db2.gz NEASNZXHJZMKDP-BMIGLBTASA-N 0 3 338.766 3.772 20 5 EHBDHN Cc1c(CN2CCC[C@@H]2C[C@@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000268309594 1140918707 /nfs/dbraw/zinc/91/87/07/1140918707.db2.gz XAKOPLIAXABHPX-NVXWUHKLSA-N 0 3 330.384 3.584 20 5 EHBDHN C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269636326 1141129667 /nfs/dbraw/zinc/12/96/67/1141129667.db2.gz AOPCBQVRUAMYFF-GTNSWQLSSA-N 0 3 336.338 3.599 20 5 EHBDHN C[C@@H]1C[C@@H](CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000271258087 1141335067 /nfs/dbraw/zinc/33/50/67/1141335067.db2.gz ACNPFXXMGUQUQT-OLZOCXBDSA-N 0 3 347.440 3.623 20 5 EHBDHN COCCOc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000154079231 1014968628 /nfs/dbraw/zinc/96/86/28/1014968628.db2.gz LLYHVQFODBKKIK-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN COc1ccccc1[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430223784 1015100428 /nfs/dbraw/zinc/10/04/28/1015100428.db2.gz VTTHHIFAUUVUNQ-AWEZNQCLSA-N 0 3 342.395 3.602 20 5 EHBDHN CC[C@@H](CSC)N(C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000167416845 1034880657 /nfs/dbraw/zinc/88/06/57/1034880657.db2.gz LTIQHKJPUSWSSO-NSHDSACASA-N 0 3 347.278 3.931 20 5 EHBDHN Cn1cc(CN2CC3(C2)CCCCC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000459601679 1032321211 /nfs/dbraw/zinc/32/12/11/1032321211.db2.gz YQBWFIYYZVQSMD-UHFFFAOYSA-N 0 3 340.427 3.761 20 5 EHBDHN C[C@H](O)C[C@@H]1CCCCCN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000388351919 1017971742 /nfs/dbraw/zinc/97/17/42/1017971742.db2.gz ADDQDXSPZZGJQF-JSGCOSHPSA-N 0 3 326.824 3.764 20 5 EHBDHN CCS[C@@H]1CCCC[C@@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000190064327 1017973365 /nfs/dbraw/zinc/97/33/65/1017973365.db2.gz NANVFCRWJOEMKS-SWLSCSKDSA-N 0 3 335.429 3.890 20 5 EHBDHN CC(C)c1ccc(CN2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000449550997 1032771613 /nfs/dbraw/zinc/77/16/13/1032771613.db2.gz FEIPREZFTDINMT-BRWVUGGUSA-N 0 3 332.444 3.701 20 5 EHBDHN CC(C)[C@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000015549968 1018758507 /nfs/dbraw/zinc/75/85/07/1018758507.db2.gz HPUBOAXCUVUVJJ-KDOFPFPSSA-N 0 3 341.411 3.909 20 5 EHBDHN Cc1ccc([C@H](C)NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000182329614 1019065678 /nfs/dbraw/zinc/06/56/78/1019065678.db2.gz FIXOLYODEIKMGI-AWEZNQCLSA-N 0 3 327.384 3.501 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CCC[C@@H]2COCC[C@@H]21 ZINC000602485463 1032914784 /nfs/dbraw/zinc/91/47/84/1032914784.db2.gz QRDDEVWPNMBQBA-OCCSQVGLSA-N 0 3 344.333 3.615 20 5 EHBDHN Cc1ccc(CN[C@H]2CCCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000449655595 1032985405 /nfs/dbraw/zinc/98/54/05/1032985405.db2.gz ZMGANZQYYILTON-KRWDZBQOSA-N 0 3 325.412 3.964 20 5 EHBDHN CCC(CC)[C@@H]1C[C@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)CCO1 ZINC000602590252 1032988371 /nfs/dbraw/zinc/98/83/71/1032988371.db2.gz YGCNKDOCWISTEA-DYVFJYSZSA-N 0 3 347.415 3.809 20 5 EHBDHN C[C@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H](C)C1 ZINC000127275141 1021670338 /nfs/dbraw/zinc/67/03/38/1021670338.db2.gz SUSAXAMKTUKPHK-QWHCGFSZSA-N 0 3 330.388 3.513 20 5 EHBDHN CC(=O)c1cc(NC[C@@H](c2ccc(C)cc2)N(C)C)ccc1[N+](=O)[O-] ZINC000550386438 1022418829 /nfs/dbraw/zinc/41/88/29/1022418829.db2.gz GXCXETBOYKLLRX-IBGZPJMESA-N 0 3 341.411 3.821 20 5 EHBDHN Cc1cccnc1CCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602686571 1033066597 /nfs/dbraw/zinc/06/65/97/1033066597.db2.gz XMCXKPAKYMTTGH-UHFFFAOYSA-N 0 3 339.317 3.649 20 5 EHBDHN CCOC(=O)CCC1CCN([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000610996947 1023992654 /nfs/dbraw/zinc/99/26/54/1023992654.db2.gz OLHBDIGMWGEXPY-AWEZNQCLSA-N 0 3 334.416 3.711 20 5 EHBDHN CC(C)N(Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC(C)(C)C1 ZINC000449780548 1033207621 /nfs/dbraw/zinc/20/76/21/1033207621.db2.gz GKCHVDYTVLZQSO-UHFFFAOYSA-N 0 3 334.416 3.860 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1 ZINC000425549725 1025712318 /nfs/dbraw/zinc/71/23/18/1025712318.db2.gz LRHSEYNYDLUOEN-QZTJIDSGSA-N 0 3 346.814 3.599 20 5 EHBDHN COCCNc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000127107300 1026274125 /nfs/dbraw/zinc/27/41/25/1026274125.db2.gz ZLRRFOYRXVMOSR-OAHLLOKOSA-N 0 3 343.427 3.812 20 5 EHBDHN COc1cc(CN2CCCC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000127931898 1026641857 /nfs/dbraw/zinc/64/18/57/1026641857.db2.gz FWYBXYZVTUGNLL-UHFFFAOYSA-N 0 3 342.395 3.778 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN(Cc1ccccc1)CC1(CO)CC1 ZINC000342839576 1027575253 /nfs/dbraw/zinc/57/52/53/1027575253.db2.gz IOGOJTKUYKUXBX-UHFFFAOYSA-N 0 3 340.423 3.678 20 5 EHBDHN C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cnn(C)c1 ZINC000525183402 1029732712 /nfs/dbraw/zinc/73/27/12/1029732712.db2.gz IQFGEVVGWBAJGD-GFCCVEGCSA-N 0 3 342.424 3.908 20 5 EHBDHN Cc1c(-c2noc([C@H](C)N3[C@@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000453246156 1029972280 /nfs/dbraw/zinc/97/22/80/1029972280.db2.gz CRVLYZWHKXJQBY-GVXVVHGQSA-N 0 3 330.388 3.887 20 5 EHBDHN CCC[C@@H](NCc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000192911171 1030037162 /nfs/dbraw/zinc/03/71/62/1030037162.db2.gz NOKQVKPYKYYNQA-QGZVFWFLSA-N 0 3 342.395 3.997 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)[C@@H](C)C1CCCCC1 ZINC000447393665 1030161243 /nfs/dbraw/zinc/16/12/43/1030161243.db2.gz KHKKFINUKZPARO-AWEZNQCLSA-N 0 3 333.432 3.742 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(-n2ccnn2)cc1 ZINC000159865237 1030396317 /nfs/dbraw/zinc/39/63/17/1030396317.db2.gz LXZZZZREEDBHIW-KGLIPLIRSA-N 0 3 337.383 3.587 20 5 EHBDHN Cc1cccc([C@@H]2CCCN2CCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000159857408 1030398731 /nfs/dbraw/zinc/39/87/31/1030398731.db2.gz FTMJYEYWXIIASL-IBGZPJMESA-N 0 3 341.411 3.904 20 5 EHBDHN CCOc1ccc([C@H](C)NCCSC(F)(F)F)cc1[N+](=O)[O-] ZINC000179404330 1030808122 /nfs/dbraw/zinc/80/81/22/1030808122.db2.gz PMRLRTWXFNYXDG-VIFPVBQESA-N 0 3 338.351 3.897 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@@H](CCCO)c1ccccc1 ZINC000594495266 1033397788 /nfs/dbraw/zinc/39/77/88/1033397788.db2.gz PGAZEJVJZSRJQS-ZWKOTPCHSA-N 0 3 326.396 3.686 20 5 EHBDHN COC[C@H](C)Oc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000594925208 1033547261 /nfs/dbraw/zinc/54/72/61/1033547261.db2.gz MQHKISIOULAGEG-LSDHHAIUSA-N 0 3 344.411 3.859 20 5 EHBDHN CCS[C@@H]1CC[C@H](N(C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293216 1033575380 /nfs/dbraw/zinc/57/53/80/1033575380.db2.gz TUIYLQZGPKCQBV-DZGCQCFKSA-N 0 3 348.472 3.816 20 5 EHBDHN COc1cccc([C@@H](CN[C@H](C)c2ccc([N+](=O)[O-])cc2)OC)c1 ZINC000599061198 1033701281 /nfs/dbraw/zinc/70/12/81/1033701281.db2.gz LDFZZNHRJRCCIY-FZKQIMNGSA-N 0 3 330.384 3.642 20 5 EHBDHN CCCN(Cc1onc(C)c1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000595295167 1033721455 /nfs/dbraw/zinc/72/14/55/1033721455.db2.gz HJPDJXFRESIAMN-INIZCTEOSA-N 0 3 329.400 3.661 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCC3(CC3(F)F)CC2)c1 ZINC000593673927 1033721660 /nfs/dbraw/zinc/72/16/60/1033721660.db2.gz MUTPLCRCWRQSLZ-UHFFFAOYSA-N 0 3 348.296 3.817 20 5 EHBDHN COc1ccc([C@@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603843267 1033966249 /nfs/dbraw/zinc/96/62/49/1033966249.db2.gz LOIBNZDOXFXGMA-KRWDZBQOSA-N 0 3 342.395 3.819 20 5 EHBDHN CCOc1cc(CN2CCC[C@@H]([C@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787962 1033998204 /nfs/dbraw/zinc/99/82/04/1033998204.db2.gz LAZXWPQISLFDEP-SJLPKXTDSA-N 0 3 348.443 3.775 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]1Cc1ccc(F)cc1 ZINC000604016833 1034142424 /nfs/dbraw/zinc/14/24/24/1034142424.db2.gz GKVBZQAMYNJEND-KRWDZBQOSA-N 0 3 344.386 3.950 20 5 EHBDHN CC[C@@H](c1ccccc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000604508739 1034407315 /nfs/dbraw/zinc/40/73/15/1034407315.db2.gz RHDBXTSNFPZBNI-IBGZPJMESA-N 0 3 325.412 3.868 20 5 EHBDHN CCOc1ccccc1[C@@H](CC)NC[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000179742857 1034599231 /nfs/dbraw/zinc/59/92/31/1034599231.db2.gz GZICGVKRLXCMSS-MSOLQXFVSA-N 0 3 344.411 3.768 20 5 EHBDHN CC(C)c1ccc(CN2CCC([C@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000612402090 1034893513 /nfs/dbraw/zinc/89/35/13/1034893513.db2.gz HQIRUXLSTNPBFL-KRWDZBQOSA-N 0 3 332.444 3.967 20 5 EHBDHN C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)CCn1cc([N+](=O)[O-])cn1 ZINC000472440666 1035050360 /nfs/dbraw/zinc/05/03/60/1035050360.db2.gz RKIXTIRDPHMKCG-JTQLQIEISA-N 0 3 343.214 3.791 20 5 EHBDHN CCOc1cccc(NC[C@H](c2ccc(F)cc2)N(C)C)c1[N+](=O)[O-] ZINC000541551913 1036445370 /nfs/dbraw/zinc/44/53/70/1036445370.db2.gz SDGVRCIOSWGKPM-MRXNPFEDSA-N 0 3 347.390 3.847 20 5 EHBDHN Cc1ccccc1NC(=O)CCN[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271705489 1036958176 /nfs/dbraw/zinc/95/81/76/1036958176.db2.gz IFYPVMKCMYTHNT-AWEZNQCLSA-N 0 3 327.384 3.583 20 5 EHBDHN C[C@@]1(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO[C@H]1C1CC1 ZINC000542316383 1037282805 /nfs/dbraw/zinc/28/28/05/1037282805.db2.gz UHBSMFFDGTYYBX-RBUKOAKNSA-N 0 3 342.395 3.902 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](C)Oc1cccc(C)c1 ZINC000462730035 1037329151 /nfs/dbraw/zinc/32/91/51/1037329151.db2.gz FHFIESQXZSBNJT-OAHLLOKOSA-N 0 3 344.411 3.859 20 5 EHBDHN COc1ccc(CN[C@H]2c3cc(F)ccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000540173947 1037642064 /nfs/dbraw/zinc/64/20/64/1037642064.db2.gz NLMBMVKLTCKRAJ-BBATYDOGSA-N 0 3 330.359 3.766 20 5 EHBDHN Cc1cccc(C(C)(C)NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000179590061 1037853087 /nfs/dbraw/zinc/85/30/87/1037853087.db2.gz IVJIMBZEGYTLAP-UHFFFAOYSA-N 0 3 341.411 3.675 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc(CN3CCCC[C@@H]3C3CCC3)n2)cc1 ZINC000592198941 1037945300 /nfs/dbraw/zinc/94/53/00/1037945300.db2.gz MTWLXNQUWKXYPE-MRXNPFEDSA-N 0 3 342.399 3.799 20 5 EHBDHN C[C@H](NCCCCc1ccc([N+](=O)[O-])cc1)c1cc2n(n1)CCCC2 ZINC000592387710 1037954959 /nfs/dbraw/zinc/95/49/59/1037954959.db2.gz IMNGOBOOODONND-HNNXBMFYSA-N 0 3 342.443 3.801 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](c1cccs1)C1CC1 ZINC000540463544 1037964022 /nfs/dbraw/zinc/96/40/22/1037964022.db2.gz CQBDKJJVPVFHFI-KRWDZBQOSA-N 0 3 345.424 3.644 20 5 EHBDHN CC[C@@H](C)[C@H](C)N(Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000104967824 1038769396 /nfs/dbraw/zinc/76/93/96/1038769396.db2.gz FHEJZPQPHJFNCB-OLZOCXBDSA-N 0 3 334.416 3.860 20 5 EHBDHN CCN(CC)[C@H](CNc1c2c(ccc1[N+](=O)[O-])NCC2)c1ccco1 ZINC000436312021 1039680253 /nfs/dbraw/zinc/68/02/53/1039680253.db2.gz LTJSGTPKAABLIG-MRXNPFEDSA-N 0 3 344.415 3.651 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCc1nccs1 ZINC000290769922 1040684447 /nfs/dbraw/zinc/68/44/47/1040684447.db2.gz BBXCYVJQTXDOKY-UHFFFAOYSA-N 0 3 332.212 3.690 20 5 EHBDHN CC1(C)CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCC[C@H]21 ZINC000555721463 1041059883 /nfs/dbraw/zinc/05/98/83/1041059883.db2.gz REJPPJATMIELLI-CABCVRRESA-N 0 3 342.399 3.655 20 5 EHBDHN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2C)c(CN(C)C)c1 ZINC001126182179 1042443566 /nfs/dbraw/zinc/44/35/66/1042443566.db2.gz FLVIPETYARODIJ-UHFFFAOYSA-N 0 3 345.374 3.665 20 5 EHBDHN CN1CC[C@H](NCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000554957922 1128948972 /nfs/dbraw/zinc/94/89/72/1128948972.db2.gz GEXGWCMCZKGRGG-WMZOPIPTSA-N 0 3 345.830 3.783 20 5 EHBDHN O=[N+]([O-])c1ccc(NCCN2CCc3ccccc3C2)c2ncccc12 ZINC000301091585 1121583366 /nfs/dbraw/zinc/58/33/66/1121583366.db2.gz WGTXSINTIJAYTQ-UHFFFAOYSA-N 0 3 348.406 3.613 20 5 EHBDHN O=C(CCN(Cc1cccc([N+](=O)[O-])c1)C1CC1)Nc1ccccc1 ZINC000153314545 1121665792 /nfs/dbraw/zinc/66/57/92/1121665792.db2.gz AHBXGHNEAPFHML-UHFFFAOYSA-N 0 3 339.395 3.588 20 5 EHBDHN C[C@H]1CCCC[C@@H]1N(C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143294 1121783830 /nfs/dbraw/zinc/78/38/30/1121783830.db2.gz OXLCSTUULHJZSO-WFASDCNBSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H]1CCC[C@@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180158 1121797995 /nfs/dbraw/zinc/79/79/95/1121797995.db2.gz GNNJYBDKEINUEP-SWLSCSKDSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H]1CN(CCCCNc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000301737025 1129011012 /nfs/dbraw/zinc/01/10/12/1129011012.db2.gz VOPYQHSCVAQMPJ-STQMWFEESA-N 0 3 341.839 3.550 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1C[C@H](c2ccccc2)C[C@H]1C ZINC000609672666 1123641614 /nfs/dbraw/zinc/64/16/14/1123641614.db2.gz WAOXMCXHAVGYLV-GDBMZVCRSA-N 0 3 326.396 3.981 20 5 EHBDHN CCOc1ccccc1[C@H](CC)NC[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000179742844 1123845751 /nfs/dbraw/zinc/84/57/51/1123845751.db2.gz GZICGVKRLXCMSS-ROUUACIJSA-N 0 3 344.411 3.768 20 5 EHBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC[C@@H](c2cc[nH]n2)C1 ZINC000615836026 1123884376 /nfs/dbraw/zinc/88/43/76/1123884376.db2.gz HCDDJXOIXIMFDU-HFQYIWAZSA-N 0 3 326.400 3.601 20 5 EHBDHN Cc1cc(NC[C@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc2n1 ZINC000181523119 1124908545 /nfs/dbraw/zinc/90/85/45/1124908545.db2.gz NHXJIQACTKVSQI-OAHLLOKOSA-N 0 3 337.379 3.639 20 5 EHBDHN CC(C)[C@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1F ZINC000182157310 1125191953 /nfs/dbraw/zinc/19/19/53/1125191953.db2.gz GCVRFDNRCYSMHV-HNNXBMFYSA-N 0 3 340.786 3.571 20 5 EHBDHN CC(=O)Nc1ccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000080347156 1129347954 /nfs/dbraw/zinc/34/79/54/1129347954.db2.gz RNQCWYHSDQECGM-UHFFFAOYSA-N 0 3 327.384 3.578 20 5 EHBDHN Cc1c(NC(=O)[C@@H](C)N2CC[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247737 1129371112 /nfs/dbraw/zinc/37/11/12/1129371112.db2.gz HYTRUVCPMJZSAN-ZIAGYGMSSA-N 0 3 333.432 3.598 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)[C@@H](C)C1CCCCC1 ZINC000331316970 1129660679 /nfs/dbraw/zinc/66/06/79/1129660679.db2.gz APTDDDVUKPPNNC-AWEZNQCLSA-N 0 3 333.432 3.742 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](N[C@H]2CC[C@H](O)CC2)c2ccccc2)c1 ZINC000305787574 1129926648 /nfs/dbraw/zinc/92/66/48/1129926648.db2.gz AGISXRQMLBWLBP-WDSOQIARSA-N 0 3 326.396 3.577 20 5 EHBDHN C[C@@H](NCc1cccc(Cn2cccn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173340992 1130211169 /nfs/dbraw/zinc/21/11/69/1130211169.db2.gz NFJFQLXKXROLEO-OAHLLOKOSA-N 0 3 336.395 3.690 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@@H](N1CCCC(F)(F)[C@@H](F)C1)CC2 ZINC001172905334 1131886808 /nfs/dbraw/zinc/88/68/08/1131886808.db2.gz RFKALELCSMBZLM-HOCLYGCPSA-N 0 3 342.361 3.911 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H]1COc2ccc(Cl)cc21 ZINC001173226267 1132006548 /nfs/dbraw/zinc/00/65/48/1132006548.db2.gz WRXLIIRFLWUSLI-ZBEGNZNMSA-N 0 3 332.787 3.903 20 5 EHBDHN COCC[C@H]1CCCCN(Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000767940064 1133073774 /nfs/dbraw/zinc/07/37/74/1133073774.db2.gz DHCLZEZKMKUSKX-CYBMUJFWSA-N 0 3 326.824 3.887 20 5 EHBDHN CCc1cc(CN[C@H](CC)CSc2ccccc2[N+](=O)[O-])[nH]n1 ZINC000768104423 1133095471 /nfs/dbraw/zinc/09/54/71/1133095471.db2.gz KDAMLRKJGDGHEB-CYBMUJFWSA-N 0 3 334.445 3.541 20 5 EHBDHN Cc1ccc(CN2CCCC[C@H]2[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246254 1133250861 /nfs/dbraw/zinc/25/08/61/1133250861.db2.gz YOWMXNWIGUYFLE-AZUAARDMSA-N 0 3 340.423 3.991 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1n[nH]c(-c3ccccc3)n1)CCC2 ZINC000774313754 1133658739 /nfs/dbraw/zinc/65/87/39/1133658739.db2.gz KILHLOUMYMMOEF-KRWDZBQOSA-N 0 3 349.394 3.547 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1nc(-c3ccccc3)n[nH]1)CCC2 ZINC000774313754 1133658740 /nfs/dbraw/zinc/65/87/40/1133658740.db2.gz KILHLOUMYMMOEF-KRWDZBQOSA-N 0 3 349.394 3.547 20 5 EHBDHN CCN(C)Cc1cccc(CNc2ccc([N+](=O)[O-])cc2C(C)=O)c1 ZINC000786583054 1133870721 /nfs/dbraw/zinc/87/07/21/1133870721.db2.gz LJLGPEJKIXSDIG-UHFFFAOYSA-N 0 3 341.411 3.861 20 5 EHBDHN CC(C)(C)CCN1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC001184972409 1134009397 /nfs/dbraw/zinc/00/93/97/1134009397.db2.gz FJNWTPWFFMWLMP-UHFFFAOYSA-N 0 3 325.840 3.806 20 5 EHBDHN COc1ccccc1C[C@@H]1CCCN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788476060 1134129696 /nfs/dbraw/zinc/12/96/96/1134129696.db2.gz MULKWSVVIPFKMT-INIZCTEOSA-N 0 3 344.386 3.950 20 5 EHBDHN O=[N+]([O-])c1cc2c(cc1NCc1ccccc1-c1cccnc1)CNC2 ZINC001170114100 1134312398 /nfs/dbraw/zinc/31/23/98/1134312398.db2.gz AZEUWPWRTVUNFL-UHFFFAOYSA-N 0 3 346.390 3.872 20 5 EHBDHN CCCCO[C@H]1C[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(C)C ZINC001170118491 1134327052 /nfs/dbraw/zinc/32/70/52/1134327052.db2.gz QXANYTVPNYAAFJ-HOTGVXAUSA-N 0 3 346.431 3.545 20 5 EHBDHN C[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CCN1C1CCCC1 ZINC001187624172 1134357894 /nfs/dbraw/zinc/35/78/94/1134357894.db2.gz ASYOSGKBFHFGSC-GFCCVEGCSA-N 0 3 346.456 3.658 20 5 EHBDHN COc1ccc(C[C@H](C)N[C@@H](C)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC001170297602 1134737468 /nfs/dbraw/zinc/73/74/68/1134737468.db2.gz QPHNAKGPHUIHCJ-JQWIXIFHSA-N 0 3 335.429 3.650 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCC(C(F)F)CC2)c([N+](=O)[O-])c1 ZINC001170351665 1134760631 /nfs/dbraw/zinc/76/06/31/1134760631.db2.gz HAZSDBYGYQNYIT-LLVKDONJSA-N 0 3 328.359 3.512 20 5 EHBDHN CCC[C@@H](NCc1ccc([N+](=O)[O-])cc1F)[C@H](O)c1ccccc1 ZINC000793239056 1134885858 /nfs/dbraw/zinc/88/58/58/1134885858.db2.gz QJWPSNUTAPMPAD-QZTJIDSGSA-N 0 3 332.375 3.726 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1C[C@@H](OC(C)C)C1(C)C ZINC001201887868 1136070373 /nfs/dbraw/zinc/07/03/73/1136070373.db2.gz DGUPGSHSGKUGAR-DLBZAZTESA-N 0 3 336.432 3.675 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H](O)C1CCCCC1 ZINC000811477924 1136097148 /nfs/dbraw/zinc/09/71/48/1136097148.db2.gz ILJNTNNUKXKCAS-CQSZACIVSA-N 0 3 347.242 3.932 20 5 EHBDHN CN1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@H]1c1ccccc1 ZINC000776254065 1136104707 /nfs/dbraw/zinc/10/47/07/1136104707.db2.gz QYEVCQLEMUGIGX-QZTJIDSGSA-N 0 3 345.830 3.783 20 5 EHBDHN CC(C)(NC[C@@H]1CCC[C@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC001170650854 1136162065 /nfs/dbraw/zinc/16/20/65/1136162065.db2.gz QGPDLTATISZBJF-SMDDNHRTSA-N 0 3 346.349 3.920 20 5 EHBDHN CC(COC(=O)c1csc(-c2cccc3ccccc32)n1)[N+](=O)[O-] ZINC000813100240 1136287742 /nfs/dbraw/zinc/28/77/42/1136287742.db2.gz PSFKENRQKBPOCF-LLVKDONJSA-N 0 3 342.376 3.785 20 5 EHBDHN Cc1cc(C)c2nc(C3CC3)cc(C(=O)OCC(C)[N+](=O)[O-])c2c1 ZINC000813110958 1136294236 /nfs/dbraw/zinc/29/42/36/1136294236.db2.gz MVWWQJFQZFWDAL-GFCCVEGCSA-N 0 3 328.368 3.551 20 5 EHBDHN CC(COC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)[N+](=O)[O-] ZINC000813107357 1136294303 /nfs/dbraw/zinc/29/43/03/1136294303.db2.gz MNXYQDPXPZOJJZ-DJYGCBNOSA-N 0 3 335.356 3.776 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN(Cc2ccc(Cl)cc2)C2CC2)cc1 ZINC000776578051 1136443458 /nfs/dbraw/zinc/44/34/58/1136443458.db2.gz CSAZXMUZXYTHMR-SFHVURJKSA-N 0 3 346.814 3.946 20 5 EHBDHN CC1(C)CCC[C@]1(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816641196 1136743381 /nfs/dbraw/zinc/74/33/81/1136743381.db2.gz LBPLEUHLBTZYJV-HNNXBMFYSA-N 0 3 347.242 3.932 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCCc3c(F)cc(F)cc32)c1 ZINC000819333736 1136932185 /nfs/dbraw/zinc/93/21/85/1136932185.db2.gz REAOCOISQOVEML-MSOLQXFVSA-N 0 3 348.349 3.574 20 5 EHBDHN CC([C@@H](OC(=O)C[C@@H](C)c1ccco1)c1ccccc1F)[N+](=O)[O-] ZINC000860854566 1137081213 /nfs/dbraw/zinc/08/12/13/1137081213.db2.gz CUVQYCIIYGQGAY-PSTGCABASA-N 0 3 335.331 3.862 20 5 EHBDHN CC[C@H](COCC(F)(F)F)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000824554436 1137142723 /nfs/dbraw/zinc/14/27/23/1137142723.db2.gz GFQROAPFVZSPSQ-SNVBAGLBSA-N 0 3 340.729 3.695 20 5 EHBDHN CCc1nc(CN[C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])co1 ZINC000825057478 1137163884 /nfs/dbraw/zinc/16/38/84/1137163884.db2.gz PFEDLNFGUIUIQL-BBRMVZONSA-N 0 3 329.400 3.646 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CNC2(c3ccccc3Cl)CCC2)cc1 ZINC000844350517 1137214227 /nfs/dbraw/zinc/21/42/27/1137214227.db2.gz HBTVHXVDICBIDH-QGZVFWFLSA-N 0 3 346.814 3.951 20 5 EHBDHN CC([C@@H](OC(=O)[C@H](C)Oc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845872257 1137315822 /nfs/dbraw/zinc/31/58/22/1137315822.db2.gz FPRULOCMCAOKJD-GDZNZVCISA-N 0 3 347.342 3.543 20 5 EHBDHN Cc1ccccc1CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845872617 1137315857 /nfs/dbraw/zinc/31/58/57/1137315857.db2.gz KLLVTXJLGLUCCA-FZKQIMNGSA-N 0 3 331.343 3.626 20 5 EHBDHN CSc1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845878174 1137316523 /nfs/dbraw/zinc/31/65/23/1137316523.db2.gz UWVGZNWONADBQD-XPTSAGLGSA-N 0 3 339.344 3.704 20 5 EHBDHN CC(C)c1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])nc1 ZINC000845882681 1137316831 /nfs/dbraw/zinc/31/68/31/1137316831.db2.gz PQUUESMGLVHRMR-SJCJKPOMSA-N 0 3 346.358 3.907 20 5 EHBDHN CC([C@H](OC(=O)C[C@@H]1CCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845882191 1137317100 /nfs/dbraw/zinc/31/71/00/1137317100.db2.gz NWGRLZFAAXCCQI-ZETOZRRWSA-N 0 3 345.317 3.901 20 5 EHBDHN CN(Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCCC1 ZINC000877908669 1137695107 /nfs/dbraw/zinc/69/51/07/1137695107.db2.gz SWLJGVRTXNITLO-UHFFFAOYSA-N 0 3 330.388 3.799 20 5 EHBDHN CC(C)[C@H](C)N(C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877928033 1137695955 /nfs/dbraw/zinc/69/59/55/1137695955.db2.gz KVYOFSRPLBIKSI-JTQLQIEISA-N 0 3 338.795 3.775 20 5 EHBDHN CC(C)C[C@@H]1CCCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878020300 1137699881 /nfs/dbraw/zinc/69/98/81/1137699881.db2.gz NDCPKSFNIAWJOI-ZDUSSCGKSA-N 0 3 330.388 3.655 20 5 EHBDHN CC[C@@H]1CCCC[C@@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447453 1137716385 /nfs/dbraw/zinc/71/63/85/1137716385.db2.gz MUGSELXQRQAVPK-OCCSQVGLSA-N 0 3 330.388 3.703 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1nnc(CN2CC[C@H](C3CCCC3)C2)o1 ZINC000878720966 1137726202 /nfs/dbraw/zinc/72/62/02/1137726202.db2.gz RMORJGIZDKGSFJ-AWEZNQCLSA-N 0 3 342.399 3.657 20 5 EHBDHN C[C@@H]1CC[C@H](NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000119244919 1137939578 /nfs/dbraw/zinc/93/95/78/1137939578.db2.gz GXQJTLBXQIGZSW-JMSVASOKSA-N 0 3 330.388 3.559 20 5 EHBDHN CC[C@H](NCc1ccnc(N2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000131447657 1138518426 /nfs/dbraw/zinc/51/84/26/1138518426.db2.gz CPWCDIKZCJLAHW-SFHVURJKSA-N 0 3 340.427 3.831 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179500569 1139760965 /nfs/dbraw/zinc/76/09/65/1139760965.db2.gz FGHSMVRJFPVCSV-WFASDCNBSA-N 0 3 341.415 3.531 20 5 EHBDHN C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C ZINC000266899165 1140735875 /nfs/dbraw/zinc/73/58/75/1140735875.db2.gz TUAYBGRJDUQEGE-STQMWFEESA-N 0 3 339.395 3.526 20 5 EHBDHN CCC[C@H](NCc1ccc(N(C)C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000268766366 1140986803 /nfs/dbraw/zinc/98/68/03/1140986803.db2.gz NVMBYBQDVVTINK-KRWDZBQOSA-N 0 3 328.416 3.687 20 5 EHBDHN Cc1ccnc(NC[C@@H](c2cccs2)N2CCCC2)c1[N+](=O)[O-] ZINC000301269218 1125459881 /nfs/dbraw/zinc/45/98/81/1125459881.db2.gz HHHAKUJSMOBIPK-ZDUSSCGKSA-N 0 3 332.429 3.609 20 5 EHBDHN Cc1nc(CCNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)c(C)o1 ZINC000340194043 1016665511 /nfs/dbraw/zinc/66/55/11/1016665511.db2.gz HHLRCUALIQTQEB-UHFFFAOYSA-N 0 3 341.367 3.792 20 5 EHBDHN CCc1ccc(C(C)(C)NCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000538258812 1032254356 /nfs/dbraw/zinc/25/43/56/1032254356.db2.gz JYSGXMFQERZXTI-UHFFFAOYSA-N 0 3 341.411 3.621 20 5 EHBDHN COc1ccc(-c2ccc(CN3CCCSCC3)o2)c([N+](=O)[O-])c1 ZINC000508640813 1032413006 /nfs/dbraw/zinc/41/30/06/1032413006.db2.gz VLCLDJOYIHMJKT-UHFFFAOYSA-N 0 3 348.424 3.802 20 5 EHBDHN COc1cccc2c1C[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000459693040 1032418127 /nfs/dbraw/zinc/41/81/27/1032418127.db2.gz HFPIKBIHEJWGSF-CYBMUJFWSA-N 0 3 332.787 3.514 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCC2(CCC(O)CC2)CC1 ZINC000449369143 1032484710 /nfs/dbraw/zinc/48/47/10/1032484710.db2.gz QVWMNXNOOIKGFQ-UHFFFAOYSA-N 0 3 348.443 3.511 20 5 EHBDHN Cc1cc(C)cc([C@@H](C)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000537115609 1032527688 /nfs/dbraw/zinc/52/76/88/1032527688.db2.gz JJLYBMYQDDQGJM-HUUCEWRRSA-N 0 3 341.411 3.889 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(CCc2noc3ccccc32)C2CC2)c1 ZINC000593963692 1032644539 /nfs/dbraw/zinc/64/45/39/1032644539.db2.gz SOSHIEOWQDOCSA-UHFFFAOYSA-N 0 3 337.379 3.943 20 5 EHBDHN COc1cc(C)nc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000449504368 1032687589 /nfs/dbraw/zinc/68/75/89/1032687589.db2.gz VVKRQVCHBJSLLK-MRXNPFEDSA-N 0 3 341.411 3.686 20 5 EHBDHN COc1c([O-])ccc(C[NH2+][C@H](C)[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000893099337 1018470383 /nfs/dbraw/zinc/47/03/83/1018470383.db2.gz LPSCNUHECWEEGT-CHWSQXEVSA-N 0 3 330.384 3.591 20 5 EHBDHN CCN(CC)[C@H](CN[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000119109672 1019362037 /nfs/dbraw/zinc/36/20/37/1019362037.db2.gz BJBSHLLBVDYCGK-WMLDXEAASA-N 0 3 331.416 3.922 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@@H](n2ncc3ccccc32)C1 ZINC000513412989 1019643460 /nfs/dbraw/zinc/64/34/60/1019643460.db2.gz FQJGSDCNOXFQJS-GNJLHFKMSA-N 0 3 348.406 3.905 20 5 EHBDHN CCC[C@H](C)N(C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000048070682 1020059056 /nfs/dbraw/zinc/05/90/56/1020059056.db2.gz NERQALGUEKEALP-JTQLQIEISA-N 0 3 332.347 3.825 20 5 EHBDHN CN(Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCN(c2ccccc2)C1 ZINC000602440624 1032890239 /nfs/dbraw/zinc/89/02/39/1032890239.db2.gz QNHYCXNBOCGUQN-INIZCTEOSA-N 0 3 325.412 3.553 20 5 EHBDHN O=[N+]([O-])c1cc2ccccc2nc1N1CCN(C2CCCCC2)CC1 ZINC000473536149 1020590314 /nfs/dbraw/zinc/59/03/14/1020590314.db2.gz ZOUYNCWCLHMRJD-UHFFFAOYSA-N 0 3 340.427 3.598 20 5 EHBDHN CCOCCC1(CNCc2nc3cc([N+](=O)[O-])ccc3o2)CCCC1 ZINC000602565785 1032978522 /nfs/dbraw/zinc/97/85/22/1032978522.db2.gz GLNUBSBZANUIPO-UHFFFAOYSA-N 0 3 347.415 3.813 20 5 EHBDHN Cc1ccc(CN2CCC(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000506646278 1021634581 /nfs/dbraw/zinc/63/45/81/1021634581.db2.gz BLZNAROHALUDID-UHFFFAOYSA-N 0 3 326.396 3.988 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441295809 1022138722 /nfs/dbraw/zinc/13/87/22/1022138722.db2.gz UATQVSYPTUBEPB-JKSUJKDBSA-N 0 3 348.443 3.631 20 5 EHBDHN CN(C/C=C/c1ccccc1[N+](=O)[O-])CCOc1ccccc1F ZINC000506140911 1022176775 /nfs/dbraw/zinc/17/67/75/1022176775.db2.gz LMSANYKSWDPYEN-SOFGYWHQSA-N 0 3 330.359 3.758 20 5 EHBDHN COc1cccc([C@H](CNc2ccc([N+](=O)[O-])c(C)c2)N(C)C)c1 ZINC000058940584 1033080560 /nfs/dbraw/zinc/08/05/60/1033080560.db2.gz UTANRYRFHVJXRH-SFHVURJKSA-N 0 3 329.400 3.627 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000075740991 1033095115 /nfs/dbraw/zinc/09/51/15/1033095115.db2.gz UPNMSOQLMODUQD-LSDHHAIUSA-N 0 3 347.459 3.530 20 5 EHBDHN O=[N+]([O-])c1cccc(N2CCN(C[C@H]3CCCC(F)(F)C3)CC2)c1 ZINC000513973417 1024003842 /nfs/dbraw/zinc/00/38/42/1024003842.db2.gz WBEBOXIBZAOXLY-AWEZNQCLSA-N 0 3 339.386 3.542 20 5 EHBDHN CCS[C@H]1CCCC[C@H]1NCc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000469780080 1024007275 /nfs/dbraw/zinc/00/72/75/1024007275.db2.gz MMRFSTUITBHBJC-CJNGLKHVSA-N 0 3 342.436 3.896 20 5 EHBDHN CCC[C@H](C)NC(=O)[C@@H]1CCCN([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000441529661 1024039550 /nfs/dbraw/zinc/03/95/50/1024039550.db2.gz AHCIWVCVONQCCL-ARFHVFGLSA-N 0 3 347.459 3.673 20 5 EHBDHN COc1ccccc1C(C)(C)NCCOc1cccc([N+](=O)[O-])c1 ZINC000507783405 1024210971 /nfs/dbraw/zinc/21/09/71/1024210971.db2.gz BUINICHVOIFBFX-UHFFFAOYSA-N 0 3 330.384 3.507 20 5 EHBDHN CCOC(=O)C[C@@H](C)N(C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000346336820 1024659001 /nfs/dbraw/zinc/65/90/01/1024659001.db2.gz PQOGFGFSHPKIHY-CYBMUJFWSA-N 0 3 346.383 3.628 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CN[C@@H]3C[C@H]4CCC[C@@H]43)cs2)c1 ZINC000897952467 1033259209 /nfs/dbraw/zinc/25/92/09/1033259209.db2.gz GRIRILLYCPDBSO-XFBWCDHKSA-N 0 3 329.425 3.997 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](Cc2nccs2)C1 ZINC000934334246 1025506279 /nfs/dbraw/zinc/50/62/79/1025506279.db2.gz UIYFFZSXAPYMGB-ZIAGYGMSSA-N 0 3 331.441 3.985 20 5 EHBDHN COc1ccccc1[C@H](CNCc1cccc([N+](=O)[O-])c1)OC(C)C ZINC000185726846 1025700287 /nfs/dbraw/zinc/70/02/87/1025700287.db2.gz WQXKUFFFPWYSJZ-IBGZPJMESA-N 0 3 344.411 3.859 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C ZINC000451480215 1025997353 /nfs/dbraw/zinc/99/73/53/1025997353.db2.gz PQUIVNNTUQBODP-JQHSSLGASA-N 0 3 348.443 3.675 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@H]3CCCCO3)o2)c([N+](=O)[O-])c1 ZINC000237430378 1026230498 /nfs/dbraw/zinc/23/04/98/1026230498.db2.gz NBDKVIJRANBXJV-CQSZACIVSA-N 0 3 346.383 3.522 20 5 EHBDHN CCOc1ccc([C@@H](C)NCCOC2CCCCC2)cc1[N+](=O)[O-] ZINC000504911089 1029053620 /nfs/dbraw/zinc/05/36/20/1029053620.db2.gz AIQDUIBUTADNOJ-CQSZACIVSA-N 0 3 336.432 3.993 20 5 EHBDHN CCC[C@H]1[C@H](C)CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066367 1029237452 /nfs/dbraw/zinc/23/74/52/1029237452.db2.gz WSJVREGQZGKCNL-DYVFJYSZSA-N 0 3 334.416 3.862 20 5 EHBDHN C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cn[nH]c1 ZINC000533803614 1029850839 /nfs/dbraw/zinc/85/08/39/1029850839.db2.gz VHGBYLRZIVFFBQ-LLVKDONJSA-N 0 3 328.397 3.897 20 5 EHBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2NCc2ccccc2Cl)n1 ZINC000447522965 1030243791 /nfs/dbraw/zinc/24/37/91/1030243791.db2.gz ROJVTWQVKILMPV-CABCVRRESA-N 0 3 334.807 3.718 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCCc2ccc3c(c2)CCO3)c(Cl)c1 ZINC000482237185 1030280207 /nfs/dbraw/zinc/28/02/07/1030280207.db2.gz ANRAXYUZMFKKID-UHFFFAOYSA-N 0 3 346.814 3.906 20 5 EHBDHN C[C@@H](NC[C@@H](O)C(F)F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000484468943 1031587443 /nfs/dbraw/zinc/58/74/43/1031587443.db2.gz BWONYPJNWXYMHT-BXKDBHETSA-N 0 3 342.367 3.600 20 5 EHBDHN C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000594490672 1033395116 /nfs/dbraw/zinc/39/51/16/1033395116.db2.gz PFCFJCIYYQESEE-UGSOOPFHSA-N 0 3 349.394 3.514 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@@H]3COC(C)(C)C3)o2)c([N+](=O)[O-])c1 ZINC000594962799 1033603337 /nfs/dbraw/zinc/60/33/37/1033603337.db2.gz KGDNFEHEYRMVGY-LBPRGKRZSA-N 0 3 346.383 3.521 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC(C)(C)c1ccccn1 ZINC000595041460 1033660914 /nfs/dbraw/zinc/66/09/14/1033660914.db2.gz LTPQVRZKZPQNHA-CYBMUJFWSA-N 0 3 329.400 3.627 20 5 EHBDHN CCCOc1ccc2c(c1)CCN(CCc1ccc([N+](=O)[O-])cc1)C2 ZINC001168301955 1033675260 /nfs/dbraw/zinc/67/52/60/1033675260.db2.gz GQPZSDSQXOFUDV-UHFFFAOYSA-N 0 3 340.423 3.984 20 5 EHBDHN COCc1csc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000595075954 1033693924 /nfs/dbraw/zinc/69/39/24/1033693924.db2.gz CGSXPDWEEVFPKA-QGZVFWFLSA-N 0 3 332.425 3.970 20 5 EHBDHN COc1cccc(OC)c1CN[C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000595075794 1033694752 /nfs/dbraw/zinc/69/47/52/1033694752.db2.gz YVZPSVOVHIKPBZ-CQSZACIVSA-N 0 3 344.411 3.723 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000604016834 1034141608 /nfs/dbraw/zinc/14/16/08/1034141608.db2.gz GKVBZQAMYNJEND-QGZVFWFLSA-N 0 3 344.386 3.950 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC([C@@H]2CCCCO2)CC1 ZINC000597225013 1034625519 /nfs/dbraw/zinc/62/55/19/1034625519.db2.gz LOTZPSJAFNQSCE-WPGJWXSHSA-N 0 3 330.428 3.889 20 5 EHBDHN COc1ccccc1C1(CNCc2ccc([N+](=O)[O-])cc2F)CCC1 ZINC000612692095 1035167532 /nfs/dbraw/zinc/16/75/32/1035167532.db2.gz ROADZBUEEZICEM-UHFFFAOYSA-N 0 3 344.386 3.954 20 5 EHBDHN COc1ccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000581965939 1035659669 /nfs/dbraw/zinc/65/96/69/1035659669.db2.gz DUIJNBPMKTZCKB-UHFFFAOYSA-N 0 3 344.411 3.945 20 5 EHBDHN C[C@@H](c1ccccc1)[C@@H](CO)NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000613389346 1035719396 /nfs/dbraw/zinc/71/93/96/1035719396.db2.gz IQQQROXKKQNDTB-BLLLJJGKSA-N 0 3 334.803 3.502 20 5 EHBDHN C[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000026227444 1036400760 /nfs/dbraw/zinc/40/07/60/1036400760.db2.gz DZDUWKCDOAMESU-LBPRGKRZSA-N 0 3 347.802 3.928 20 5 EHBDHN CC[C@H](CCO)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180738893 1037133946 /nfs/dbraw/zinc/13/39/46/1037133946.db2.gz MHZBLGFFSLEZNF-BEFAXECRSA-N 0 3 328.412 3.682 20 5 EHBDHN CC(C)C[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000540341425 1037846427 /nfs/dbraw/zinc/84/64/27/1037846427.db2.gz KLJOLBAEGRXLNR-KRWDZBQOSA-N 0 3 341.411 3.910 20 5 EHBDHN CC(C)(C)O[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000592375753 1037923405 /nfs/dbraw/zinc/92/34/05/1037923405.db2.gz YTUZTSUNHZCVAT-BJHJDKERSA-N 0 3 344.358 3.632 20 5 EHBDHN C[C@H](NC1CC(OCc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000463385174 1038088387 /nfs/dbraw/zinc/08/83/87/1038088387.db2.gz AAPIMBPREPRLMO-OOHWJJMZSA-N 0 3 326.396 3.993 20 5 EHBDHN Cc1ccc(CN(CCCO)[C@@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000538731435 1038498115 /nfs/dbraw/zinc/49/81/15/1038498115.db2.gz KKOWYLPPPZNHNW-LJQANCHMSA-N 0 3 340.423 3.775 20 5 EHBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])CCCC(=O)OC(C)(C)C ZINC000538739942 1038504545 /nfs/dbraw/zinc/50/45/45/1038504545.db2.gz VWEJRKVYZNAICE-YFHOEESVSA-N 0 3 334.416 3.662 20 5 EHBDHN CC[C@H]1CCCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000042145535 1040023025 /nfs/dbraw/zinc/02/30/25/1040023025.db2.gz OEFKWKVBBIYNSF-STQMWFEESA-N 0 3 330.388 3.828 20 5 EHBDHN CN(CCSc1ncc(Cl)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000432927606 1040199156 /nfs/dbraw/zinc/19/91/56/1040199156.db2.gz NDKFGFTWEHBFGV-UHFFFAOYSA-N 0 3 337.832 3.867 20 5 EHBDHN CCCCC[C@H]1CCCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000486782287 1040442112 /nfs/dbraw/zinc/44/21/12/1040442112.db2.gz UJBUFUDKSBNXCH-INIZCTEOSA-N 0 3 333.432 3.602 20 5 EHBDHN CCC[C@H](C)[C@@H]1CCCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804449 1040471989 /nfs/dbraw/zinc/47/19/89/1040471989.db2.gz YQTBZWDQIKKDOP-GUYCJALGSA-N 0 3 333.432 3.742 20 5 EHBDHN COc1c(C)cc(CN(C)CCOc2ccccc2[N+](=O)[O-])cc1C ZINC000110296426 1040493782 /nfs/dbraw/zinc/49/37/82/1040493782.db2.gz RLFPGIMMFJMSCC-UHFFFAOYSA-N 0 3 344.411 3.731 20 5 EHBDHN CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCCC[C@@H]1O ZINC000555420384 1040557615 /nfs/dbraw/zinc/55/76/15/1040557615.db2.gz GXVWRWVKWOIUED-ABAIWWIYSA-N 0 3 346.349 3.597 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](N[C@@H]2CCN(C3CC3)C2)c2ccccc2)c1 ZINC000491022890 1040869363 /nfs/dbraw/zinc/86/93/63/1040869363.db2.gz QDAMCVZUECETNM-YLJYHZDGSA-N 0 3 337.423 3.511 20 5 EHBDHN CC(C)(C)OC(=O)CCN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433233879 1041121726 /nfs/dbraw/zinc/12/17/26/1041121726.db2.gz HYYHVUVZZZPDFH-HNNXBMFYSA-N 0 3 334.416 3.639 20 5 EHBDHN Cc1cnc([C@@H](C)CNCc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000893576983 1042734671 /nfs/dbraw/zinc/73/46/71/1042734671.db2.gz WEZCDXIERJYZOL-VIFPVBQESA-N 0 3 325.821 3.906 20 5 EHBDHN Cc1ccc([C@@H](O)CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000279029792 1043220651 /nfs/dbraw/zinc/22/06/51/1043220651.db2.gz IHPPRCYEJUXYNH-CVEARBPZSA-N 0 3 330.384 3.542 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nnc(CN3CCC[C@H]4CCCC[C@@H]43)o2)cc1 ZINC000072971114 1043373300 /nfs/dbraw/zinc/37/33/00/1043373300.db2.gz VNLBGXLWBNUKIC-CJNGLKHVSA-N 0 3 342.399 3.799 20 5 EHBDHN CCS[C@H]1CC[C@H](N(C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083214634 1127234357 /nfs/dbraw/zinc/23/43/57/1127234357.db2.gz SDHQLKUHSZJTOA-AAEUAGOBSA-N 0 3 335.429 3.842 20 5 EHBDHN CCS[C@H]1CC[C@H](N(C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039958 1127568699 /nfs/dbraw/zinc/56/86/99/1127568699.db2.gz USRGYCZPIAHOLJ-ZFWWWQNUSA-N 0 3 348.472 3.816 20 5 EHBDHN COc1cc(NC[C@H](c2ccco2)N2CCCCC2)ccc1[N+](=O)[O-] ZINC000301337537 1127738450 /nfs/dbraw/zinc/73/84/50/1127738450.db2.gz DPCYWWAQNWBDBB-MRXNPFEDSA-N 0 3 345.399 3.836 20 5 EHBDHN O=[N+]([O-])c1ccn(C2CCN([C@@H]3CCc4ccc(Cl)cc43)CC2)n1 ZINC000488968492 1128888678 /nfs/dbraw/zinc/88/86/78/1128888678.db2.gz ASFJMTBZWSILFG-MRXNPFEDSA-N 0 3 346.818 3.769 20 5 EHBDHN Cc1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c(CN(C)C)c1 ZINC000254951540 1128968243 /nfs/dbraw/zinc/96/82/43/1128968243.db2.gz AZLMYLIZWKASSB-XFFZJAGNSA-N 0 3 339.395 3.617 20 5 EHBDHN COc1cccc([C@@H](CNc2cc(C)c([N+](=O)[O-])cc2F)N(C)C)c1 ZINC000327847443 1129133722 /nfs/dbraw/zinc/13/37/22/1129133722.db2.gz QUUZFGVXJAOCFO-GOSISDBHSA-N 0 3 347.390 3.766 20 5 EHBDHN Cc1cc(C)cc([C@H](C)NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000182906866 1125391601 /nfs/dbraw/zinc/39/16/01/1125391601.db2.gz CGYQUBWQYYUVGF-HNNXBMFYSA-N 0 3 341.411 3.809 20 5 EHBDHN CC[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 ZINC000126050890 1129733076 /nfs/dbraw/zinc/73/30/76/1129733076.db2.gz HSDPIBDXZAEAOS-INIZCTEOSA-N 0 3 330.384 3.853 20 5 EHBDHN Cc1cc(NC[C@@H](C)CC2(C)OCCO2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302211973 1129773571 /nfs/dbraw/zinc/77/35/71/1129773571.db2.gz YWXVHLAKKUOTPN-LBPRGKRZSA-N 0 3 345.399 3.653 20 5 EHBDHN C[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245422068 1130202279 /nfs/dbraw/zinc/20/22/79/1130202279.db2.gz ILYCMPHIXDWONU-IFXJQAMLSA-N 0 3 339.395 3.616 20 5 EHBDHN Cc1nc([C@H](C)N[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cs1 ZINC001172899039 1131882823 /nfs/dbraw/zinc/88/28/23/1131882823.db2.gz LBNVLCVHHMRUCS-XHDPSFHLSA-N 0 3 331.441 3.958 20 5 EHBDHN Cc1ccc(N2CCN([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC001173224332 1132005133 /nfs/dbraw/zinc/00/51/33/1132005133.db2.gz DTBCUJJLDCHKJB-KRWDZBQOSA-N 0 3 339.439 3.656 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(C)[C@H](c2ccccc2)C1 ZINC001173227928 1132008330 /nfs/dbraw/zinc/00/83/30/1132008330.db2.gz SPMVACWSVHGVDQ-JXFKEZNVSA-N 0 3 339.439 3.515 20 5 EHBDHN CC(C)C[C@@H](N)c1nc2ccccc2n1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168990238 1132634670 /nfs/dbraw/zinc/63/46/70/1132634670.db2.gz YUOIIIBSAMEHOZ-SOUVJXGZSA-N 0 3 330.432 3.700 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H](O)c3ccccc3)o2)cc1 ZINC001177117477 1133029229 /nfs/dbraw/zinc/02/92/29/1133029229.db2.gz WOCLFXHOLCUWMF-GOSISDBHSA-N 0 3 338.363 3.678 20 5 EHBDHN CCN(CC)[C@@H](CNCc1cccc([N+](=O)[O-])c1C)c1ccco1 ZINC001177554216 1133075289 /nfs/dbraw/zinc/07/52/89/1133075289.db2.gz QECFLXCRQBFVTF-KRWDZBQOSA-N 0 3 331.416 3.669 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CCNCc1ccncc1Cl ZINC001178327027 1133159992 /nfs/dbraw/zinc/15/99/92/1133159992.db2.gz VUNRGAGNHKHBQI-UHFFFAOYSA-N 0 3 326.183 3.629 20 5 EHBDHN O=C(OCc1ccccc1[N+](=O)[O-])c1cccc(CN2CCCC2)c1 ZINC000785712750 1133746719 /nfs/dbraw/zinc/74/67/19/1133746719.db2.gz DVVRXKRZYZGVBW-UHFFFAOYSA-N 0 3 340.379 3.548 20 5 EHBDHN CCS[C@@H]1CCCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879226 1134810937 /nfs/dbraw/zinc/81/09/37/1134810937.db2.gz GPKSEPOWJBUJNU-DZGCQCFKSA-N 0 3 339.417 3.657 20 5 EHBDHN C[C@H](CN(Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000805820336 1135336832 /nfs/dbraw/zinc/33/68/32/1135336832.db2.gz KXSWGQJAYVUOAY-CABCVRRESA-N 0 3 346.402 3.720 20 5 EHBDHN C[C@@]1(NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@H]1C1CC1 ZINC000809975086 1135907938 /nfs/dbraw/zinc/90/79/38/1135907938.db2.gz WBLBBOCRVJDJNN-LSDHHAIUSA-N 0 3 345.226 3.949 20 5 EHBDHN CC(C)C1(CNCc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC001200891179 1135964290 /nfs/dbraw/zinc/96/42/90/1135964290.db2.gz JXQLXYGXSDFEST-UHFFFAOYSA-N 0 3 327.222 3.883 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC[C@H]1CCCCO1 ZINC000811488837 1136093045 /nfs/dbraw/zinc/09/30/45/1136093045.db2.gz NEKWEQZQAXJEEO-GFCCVEGCSA-N 0 3 333.215 3.950 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000776276944 1136130593 /nfs/dbraw/zinc/13/05/93/1136130593.db2.gz LXKCYTDSODXMBI-ROUUACIJSA-N 0 3 330.359 3.604 20 5 EHBDHN CC(COC(=O)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1)[N+](=O)[O-] ZINC000813104015 1136288233 /nfs/dbraw/zinc/28/82/33/1136288233.db2.gz WHKYUKHIAJPRJF-AGIUHOORSA-N 0 3 346.408 3.555 20 5 EHBDHN CC(COC(=O)CSc1cccc2cccc(Cl)c21)[N+](=O)[O-] ZINC000813105655 1136288846 /nfs/dbraw/zinc/28/88/46/1136288846.db2.gz RGWGULGEFPKIJH-SNVBAGLBSA-N 0 3 339.800 3.794 20 5 EHBDHN CN(Cc1ccc(Cl)c(F)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597186 1136457786 /nfs/dbraw/zinc/45/77/86/1136457786.db2.gz HUDNGQVMXAIFMK-MRXNPFEDSA-N 0 3 338.766 3.553 20 5 EHBDHN C[C@H](NC[C@H]1COC2(CCCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776741653 1136617610 /nfs/dbraw/zinc/61/76/10/1136617610.db2.gz WKBSWZTXHPAWDV-YOEHRIQHSA-N 0 3 334.416 3.711 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H]1C[C@H]1c1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000860855114 1137081367 /nfs/dbraw/zinc/08/13/67/1137081367.db2.gz RKZIDUDXHVRFPP-FDKDBAQKSA-N 0 3 349.383 3.940 20 5 EHBDHN CC([C@H](OC(=O)C[C@@H](C)c1ccco1)c1ccccc1F)[N+](=O)[O-] ZINC000860854567 1137081373 /nfs/dbraw/zinc/08/13/73/1137081373.db2.gz CUVQYCIIYGQGAY-QFSBIZTOSA-N 0 3 335.331 3.862 20 5 EHBDHN Cc1ccc(CCC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845873391 1137316048 /nfs/dbraw/zinc/31/60/48/1137316048.db2.gz CXMUUOIHUXHXRM-SJKOYZFVSA-N 0 3 335.331 3.609 20 5 EHBDHN CCCCSCC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845873239 1137316095 /nfs/dbraw/zinc/31/60/95/1137316095.db2.gz CBJCNWNINJMKEJ-XHDPSFHLSA-N 0 3 329.393 3.609 20 5 EHBDHN CC(C)n1cccc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845873967 1137316178 /nfs/dbraw/zinc/31/61/78/1137316178.db2.gz FPCAKRQJNQYRFR-LRDDRELGSA-N 0 3 334.347 3.771 20 5 EHBDHN C[C@H](NCc1ccc(C2(C)OCCO2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000866421711 1137353360 /nfs/dbraw/zinc/35/33/60/1137353360.db2.gz XSFDIQHXJWAHAD-AWEZNQCLSA-N 0 3 342.395 3.665 20 5 EHBDHN COCCOc1ccc(CNCc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000873012748 1137588040 /nfs/dbraw/zinc/58/80/40/1137588040.db2.gz WXMHAJKCIVQFRG-UHFFFAOYSA-N 0 3 344.411 3.527 20 5 EHBDHN CC(C)(O)C1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000877754091 1137688037 /nfs/dbraw/zinc/68/80/37/1137688037.db2.gz VWPQVRPPRYAVJA-UHFFFAOYSA-N 0 3 344.411 3.838 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000877804830 1137690444 /nfs/dbraw/zinc/69/04/44/1137690444.db2.gz FAPDISZVZOJNPL-VZJVUDMVSA-N 0 3 344.333 3.661 20 5 EHBDHN CCC(CC)CN(CC)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000877960181 1137697138 /nfs/dbraw/zinc/69/71/38/1137697138.db2.gz HJNNZUDLDNFBGJ-UHFFFAOYSA-N 0 3 332.404 3.903 20 5 EHBDHN C[C@@H](NC(C)(C)c1cccs1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000348319322 1137949118 /nfs/dbraw/zinc/94/91/18/1137949118.db2.gz LDLNCMQRTFFKIS-LLVKDONJSA-N 0 3 333.413 3.508 20 5 EHBDHN CCN(CCN[C@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000301643157 1138612005 /nfs/dbraw/zinc/61/20/05/1138612005.db2.gz NJTPRPBDWPOEPA-CYBMUJFWSA-N 0 3 337.420 3.502 20 5 EHBDHN Cc1c([C@H](C)NC[C@H]2COC3(CCC(C)CC3)O2)cccc1[N+](=O)[O-] ZINC000777311277 1139566350 /nfs/dbraw/zinc/56/63/50/1139566350.db2.gz AYOJDMNMENZCKH-ZAKOAHRUSA-N 0 3 348.443 3.876 20 5 EHBDHN C[C@H](NC[C@@H]1COC2(CCC(C)CC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777314757 1139584729 /nfs/dbraw/zinc/58/47/29/1139584729.db2.gz WEIPAKFDUHJCKM-VLNFIEOWSA-N 0 3 334.416 3.567 20 5 EHBDHN CN(C)[C@@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccccc1 ZINC000097466709 219026089 /nfs/dbraw/zinc/02/60/89/219026089.db2.gz ZITYVUMSOWUFGH-SFHVURJKSA-N 0 3 336.395 3.858 20 5 EHBDHN C[C@H]1CCCC[C@@]1(C)NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000459615520 1032353106 /nfs/dbraw/zinc/35/31/06/1032353106.db2.gz PEABAZIOVPVEOP-YVEFUNNKSA-N 0 3 330.388 3.703 20 5 EHBDHN CC(COC(=O)[C@@H](C)Sc1cc(Cl)ccc1Cl)[N+](=O)[O-] ZINC000813109770 1017239516 /nfs/dbraw/zinc/23/95/16/1017239516.db2.gz OKJBRONJRWXFSC-JGVFFNPUSA-N 0 3 338.212 3.682 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548010022 1018197977 /nfs/dbraw/zinc/19/79/77/1018197977.db2.gz BSXIIFICMOXOGP-WMLDXEAASA-N 0 3 340.427 3.678 20 5 EHBDHN CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCCCC1 ZINC000052331329 1018927520 /nfs/dbraw/zinc/92/75/20/1018927520.db2.gz ZDODXTZOVNWDNN-UHFFFAOYSA-N 0 3 330.388 3.799 20 5 EHBDHN Cc1cnn(CCCCCN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135219569 1020904181 /nfs/dbraw/zinc/90/41/81/1020904181.db2.gz RKCHYCLONPNUKZ-UHFFFAOYSA-N 0 3 342.443 3.935 20 5 EHBDHN CO[C@@H]([C@@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000449633534 1032967005 /nfs/dbraw/zinc/96/70/05/1032967005.db2.gz ULVVFSATIJVLKE-XIKOKIGWSA-N 0 3 330.384 3.758 20 5 EHBDHN COc1ccc2c(c1)CCN(Cc1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000439788477 1021717699 /nfs/dbraw/zinc/71/76/99/1021717699.db2.gz WJQKPHMLEWKTIH-UHFFFAOYSA-N 0 3 326.396 3.513 20 5 EHBDHN C[C@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000090920827 1021819892 /nfs/dbraw/zinc/81/98/92/1021819892.db2.gz BWEJWJDXYGWFEP-MGPLVRAMSA-N 0 3 338.766 3.772 20 5 EHBDHN C[C@@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000090936242 1021949266 /nfs/dbraw/zinc/94/92/66/1021949266.db2.gz SGGMYLMGKVJXLQ-QLJPJBMISA-N 0 3 338.766 3.772 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC[C@@]1(CO)C[C@@H]1c1ccccc1 ZINC000894535306 1022497441 /nfs/dbraw/zinc/49/74/41/1022497441.db2.gz BNKCJQKMKZIDHH-SJLPKXTDSA-N 0 3 346.814 3.504 20 5 EHBDHN CCOC(=O)CCC1CCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000610997466 1024018400 /nfs/dbraw/zinc/01/84/00/1024018400.db2.gz TTZIOQFXLQUOMW-AWEZNQCLSA-N 0 3 334.416 3.711 20 5 EHBDHN Cc1ccc(CN2CC3(CCC3)[C@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000425368573 1024882904 /nfs/dbraw/zinc/88/29/04/1024882904.db2.gz FDTPUMWNZKDBSX-GOSISDBHSA-N 0 3 330.428 3.684 20 5 EHBDHN CCC1CCC(N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000444026936 1025187677 /nfs/dbraw/zinc/18/76/77/1025187677.db2.gz ADIMLZJDWIAJKS-UHFFFAOYSA-N 0 3 333.432 3.742 20 5 EHBDHN COC[C@H](Cc1ccccc1)N(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000475141482 1026234643 /nfs/dbraw/zinc/23/46/43/1026234643.db2.gz WCQGTNDXSBZOFG-ICEKFOEVSA-N 0 3 340.423 3.798 20 5 EHBDHN Cc1cccc([C@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000452074974 1026464344 /nfs/dbraw/zinc/46/43/44/1026464344.db2.gz BKEKHZNAJPECQP-UONOGXRCSA-N 0 3 327.384 3.581 20 5 EHBDHN C[C@H](NCc1ccc(Cn2cccn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178642374 1026998545 /nfs/dbraw/zinc/99/85/45/1026998545.db2.gz IHQRABPFXINXCM-HNNXBMFYSA-N 0 3 336.395 3.690 20 5 EHBDHN C[C@@H]1CCCC[C@@H]1OCCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783597568 1027600600 /nfs/dbraw/zinc/60/06/00/1027600600.db2.gz TWHRJGOLANLOIW-WBMJQRKESA-N 0 3 326.824 3.933 20 5 EHBDHN O=[N+]([O-])c1cnn(CCN(Cc2ccccc2F)C2CCCCC2)c1 ZINC000472257224 1027619837 /nfs/dbraw/zinc/61/98/37/1027619837.db2.gz MEHSKJNNKQDTSW-UHFFFAOYSA-N 0 3 346.406 3.765 20 5 EHBDHN COc1ccc([C@@H]2CCN(Cc3cc([N+](=O)[O-])ccc3OC)C2)cc1 ZINC000504521290 1028709492 /nfs/dbraw/zinc/70/94/92/1028709492.db2.gz KECRQWJUEYAWFG-OAHLLOKOSA-N 0 3 342.395 3.602 20 5 EHBDHN Nc1ccc2c(c1)CCC[C@@H]2NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000841059219 1029716840 /nfs/dbraw/zinc/71/68/40/1029716840.db2.gz NKXIQNYIEXCQFD-INIZCTEOSA-N 0 3 331.803 3.998 20 5 EHBDHN Cc1ccc(CNC2(c3ccccc3)CCOCC2)cc1[N+](=O)[O-] ZINC000525183425 1029732346 /nfs/dbraw/zinc/73/23/46/1029732346.db2.gz KPQPPTPHDCULTJ-UHFFFAOYSA-N 0 3 326.396 3.699 20 5 EHBDHN CN(C)c1cccc(CN(C)C/C=C\c2ccccc2[N+](=O)[O-])c1 ZINC000537659799 1030914759 /nfs/dbraw/zinc/91/47/59/1030914759.db2.gz RHTRPGLZJITJGS-YFHOEESVSA-N 0 3 325.412 3.806 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CO[C@@H](C3CC3)C2)o1 ZINC000599006855 1033641993 /nfs/dbraw/zinc/64/19/93/1033641993.db2.gz LNXHIIRFKQMHOX-FZKQIMNGSA-N 0 3 328.368 3.512 20 5 EHBDHN C[C@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCCCO1 ZINC000599044667 1033673159 /nfs/dbraw/zinc/67/31/59/1033673159.db2.gz RYDJUNZYWTUKPW-HZMBPMFUSA-N 0 3 332.322 3.661 20 5 EHBDHN C[C@@H](COCC1CC1)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000593682580 1033753392 /nfs/dbraw/zinc/75/33/92/1033753392.db2.gz WEYFWKKHPRRIDQ-ZDUSSCGKSA-N 0 3 330.384 3.760 20 5 EHBDHN C[C@@H](CCO)N(C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000593694702 1033804145 /nfs/dbraw/zinc/80/41/45/1033804145.db2.gz QGXVPDLDYFUOPN-ZDUSSCGKSA-N 0 3 348.374 3.729 20 5 EHBDHN C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCCC2 ZINC000179424323 1034296975 /nfs/dbraw/zinc/29/69/75/1034296975.db2.gz MIYYSKNJWVPKIO-GFCCVEGCSA-N 0 3 331.441 3.823 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000612593289 1035084211 /nfs/dbraw/zinc/08/42/11/1035084211.db2.gz ZMXSRVXWQQCWNQ-CRAIPNDOSA-N 0 3 348.349 3.883 20 5 EHBDHN Cc1noc(CN2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)c1[N+](=O)[O-] ZINC000595489384 1035848262 /nfs/dbraw/zinc/84/82/62/1035848262.db2.gz ABBHJUKMPPXTFV-XHSDSOJGSA-N 0 3 327.384 3.659 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@@H]2CCCOc3cc(F)ccc32)cc1 ZINC000540990518 1035886815 /nfs/dbraw/zinc/88/68/15/1035886815.db2.gz RHRWNOMWNZXUBH-QGZVFWFLSA-N 0 3 346.358 3.616 20 5 EHBDHN CCOc1cccc(N[C@@H]2CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000310831178 1036912847 /nfs/dbraw/zinc/91/28/47/1036912847.db2.gz YXIIDBRCVPPYJT-MRXNPFEDSA-N 0 3 341.411 3.680 20 5 EHBDHN CC[C@H]1CCCC[C@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000163411163 1037393447 /nfs/dbraw/zinc/39/34/47/1037393447.db2.gz XTSAZFUQMBCSMZ-SWLSCSKDSA-N 0 3 330.388 3.703 20 5 EHBDHN CO[C@@H]1CCC[C@H]1CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000540328654 1037825354 /nfs/dbraw/zinc/82/53/54/1037825354.db2.gz OWBCTZQYDFUUMM-XJKSGUPXSA-N 0 3 347.440 3.623 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN(Cc1ccccc1)[C@H]1CC[C@H](O)CC1 ZINC000592130700 1037841171 /nfs/dbraw/zinc/84/11/71/1037841171.db2.gz JLTWMJJZJAELLK-WGSAOQKQSA-N 0 3 340.423 3.901 20 5 EHBDHN CC[C@@H](C)[C@@H](C)N(Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000104967820 1038768898 /nfs/dbraw/zinc/76/88/98/1038768898.db2.gz FHEJZPQPHJFNCB-CHWSQXEVSA-N 0 3 334.416 3.860 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1cccc(CO)c1)CCCC2 ZINC000417312693 1039665626 /nfs/dbraw/zinc/66/56/26/1039665626.db2.gz ODTDKRMNAVTYNW-LJQANCHMSA-N 0 3 326.396 3.644 20 5 EHBDHN Cc1ccc(Sc2ccc(CN(C)[C@@H](C)CO)cc2[N+](=O)[O-])cc1 ZINC000554883841 1039906897 /nfs/dbraw/zinc/90/68/97/1039906897.db2.gz CBQBIHZRHARFPP-AWEZNQCLSA-N 0 3 346.452 3.867 20 5 EHBDHN CCOc1cc(NC[C@@H](c2cccc(F)c2)N(C)C)ccc1[N+](=O)[O-] ZINC000486449156 1040145815 /nfs/dbraw/zinc/14/58/15/1040145815.db2.gz IMBXQKSVBHFBAK-KRWDZBQOSA-N 0 3 347.390 3.847 20 5 EHBDHN CC(C)C[C@H]1OCCC[C@H]1NCc1ccc([N+](=O)[O-])cc1Cl ZINC000479581132 1040403180 /nfs/dbraw/zinc/40/31/80/1040403180.db2.gz RGBALOZMLPGJPE-HZPDHXFCSA-N 0 3 326.824 3.932 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H](CCOC)C1 ZINC000467269246 1040514150 /nfs/dbraw/zinc/51/41/50/1040514150.db2.gz RHINOVZMEKOZAZ-HNNXBMFYSA-N 0 3 336.432 3.632 20 5 EHBDHN COc1cc(CN2CCC[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000433074285 1040642889 /nfs/dbraw/zinc/64/28/89/1040642889.db2.gz HYOVZUYDEAEDIM-QGZVFWFLSA-N 0 3 326.396 3.983 20 5 EHBDHN CC[C@H]1[C@H](C)CCN1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371478 1040791995 /nfs/dbraw/zinc/79/19/95/1040791995.db2.gz MXYURLXIVJSOIU-PWSUYJOCSA-N 0 3 344.358 3.825 20 5 EHBDHN CC(=O)c1ccc(N[C@@H](C)CN2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000511711000 1041474234 /nfs/dbraw/zinc/47/42/34/1041474234.db2.gz CHYNDCFCJONRGN-MJBXVCDLSA-N 0 3 333.432 3.576 20 5 EHBDHN Cc1ccc(Sc2ccc(CNC[C@@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000120374286 1042772262 /nfs/dbraw/zinc/77/22/62/1042772262.db2.gz NFPBVMLHPWXHLB-CYBMUJFWSA-N 0 3 332.425 3.525 20 5 EHBDHN COc1ccc(CN[C@@H]2CCCC[C@@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000106466637 1042986153 /nfs/dbraw/zinc/98/61/53/1042986153.db2.gz DVEYXKKGQPIXNV-NWDGAFQWSA-N 0 3 332.322 3.814 20 5 EHBDHN C[C@@H](CN(C)Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000083170488 1127225187 /nfs/dbraw/zinc/22/51/87/1127225187.db2.gz CAKPTOIUDWLGCA-ZDUSSCGKSA-N 0 3 325.368 3.972 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@H]2CCN2Cc2ccccc2)c2ccncc21 ZINC000715711904 1128810360 /nfs/dbraw/zinc/81/03/60/1128810360.db2.gz KYWVJRXURMAUFF-MRXNPFEDSA-N 0 3 348.406 3.829 20 5 EHBDHN Cc1ccc(CN[C@@H](CN(C)C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000554938854 1128888354 /nfs/dbraw/zinc/88/83/54/1128888354.db2.gz YPVLMEHAQIKDBJ-KRWDZBQOSA-N 0 3 347.846 3.949 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H](c1cccs1)C1CC1 ZINC000542511477 1120865781 /nfs/dbraw/zinc/86/57/81/1120865781.db2.gz RFDFIGGJFFMSBZ-QGZVFWFLSA-N 0 3 345.424 3.644 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@@H]2/C=C\c2ccccc2)cc1 ZINC000780400262 1121575412 /nfs/dbraw/zinc/57/54/12/1121575412.db2.gz UQZPVQNKRTVKJO-NCJCTJFTSA-N 0 3 338.407 3.806 20 5 EHBDHN COCCOc1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000154079002 1122211005 /nfs/dbraw/zinc/21/10/05/1122211005.db2.gz OBMJVTCQOBWGMX-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN CCC(CC)CN(CC)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917454505 1122610909 /nfs/dbraw/zinc/61/09/09/1122610909.db2.gz PXXXQDUWMPBHPM-UHFFFAOYSA-N 0 3 331.420 3.569 20 5 EHBDHN Cc1ccc([C@@H](C)NCCC(=O)Nc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000181815292 1125048670 /nfs/dbraw/zinc/04/86/70/1125048670.db2.gz ORJFHJBKNJGWIL-CYBMUJFWSA-N 0 3 345.374 3.722 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCC1 ZINC000182933151 1125397086 /nfs/dbraw/zinc/39/70/86/1125397086.db2.gz WCHZJMQDDGBQHU-LBPRGKRZSA-N 0 3 330.388 3.703 20 5 EHBDHN CCOc1cccc(NC[C@@H](c2cccs2)N(C)C)c1[N+](=O)[O-] ZINC000183135175 1125453562 /nfs/dbraw/zinc/45/35/62/1125453562.db2.gz OWEDYPDYULTHII-ZDUSSCGKSA-N 0 3 335.429 3.770 20 5 EHBDHN CSc1ccc([C@@H](CNc2nccc(C)c2[N+](=O)[O-])N(C)C)cc1 ZINC000338834816 1129397958 /nfs/dbraw/zinc/39/79/58/1129397958.db2.gz FHKBSUDHOUAMOA-OAHLLOKOSA-N 0 3 346.456 3.735 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](C2CCOCC2)C1 ZINC000330447106 1129637709 /nfs/dbraw/zinc/63/77/09/1129637709.db2.gz HTDXEZHURAWAKY-MRXNPFEDSA-N 0 3 348.443 3.631 20 5 EHBDHN O=[N+]([O-])c1cncc(Cl)c1NC1CCN(Cc2ccccc2)CC1 ZINC000306114693 1129932504 /nfs/dbraw/zinc/93/25/04/1129932504.db2.gz YCEKBCRBHULQQO-UHFFFAOYSA-N 0 3 346.818 3.720 20 5 EHBDHN C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245422067 1130202859 /nfs/dbraw/zinc/20/28/59/1130202859.db2.gz ILYCMPHIXDWONU-AUUYWEPGSA-N 0 3 339.395 3.616 20 5 EHBDHN C[C@@H](O)CC(C)(C)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174464460 1130360484 /nfs/dbraw/zinc/36/04/84/1130360484.db2.gz AKFVXSHQKICFFV-GFCCVEGCSA-N 0 3 349.456 3.605 20 5 EHBDHN CCC[C@H]1[C@H](C)CCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381101 1131915016 /nfs/dbraw/zinc/91/50/16/1131915016.db2.gz VZVFOFQIPWOCED-PBHICJAKSA-N 0 3 343.431 3.711 20 5 EHBDHN CC[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1cc(C)ccc1C ZINC001175362167 1132650089 /nfs/dbraw/zinc/65/00/89/1132650089.db2.gz RKRKEOPDAUUNEW-MRXNPFEDSA-N 0 3 341.411 3.891 20 5 EHBDHN C[C@@H](CCc1ccccc1[N+](=O)[O-])NCc1noc2cc(F)ccc12 ZINC001183481177 1133812492 /nfs/dbraw/zinc/81/24/92/1133812492.db2.gz FDEFQFSFQOUVNI-LBPRGKRZSA-N 0 3 343.358 3.986 20 5 EHBDHN CO[C@@H](CN[C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000788670163 1134159941 /nfs/dbraw/zinc/15/99/41/1134159941.db2.gz SQFUMQBDUUGQIR-DIFFPNOSSA-N 0 3 349.818 3.869 20 5 EHBDHN CC(C)C[C@@]1(CO)CCCN1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789501755 1134286278 /nfs/dbraw/zinc/28/62/78/1134286278.db2.gz CZFJCCGIFIETIA-MRXNPFEDSA-N 0 3 326.824 3.621 20 5 EHBDHN CC(C)O[C@H]1C[C@H](NCc2cc(Cl)ccc2[N+](=O)[O-])C1(C)C ZINC001194457535 1135270544 /nfs/dbraw/zinc/27/05/44/1135270544.db2.gz NVYPKEHUIDKLNS-GJZGRUSLSA-N 0 3 326.824 3.930 20 5 EHBDHN C[C@@](CO)(NCc1cc(Cl)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000747529480 1135742447 /nfs/dbraw/zinc/74/24/47/1135742447.db2.gz DNBYUKCMODMRON-INIZCTEOSA-N 0 3 326.824 3.669 20 5 EHBDHN C[C@@H]1CC=CC[C@H]1NCc1cc([N+](=O)[O-])ccc1Br ZINC001198604936 1135837049 /nfs/dbraw/zinc/83/70/49/1135837049.db2.gz VJPJTRIOWRYFCC-QMTHXVAHSA-N 0 3 325.206 3.802 20 5 EHBDHN C[C@]1(NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@H]1C1CC1 ZINC000809975084 1135908000 /nfs/dbraw/zinc/90/80/00/1135908000.db2.gz WBLBBOCRVJDJNN-GJZGRUSLSA-N 0 3 345.226 3.949 20 5 EHBDHN CC1(O)CCC(NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000811482667 1136092153 /nfs/dbraw/zinc/09/21/53/1136092153.db2.gz NYLREJHLNLBUDF-UHFFFAOYSA-N 0 3 333.215 3.685 20 5 EHBDHN Cc1cccc2c1OC[C@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)C2 ZINC000811518394 1136098408 /nfs/dbraw/zinc/09/84/08/1136098408.db2.gz MQJXFMPTCOVTNG-CQSZACIVSA-N 0 3 332.787 3.650 20 5 EHBDHN CC(COC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)[N+](=O)[O-] ZINC000813107359 1136293916 /nfs/dbraw/zinc/29/39/16/1136293916.db2.gz MNXYQDPXPZOJJZ-DVBBHNHCSA-N 0 3 335.356 3.776 20 5 EHBDHN CC(COC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[N+](=O)[O-] ZINC000813105309 1136294225 /nfs/dbraw/zinc/29/42/25/1136294225.db2.gz LRFNTIYKMIVCIF-LURJTMIESA-N 0 3 345.195 3.546 20 5 EHBDHN CN(Cc1cc2ccccc2o1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776590374 1136453136 /nfs/dbraw/zinc/45/31/36/1136453136.db2.gz DCCSQKBBFMACOP-KRWDZBQOSA-N 0 3 326.352 3.506 20 5 EHBDHN C[C@@H](NC[C@H]1COC2(CCCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776741647 1136617766 /nfs/dbraw/zinc/61/77/66/1136617766.db2.gz WKBSWZTXHPAWDV-PBHICJAKSA-N 0 3 334.416 3.711 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@](O)(c2ccccc2)C1 ZINC000859585274 1137021509 /nfs/dbraw/zinc/02/15/09/1137021509.db2.gz MMZIJTMMDVNQFC-KXBFYZLASA-N 0 3 326.396 3.639 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@H]2CCC[C@H]2O)cc1Cl ZINC000824696977 1137147087 /nfs/dbraw/zinc/14/70/87/1137147087.db2.gz WUUHAZPOHMBJTC-FRFSOERESA-N 0 3 338.835 3.764 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1Cl ZINC000824696979 1137147250 /nfs/dbraw/zinc/14/72/50/1137147250.db2.gz WUUHAZPOHMBJTC-UNEWFSDZSA-N 0 3 338.835 3.764 20 5 EHBDHN CC([C@H](OC(=O)C(F)=C1CCCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845877043 1137316543 /nfs/dbraw/zinc/31/65/43/1137316543.db2.gz DNLMYIBHGUWAIR-BONVTDFDSA-N 0 3 325.311 3.873 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@@H](O)c2c(Cl)cccc2Cl)cc1 ZINC000124251530 1137584518 /nfs/dbraw/zinc/58/45/18/1137584518.db2.gz DEFUHJPZXQVDNF-CQSZACIVSA-N 0 3 341.194 3.725 20 5 EHBDHN CSCC[C@H](C)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000877054831 1137668853 /nfs/dbraw/zinc/66/88/53/1137668853.db2.gz IAJSMLQYRGUBLA-ZETCQYMHSA-N 0 3 339.280 3.650 20 5 EHBDHN C[C@@H]1CCCC[C@H]1N(C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476034 1137717327 /nfs/dbraw/zinc/71/73/27/1137717327.db2.gz VJXRXJWQEBZFJR-TZMCWYRMSA-N 0 3 330.388 3.655 20 5 EHBDHN CCCCN(CC)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000131874961 1137860935 /nfs/dbraw/zinc/86/09/35/1137860935.db2.gz VXQMRMAWRQLSFH-NSHDSACASA-N 0 3 327.812 3.697 20 5 EHBDHN Cc1c(NC(=O)[C@@H](C)N[C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000107070304 1137885335 /nfs/dbraw/zinc/88/53/35/1137885335.db2.gz WIEMDAXVWDXFQZ-UONOGXRCSA-N 0 3 327.384 3.581 20 5 EHBDHN CCCCN(Cc1cccnc1[N+](=O)[O-])[C@@H]1CCc2ncsc2C1 ZINC000886265911 1138063028 /nfs/dbraw/zinc/06/30/28/1138063028.db2.gz URWXYVAPFCGRLW-CQSZACIVSA-N 0 3 346.456 3.606 20 5 EHBDHN Cc1nc(C2CCN([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)[nH]c1C ZINC000886670043 1138112050 /nfs/dbraw/zinc/11/20/50/1138112050.db2.gz ILRUNIMYYMBUCQ-CQSZACIVSA-N 0 3 328.416 3.875 20 5 EHBDHN C[C@@H](NC[C@H]1COC2(CCCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777316144 1139577187 /nfs/dbraw/zinc/57/71/87/1139577187.db2.gz RSGAYGHEGXUSJG-PBHICJAKSA-N 0 3 334.416 3.711 20 5 EHBDHN Cc1ccc([C@H](C)NC[C@@H]2COC3(CCC(C)CC3)O2)cc1[N+](=O)[O-] ZINC000777313944 1139583314 /nfs/dbraw/zinc/58/33/14/1139583314.db2.gz SBUIGHYUTUAKNH-MNCVFJLESA-N 0 3 348.443 3.876 20 5 EHBDHN C[C@H](NC[C@@H](O)c1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000187419790 1140255010 /nfs/dbraw/zinc/25/50/10/1140255010.db2.gz VKNPKYQIIMLSQJ-MGPLVRAMSA-N 0 3 338.766 3.772 20 5 EHBDHN C[C@@H](O)c1ccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192723994 1140546422 /nfs/dbraw/zinc/54/64/22/1140546422.db2.gz HMAYABNBDWIFCQ-BFUOFWGJSA-N 0 3 326.396 3.815 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN(C[C@H]1CCCO1)C1CCCC1 ZINC000430215918 1015045638 /nfs/dbraw/zinc/04/56/38/1015045638.db2.gz DHZSZBAXZHFAAR-QGZVFWFLSA-N 0 3 334.416 3.527 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1C[C@H](c2ccccc2)C[C@@H]1C ZINC000609672668 1015830481 /nfs/dbraw/zinc/83/04/81/1015830481.db2.gz WAOXMCXHAVGYLV-GOEBONIOSA-N 0 3 326.396 3.981 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCCN(C)[C@H]2c2cccs2)n1 ZINC000247132401 1016597735 /nfs/dbraw/zinc/59/77/35/1016597735.db2.gz VPEOTBVGWDMZPF-CZUORRHYSA-N 0 3 346.456 3.855 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H](C[C@H]2CCOC2)c2ccccc2)cc1F ZINC000278746236 1032291300 /nfs/dbraw/zinc/29/13/00/1032291300.db2.gz WTGCZHRXNOOWDM-CRAIPNDOSA-N 0 3 344.386 3.991 20 5 EHBDHN CC[C@@H](C)CN(C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000341022504 1017781043 /nfs/dbraw/zinc/78/10/43/1017781043.db2.gz ZXMMVFXIQQVCLL-SNVBAGLBSA-N 0 3 332.347 3.683 20 5 EHBDHN Cc1ccc([C@@H](C)NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000182329513 1019064015 /nfs/dbraw/zinc/06/40/15/1019064015.db2.gz PFXCSDVMEBZKFF-CQSZACIVSA-N 0 3 327.384 3.501 20 5 EHBDHN Cc1c(CN2CC[C@H](n3ncc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000510417366 1020818802 /nfs/dbraw/zinc/81/88/02/1020818802.db2.gz PSRKECAYOSWZQN-KRWDZBQOSA-N 0 3 336.395 3.700 20 5 EHBDHN CO[C@@H]([C@@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000449633671 1032965323 /nfs/dbraw/zinc/96/53/23/1032965323.db2.gz UQPIZIORFVPSQV-XIKOKIGWSA-N 0 3 330.384 3.758 20 5 EHBDHN Cc1nc(CCNc2cc(C)nc3ccc([N+](=O)[O-])cc32)cs1 ZINC000302157355 1022159568 /nfs/dbraw/zinc/15/95/68/1022159568.db2.gz JAFLVSVUOQGFIL-UHFFFAOYSA-N 0 3 328.397 3.871 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548336455 1022376474 /nfs/dbraw/zinc/37/64/74/1022376474.db2.gz JTMBQUVGXPWYQY-LSDHHAIUSA-N 0 3 340.427 3.678 20 5 EHBDHN COc1cc(CN(C)C[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000514103225 1024134545 /nfs/dbraw/zinc/13/45/45/1024134545.db2.gz ANBYODPNHVEAQY-AWEZNQCLSA-N 0 3 344.411 3.848 20 5 EHBDHN Cc1ccc([C@@H](C)NCCOCCOc2ccccc2)cc1[N+](=O)[O-] ZINC000538277021 1024287716 /nfs/dbraw/zinc/28/77/16/1024287716.db2.gz WUJGRVSMYGWRGH-MRXNPFEDSA-N 0 3 344.411 3.649 20 5 EHBDHN C[C@@H]1CC[C@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000248553208 1024337904 /nfs/dbraw/zinc/33/79/04/1024337904.db2.gz JLWZGJKDJNFVGR-XUJVJEKNSA-N 0 3 330.388 3.559 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](OCc2ccncc2)C1 ZINC000280899673 1024411507 /nfs/dbraw/zinc/41/15/07/1024411507.db2.gz DSUPKIIDKRLVOC-YJBOKZPZSA-N 0 3 341.411 3.650 20 5 EHBDHN CCCCNC(=O)C1(NCc2ccc(C)c([N+](=O)[O-])c2)CCCCC1 ZINC000428084554 1024964088 /nfs/dbraw/zinc/96/40/88/1024964088.db2.gz OQMNVCZZMJOHDO-UHFFFAOYSA-N 0 3 347.459 3.612 20 5 EHBDHN Cc1nc(CCNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c(C)o1 ZINC000346816004 1025144321 /nfs/dbraw/zinc/14/43/21/1025144321.db2.gz DAJWZOGKAZFKHQ-UHFFFAOYSA-N 0 3 341.367 3.792 20 5 EHBDHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NCCOc1cccc([N+](=O)[O-])c1 ZINC000157879178 1025184301 /nfs/dbraw/zinc/18/43/01/1025184301.db2.gz JGNDSRGICDQKLU-CYBMUJFWSA-N 0 3 346.431 3.584 20 5 EHBDHN CCSCCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000281895195 1025647216 /nfs/dbraw/zinc/64/72/16/1025647216.db2.gz FHRKGJNOGPGDCZ-UHFFFAOYSA-N 0 3 337.470 3.951 20 5 EHBDHN C[C@@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CO1 ZINC000516063417 1025948132 /nfs/dbraw/zinc/94/81/32/1025948132.db2.gz SXSUOJOGLYPKTA-MNOVXSKESA-N 0 3 336.775 3.775 20 5 EHBDHN COCCOc1ccc([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000478492543 1026127336 /nfs/dbraw/zinc/12/73/36/1026127336.db2.gz NZVFPWOJHFVHDN-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN CCOC1(CNCc2cc([N+](=O)[O-])ccc2OC(F)F)CCCC1 ZINC000582952836 1028351592 /nfs/dbraw/zinc/35/15/92/1028351592.db2.gz GUEJGAXQHDONJQ-UHFFFAOYSA-N 0 3 344.358 3.635 20 5 EHBDHN CN(C)c1cccc([C@@H]2CCCN2Cc2ccccc2[N+](=O)[O-])c1 ZINC000524755275 1029485199 /nfs/dbraw/zinc/48/51/99/1029485199.db2.gz LKSWVULIBUDBKR-SFHVURJKSA-N 0 3 325.412 3.998 20 5 EHBDHN CN(C)C[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776188 1030705060 /nfs/dbraw/zinc/70/50/60/1030705060.db2.gz TXLRGRAJRBHTFZ-YEODSOHDSA-N 0 3 343.402 3.640 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@H](c2ccco2)N2CCCCC2)cc1 ZINC000237981337 1030720552 /nfs/dbraw/zinc/72/05/52/1030720552.db2.gz IWMVHMXSUJCRHY-QGZVFWFLSA-N 0 3 329.400 3.505 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000278431177 1030787939 /nfs/dbraw/zinc/78/79/39/1030787939.db2.gz DFKUPBOLYZQGGC-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN COCC1(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000594509790 1033415313 /nfs/dbraw/zinc/41/53/13/1033415313.db2.gz HGZBWDALZYGBRU-SFHVURJKSA-N 0 3 326.396 3.700 20 5 EHBDHN Cc1nn(CN(C)CCCc2ccccc2)c2cc([N+](=O)[O-])ccc12 ZINC000761288926 1033456716 /nfs/dbraw/zinc/45/67/16/1033456716.db2.gz YFNPHZPSWDBCRR-UHFFFAOYSA-N 0 3 338.411 3.775 20 5 EHBDHN CCC(C)(C)N(C)Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491218120 1033928100 /nfs/dbraw/zinc/92/81/00/1033928100.db2.gz VDUYYRFHKONREE-UHFFFAOYSA-N 0 3 346.374 3.868 20 5 EHBDHN C[C@@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000597224939 1034625563 /nfs/dbraw/zinc/62/55/63/1034625563.db2.gz KUGSAPAOBKIGLN-KGLIPLIRSA-N 0 3 330.384 3.854 20 5 EHBDHN O=[N+]([O-])c1cccc(Cl)c1CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2 ZINC000450855931 1034898480 /nfs/dbraw/zinc/89/84/80/1034898480.db2.gz HRVJMHHUWWDRGR-HFBAOOFYSA-N 0 3 336.819 3.686 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN[C@@H](Cc3ccccc3)C3CC3)nc2c1 ZINC000612465508 1034964119 /nfs/dbraw/zinc/96/41/19/1034964119.db2.gz MNTSUPUHBSTKBR-INIZCTEOSA-N 0 3 337.379 3.847 20 5 EHBDHN COc1ccc([C@@H](C)NCc2ccc(OC)c([N+](=O)[O-])c2)c(C)c1 ZINC000414084780 1035465285 /nfs/dbraw/zinc/46/52/85/1035465285.db2.gz XTJPXWGULLFYGL-CYBMUJFWSA-N 0 3 330.384 3.771 20 5 EHBDHN C[C@H](c1ccccc1)[C@H](CO)NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000613389357 1035721444 /nfs/dbraw/zinc/72/14/44/1035721444.db2.gz IQQQROXKKQNDTB-WBMJQRKESA-N 0 3 334.803 3.502 20 5 EHBDHN COC1(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000180199223 1036172336 /nfs/dbraw/zinc/17/23/36/1036172336.db2.gz VVFMXEZUOULVHW-SFHVURJKSA-N 0 3 326.396 3.843 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1ccc(NC(N)=O)cc1 ZINC000165433944 1036557153 /nfs/dbraw/zinc/55/71/53/1036557153.db2.gz PRTXGXBNCBKYFA-STQMWFEESA-N 0 3 342.399 3.806 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN[C@H](C)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000541691068 1036563664 /nfs/dbraw/zinc/56/36/64/1036563664.db2.gz URABNAIBUJMKBI-XEKQOVJPSA-N 0 3 342.395 3.646 20 5 EHBDHN CC(C)[C@](C)(O)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180528231 1036919366 /nfs/dbraw/zinc/91/93/66/1036919366.db2.gz KDLNFJOAUYJPJO-RTBURBONSA-N 0 3 328.412 3.681 20 5 EHBDHN CCC[C@H](NCc1ccc([S@@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000090220739 1036948924 /nfs/dbraw/zinc/94/89/24/1036948924.db2.gz QUERRIOMIHKXKL-UUOWRZLLSA-N 0 3 346.452 3.963 20 5 EHBDHN C[C@H](O)CN(Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000541999092 1036964310 /nfs/dbraw/zinc/96/43/10/1036964310.db2.gz VGLVYDOGEBNJNV-LBPRGKRZSA-N 0 3 326.824 3.764 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nc(CN3CC[C@@H](C4CCC4)C3)co2)cc1 ZINC000591063380 1037225577 /nfs/dbraw/zinc/22/55/77/1037225577.db2.gz SFICJGCAMYKMMA-OAHLLOKOSA-N 0 3 327.384 3.872 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ccc(CO)cc1)CCCC2 ZINC000592392980 1037934226 /nfs/dbraw/zinc/93/42/26/1037934226.db2.gz NTLZHNCQAYUZTB-LJQANCHMSA-N 0 3 326.396 3.644 20 5 EHBDHN Cc1cccc([C@H](C)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000539290613 1038762778 /nfs/dbraw/zinc/76/27/78/1038762778.db2.gz ARCFYBURAKYVCX-LSDHHAIUSA-N 0 3 341.411 3.889 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1cccc3c1CCOC3)CCC2 ZINC000601304632 1038936244 /nfs/dbraw/zinc/93/62/44/1038936244.db2.gz QINBCWNRPLSESU-HXUWFJFHSA-N 0 3 338.407 3.835 20 5 EHBDHN Cn1ncc2ccc(CN[C@@H]3CCCc4ccc([N+](=O)[O-])cc43)cc21 ZINC000567533245 1040088071 /nfs/dbraw/zinc/08/80/71/1040088071.db2.gz DAOLORKRMNKMLU-GOSISDBHSA-N 0 3 336.395 3.649 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CCC[C@H](Nc2ccccc2)C1 ZINC000490064884 1040330167 /nfs/dbraw/zinc/33/01/67/1040330167.db2.gz IWGNVUAITJYTMZ-KRWDZBQOSA-N 0 3 341.411 3.550 20 5 EHBDHN CCC[C@H](C)[C@H]1CCCN1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787133 1040443998 /nfs/dbraw/zinc/44/39/98/1040443998.db2.gz HEDIZDDHMCMDDG-WMLDXEAASA-N 0 3 333.432 3.742 20 5 EHBDHN Cc1ccc([C@H](C)N[C@H](C)c2ccc(NC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000192847069 1040575523 /nfs/dbraw/zinc/57/55/23/1040575523.db2.gz LQPGOCDWAWMIPC-OLZOCXBDSA-N 0 3 342.399 3.806 20 5 EHBDHN COC(=O)C(C)(C)[C@H]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000093283789 1042138826 /nfs/dbraw/zinc/13/88/26/1042138826.db2.gz IQTARADSKNIRTJ-HIFRSBDPSA-N 0 3 334.416 3.567 20 5 EHBDHN Cc1nc2c(s1)[C@@H](N(C)CCOc1ccccc1[N+](=O)[O-])CCC2 ZINC000111311637 1042260903 /nfs/dbraw/zinc/26/09/03/1042260903.db2.gz XPFUJEKIFQLAKF-HNNXBMFYSA-N 0 3 347.440 3.748 20 5 EHBDHN Cc1ccc(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)c(CN(C)C)c1 ZINC000072841124 1042604392 /nfs/dbraw/zinc/60/43/92/1042604392.db2.gz GWMLUWCDYZXZJQ-CSKARUKUSA-N 0 3 339.395 3.617 20 5 EHBDHN CCC[C@H]1[C@H](C)CCCN1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799437 1042700849 /nfs/dbraw/zinc/70/08/49/1042700849.db2.gz ZMGDHQPYHQJVRS-CJNGLKHVSA-N 0 3 334.416 3.782 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](c1ccccc1)C1CC1 ZINC000192501280 1126911916 /nfs/dbraw/zinc/91/19/16/1126911916.db2.gz XUHDVFXPOZBDCB-IBGZPJMESA-N 0 3 339.395 3.583 20 5 EHBDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283260 1127473388 /nfs/dbraw/zinc/47/33/88/1127473388.db2.gz PFKBJQOHBYXWMX-RYUDHWBXSA-N 0 3 341.839 3.943 20 5 EHBDHN CC[C@H](NCCOc1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC001168632974 1128506248 /nfs/dbraw/zinc/50/62/48/1128506248.db2.gz HAGCHJYIXSQBFE-KRWDZBQOSA-N 0 3 336.338 3.993 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(=S)n(CN(CC3CC3)CC3CC3)c2c1 ZINC000734477537 1131243164 /nfs/dbraw/zinc/24/31/64/1131243164.db2.gz GVEQCNDMDMFGDZ-UHFFFAOYSA-N 0 3 333.413 3.951 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCCc3nccs3)o2)c1 ZINC001648993152 1120338101 /nfs/dbraw/zinc/33/81/01/1120338101.db2.gz XWHWHLRUNSORKO-UHFFFAOYSA-N 0 3 329.381 3.644 20 5 EHBDHN COC[C@H](CC(C)C)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494516370 1120576969 /nfs/dbraw/zinc/57/69/69/1120576969.db2.gz TYOMGBYIUUWDRB-ZDUSSCGKSA-N 0 3 334.338 3.764 20 5 EHBDHN CCN(CC(C)C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153752728 1121690582 /nfs/dbraw/zinc/69/05/82/1121690582.db2.gz YFIYZZNISMOZAH-LLVKDONJSA-N 0 3 327.812 3.553 20 5 EHBDHN CCN1CCN(c2ccc(Nc3ccc([N+](=O)[O-])c(C)c3)cc2)CC1 ZINC000917003648 1122435305 /nfs/dbraw/zinc/43/53/05/1122435305.db2.gz QPRYEYMRKOHHFF-UHFFFAOYSA-N 0 3 340.427 3.789 20 5 EHBDHN CCOc1ccc([C@@H](C)NCC2(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000556919605 1123208523 /nfs/dbraw/zinc/20/85/23/1123208523.db2.gz GUZQHULDWVRMJR-SNVBAGLBSA-N 0 3 332.322 3.987 20 5 EHBDHN Cc1c(CN[C@@H](C)c2ccc(-n3cccn3)cc2)cccc1[N+](=O)[O-] ZINC000180842576 1124088747 /nfs/dbraw/zinc/08/87/47/1124088747.db2.gz LBTLDTQGFSCRRS-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN CC[C@@H](NCc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000078635511 1129174792 /nfs/dbraw/zinc/17/47/92/1129174792.db2.gz JIQYWUVQQMMZRH-MRXNPFEDSA-N 0 3 328.368 3.607 20 5 EHBDHN C[C@@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCCC1 ZINC000182940940 1125406400 /nfs/dbraw/zinc/40/64/00/1125406400.db2.gz MPLMVYJDMFRYOO-GFCCVEGCSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1cccc([C@@H](C)N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000115602941 1129278095 /nfs/dbraw/zinc/27/80/95/1129278095.db2.gz OOZBPHORPQZRLD-HUUCEWRRSA-N 0 3 341.411 3.889 20 5 EHBDHN Cc1c(NC(=O)CCN(C)[C@H](C)c2ccco2)cccc1[N+](=O)[O-] ZINC000069070394 1129420788 /nfs/dbraw/zinc/42/07/88/1129420788.db2.gz YJQWGTIAHPTTAD-CYBMUJFWSA-N 0 3 331.372 3.518 20 5 EHBDHN C[C@H](N[C@H](c1ccccc1)C1CC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000012674622 1129451138 /nfs/dbraw/zinc/45/11/38/1129451138.db2.gz PCHGDBFDYKENHJ-SCLBCKFNSA-N 0 3 339.395 3.663 20 5 EHBDHN C[C@H](NC[C@@H](c1ccco1)N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000154964266 1129602036 /nfs/dbraw/zinc/60/20/36/1129602036.db2.gz WOADWVKXAQVIIQ-YOEHRIQHSA-N 0 3 329.400 3.676 20 5 EHBDHN O=[N+]([O-])c1cc(F)c(CN[C@@H](Cc2ccccc2)C2CC2)c(F)c1 ZINC000509020815 1129656845 /nfs/dbraw/zinc/65/68/45/1129656845.db2.gz GRDCDMRLUZQMQK-SFHVURJKSA-N 0 3 332.350 3.984 20 5 EHBDHN Cc1cc(NCCC(=O)OC(C)(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000302166487 1129771184 /nfs/dbraw/zinc/77/11/84/1129771184.db2.gz KXNIBXYOKAFHON-UHFFFAOYSA-N 0 3 331.372 3.595 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CNCc2ccc(-c3ccccc3)o2)cc1 ZINC000731678489 1130830704 /nfs/dbraw/zinc/83/07/04/1130830704.db2.gz NGXNJWZLULUTFD-SFHVURJKSA-N 0 3 338.363 3.678 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC[C@@H]1CCN1Cc1ccccc1 ZINC000716276185 1131447129 /nfs/dbraw/zinc/44/71/29/1131447129.db2.gz HLOPVCLOQYJZOG-KRWDZBQOSA-N 0 3 345.830 3.612 20 5 EHBDHN Cc1nc([C@@H](C)N[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cs1 ZINC001172899036 1131883091 /nfs/dbraw/zinc/88/30/91/1131883091.db2.gz LBNVLCVHHMRUCS-IAQYHMDHSA-N 0 3 331.441 3.958 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H](CO)c1ccccc1Cl ZINC001173225554 1132006904 /nfs/dbraw/zinc/00/69/04/1132006904.db2.gz RRROGRDBLGAUEU-SJKOYZFVSA-N 0 3 334.803 3.502 20 5 EHBDHN COc1ccc(Nc2cccc3c2OCC[C@H]3N(C)C)cc1[N+](=O)[O-] ZINC001176362068 1132920907 /nfs/dbraw/zinc/92/09/07/1132920907.db2.gz RSNKWOCLYJCATA-OAHLLOKOSA-N 0 3 343.383 3.732 20 5 EHBDHN CCO[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2OC)C12CCCCC2 ZINC001170001417 1133241476 /nfs/dbraw/zinc/24/14/76/1133241476.db2.gz KODWAIVWIVCRNR-ROUUACIJSA-N 0 3 348.443 3.821 20 5 EHBDHN CO[C@](C)(CNCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 ZINC001181871607 1133544187 /nfs/dbraw/zinc/54/41/87/1133544187.db2.gz XGSCIXHQTFCLGD-QGZVFWFLSA-N 0 3 334.803 3.900 20 5 EHBDHN CC(C)(CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCC1CC1 ZINC001182395852 1133653140 /nfs/dbraw/zinc/65/31/40/1133653140.db2.gz ASYMUAVBNZMWDU-UHFFFAOYSA-N 0 3 346.349 3.908 20 5 EHBDHN O=[N+]([O-])c1sc(CNCCC2CC=CC2)cc1Br ZINC001183756236 1133856052 /nfs/dbraw/zinc/85/60/52/1133856052.db2.gz ZQYRXWAKLCBDQA-UHFFFAOYSA-N 0 3 331.235 3.865 20 5 EHBDHN C[C@@H]1C[C@H]1[C@@H]1C[C@H]1NCc1cc(Br)c([N+](=O)[O-])s1 ZINC001183885125 1133870352 /nfs/dbraw/zinc/87/03/52/1133870352.db2.gz DDCBYTUQDQTEEI-GPUHXXMPSA-N 0 3 331.235 3.553 20 5 EHBDHN CC(C)Oc1ccccc1[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000774981595 1134176420 /nfs/dbraw/zinc/17/64/20/1134176420.db2.gz RASXMRULHYRVOE-KBXCAEBGSA-N 0 3 344.411 3.766 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCC[C@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC001170329062 1134748914 /nfs/dbraw/zinc/74/89/14/1134748914.db2.gz NVNNDWBXFAZDSU-KSSFIOAISA-N 0 3 341.411 3.767 20 5 EHBDHN CCS[C@@H]1CCCC[C@H]1NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879228 1134810910 /nfs/dbraw/zinc/81/09/10/1134810910.db2.gz GPKSEPOWJBUJNU-UKRRQHHQSA-N 0 3 339.417 3.657 20 5 EHBDHN C[C@@]12CCN(CCc3ccc([N+](=O)[O-])cc3)C[C@@H]1C2(Cl)Cl ZINC000792916273 1134824294 /nfs/dbraw/zinc/82/42/94/1134824294.db2.gz XDQOEUWFYRKOPG-UONOGXRCSA-N 0 3 329.227 3.653 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN[C@@H](c2ccc(F)cc2F)C2CC2)c1 ZINC001192617516 1135040765 /nfs/dbraw/zinc/04/07/65/1135040765.db2.gz UPOSFOPNHBMSFY-QZTJIDSGSA-N 0 3 348.349 3.647 20 5 EHBDHN CC[C@@H](C)N[C@@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804781930 1135199537 /nfs/dbraw/zinc/19/95/37/1135199537.db2.gz LBNHQALBKBOHIH-NEPJUHHUSA-N 0 3 348.359 3.637 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H]1CCC[C@@H](O)C1 ZINC000811481533 1136091641 /nfs/dbraw/zinc/09/16/41/1136091641.db2.gz FDWSICKOMNCOQE-JOYOIKCWSA-N 0 3 333.215 3.542 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCc1ccccc1O ZINC000811477513 1136097029 /nfs/dbraw/zinc/09/70/29/1136097029.db2.gz UHVOJGNUBWSJRW-UHFFFAOYSA-N 0 3 341.194 3.940 20 5 EHBDHN CC(C)c1ccc(CNC[C@]23OCCC[C@H]2C3(F)F)cc1[N+](=O)[O-] ZINC000850378230 1136245319 /nfs/dbraw/zinc/24/53/19/1136245319.db2.gz YXPPNPJDUKPPOX-CVEARBPZSA-N 0 3 340.370 3.622 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1COc2ccccc2C1 ZINC000850428997 1136256833 /nfs/dbraw/zinc/25/68/33/1136256833.db2.gz WNHDYTVWHTWLRC-KBPBESRZSA-N 0 3 342.395 3.505 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC[C@@](C)(O)c1ccccc1 ZINC000850462395 1136264229 /nfs/dbraw/zinc/26/42/29/1136264229.db2.gz NYKQYMIBXZROPK-IFXJQAMLSA-N 0 3 344.411 3.552 20 5 EHBDHN Cc1cc(C(=O)OCC(C)[N+](=O)[O-])c(C)n1[C@H](C)c1ccccc1 ZINC000813111324 1136294862 /nfs/dbraw/zinc/29/48/62/1136294862.db2.gz GLDHHZMRTIPRDT-UONOGXRCSA-N 0 3 330.384 3.536 20 5 EHBDHN CC([C@H](OC(=O)[C@H](C)Cc1ccco1)c1ccccc1F)[N+](=O)[O-] ZINC000851109243 1136338150 /nfs/dbraw/zinc/33/81/50/1136338150.db2.gz WCJZKJIPLBSKPN-WQGACYEGSA-N 0 3 335.331 3.547 20 5 EHBDHN CC(C)[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000852446118 1136456686 /nfs/dbraw/zinc/45/66/86/1136456686.db2.gz DJTQCZWZZCYTOG-ROUUACIJSA-N 0 3 332.375 3.754 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CNC2(c3ccc(Cl)cc3)CC2)cc1 ZINC000776606716 1136469855 /nfs/dbraw/zinc/46/98/55/1136469855.db2.gz ZZOKUGQEBBXDAF-MRXNPFEDSA-N 0 3 332.787 3.561 20 5 EHBDHN CC1(C)CCC[C@@]1(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816641197 1136743536 /nfs/dbraw/zinc/74/35/36/1136743536.db2.gz LBPLEUHLBTZYJV-OAHLLOKOSA-N 0 3 347.242 3.932 20 5 EHBDHN C[C@@H](NCc1ccc(F)c(CN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000173419327 1137095285 /nfs/dbraw/zinc/09/52/85/1137095285.db2.gz KGHAPCFSIXJUNV-CYBMUJFWSA-N 0 3 331.391 3.646 20 5 EHBDHN CC([C@H](OC(=O)CSC(C)(C)C)c1ccccc1F)[N+](=O)[O-] ZINC000845872288 1137315997 /nfs/dbraw/zinc/31/59/97/1137315997.db2.gz GCGZBTGKVQIYSJ-HZMBPMFUSA-N 0 3 329.393 3.607 20 5 EHBDHN CC(C)n1cccc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845873969 1137316289 /nfs/dbraw/zinc/31/62/89/1137316289.db2.gz FPCAKRQJNQYRFR-MLGOLLRUSA-N 0 3 334.347 3.771 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H](C)c1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000845876596 1137316620 /nfs/dbraw/zinc/31/66/20/1137316620.db2.gz NCRPQBMIQBVBQM-FIXISWKDSA-N 0 3 337.372 3.940 20 5 EHBDHN CC([C@H](OC(=O)[C@H](C)c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881192 1137316922 /nfs/dbraw/zinc/31/69/22/1137316922.db2.gz ZENLTFVNDZVPQR-XNJGSVPQSA-N 0 3 331.343 3.879 20 5 EHBDHN CCc1noc(CC)c1CN[C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866282126 1137342550 /nfs/dbraw/zinc/34/25/50/1137342550.db2.gz XVMUOGYPXLMNCZ-NSHDSACASA-N 0 3 335.379 3.568 20 5 EHBDHN Cc1ccccc1NC(=O)C[C@H](C)NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000866538588 1137362985 /nfs/dbraw/zinc/36/29/85/1137362985.db2.gz CPYRACVLQGETCZ-HNNXBMFYSA-N 0 3 341.411 3.719 20 5 EHBDHN C[C@@H](CC(=O)N(C)c1ccccc1)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129787 1137573129 /nfs/dbraw/zinc/57/31/29/1137573129.db2.gz TZLRSULDVHQSIH-GJZGRUSLSA-N 0 3 341.411 3.687 20 5 EHBDHN CCN(Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)CC(C)C ZINC000877958158 1137697067 /nfs/dbraw/zinc/69/70/67/1137697067.db2.gz ICSHCYDHCWUKMV-UHFFFAOYSA-N 0 3 338.795 3.776 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1nnc(CN(C2CC2)C2CCCCC2)o1 ZINC000877965561 1137697434 /nfs/dbraw/zinc/69/74/34/1137697434.db2.gz XFLKFHNGXHVUCE-UHFFFAOYSA-N 0 3 342.399 3.942 20 5 EHBDHN C[C@@H]1CCC[C@@H](C)C1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878351737 1137712181 /nfs/dbraw/zinc/71/21/81/1137712181.db2.gz YYYORIHGIMNKLG-VXGBXAGGSA-N 0 3 330.388 3.559 20 5 EHBDHN CC[C@@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCCOC1 ZINC000880469362 1137779633 /nfs/dbraw/zinc/77/96/33/1137779633.db2.gz KEDDAQTURDFCBJ-RHSMWYFYSA-N 0 3 345.399 3.545 20 5 EHBDHN COCC[C@H]1CCCCN(Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000332367250 1137941691 /nfs/dbraw/zinc/94/16/91/1137941691.db2.gz WCKCRHAAJZOUCW-CYBMUJFWSA-N 0 3 326.824 3.887 20 5 EHBDHN COc1cccc([C@H]2CCN(Cc3cccnc3[N+](=O)[O-])C2(C)C)c1 ZINC000886316744 1138066675 /nfs/dbraw/zinc/06/66/75/1138066675.db2.gz LJMLYIXJHGKRCJ-QGZVFWFLSA-N 0 3 341.411 3.767 20 5 EHBDHN O=[N+]([O-])c1ccccc1C[C@H](NCc1cc(C2CC2)no1)C1CC1 ZINC000886684678 1138114845 /nfs/dbraw/zinc/11/48/45/1138114845.db2.gz PVOHXFACGYNXCT-INIZCTEOSA-N 0 3 327.384 3.571 20 5 EHBDHN Cc1ccc([C@@H](C)NC[C@H]2COC3(CCC(C)CC3)O2)cc1[N+](=O)[O-] ZINC000777313941 1139583234 /nfs/dbraw/zinc/58/32/34/1139583234.db2.gz SBUIGHYUTUAKNH-LJQUFJLCSA-N 0 3 348.443 3.876 20 5 EHBDHN CC(C)(O)c1ccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000193304992 1140570795 /nfs/dbraw/zinc/57/07/95/1140570795.db2.gz WNZSBCHJPYRMKR-LJQANCHMSA-N 0 3 340.423 3.989 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCCCC[C@H]2c2ccco2)c1 ZINC000269633864 1141129515 /nfs/dbraw/zinc/12/95/15/1141129515.db2.gz GNBCBKDESGSINQ-DLBZAZTESA-N 0 3 330.384 3.839 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@H](O)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271025737 1141296440 /nfs/dbraw/zinc/29/64/40/1141296440.db2.gz BBXDJHABSSFHEL-PXAZEXFGSA-N 0 3 348.374 3.517 20 5 EHBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1nc2c(s1)CCCC2 ZINC000271600144 1141404538 /nfs/dbraw/zinc/40/45/38/1141404538.db2.gz VGADSUFTUPDDNO-GFCCVEGCSA-N 0 3 331.441 3.823 20 5 EHBDHN CN(CC[C@@H]1CCCO1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339116651 1141501641 /nfs/dbraw/zinc/50/16/41/1141501641.db2.gz UZYHIOCVNHUJJL-ZDUSSCGKSA-N 0 3 332.322 3.615 20 5 EHBDHN C[C@@H](c1ccco1)N(CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000283371421 1141611630 /nfs/dbraw/zinc/61/16/30/1141611630.db2.gz SJDKNNVGLIHXBB-ZDUSSCGKSA-N 0 3 343.383 3.742 20 5 EHBDHN CC(C)[C@@H]1CCCCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000117349715 1015072504 /nfs/dbraw/zinc/07/25/04/1015072504.db2.gz NKWUWLWPRFYDSB-HNNXBMFYSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@@H](NC[C@@H](O)c1ccc(F)cc1Cl)c1ccccc1[N+](=O)[O-] ZINC000274824584 1015438351 /nfs/dbraw/zinc/43/83/51/1015438351.db2.gz KRUQDRPNIAYHFF-QLJPJBMISA-N 0 3 338.766 3.772 20 5 EHBDHN C[C@@H]1CCC[C@@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001167226896 1016661354 /nfs/dbraw/zinc/66/13/54/1016661354.db2.gz DJIBNAFALYIQGT-DGCLKSJQSA-N 0 3 339.823 3.697 20 5 EHBDHN O=[N+]([O-])c1cccc(CN[C@@H]2c3ccccc3CC23CCOCC3)c1 ZINC000290227577 1016819994 /nfs/dbraw/zinc/81/99/94/1016819994.db2.gz XLIBGSJXEICECG-LJQANCHMSA-N 0 3 338.407 3.779 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(F)c(CN(C)C)c1 ZINC000120910020 1017182962 /nfs/dbraw/zinc/18/29/62/1017182962.db2.gz FWSWSIGYKUJQLU-CQSZACIVSA-N 0 3 345.418 3.955 20 5 EHBDHN C[C@H](CO)NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000101594381 1018371497 /nfs/dbraw/zinc/37/14/97/1018371497.db2.gz HSWYFFJAFDHXFU-LLVKDONJSA-N 0 3 336.775 3.511 20 5 EHBDHN CC[C@@H]1C[C@H](C)CN1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000610410596 1018933376 /nfs/dbraw/zinc/93/33/76/1018933376.db2.gz VJCAACNBIZWXAK-CMPLNLGQSA-N 0 3 344.358 3.825 20 5 EHBDHN C[C@@H]1CCCC[C@@H]1N(C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548075196 1018999430 /nfs/dbraw/zinc/99/94/30/1018999430.db2.gz XGALUINHRBIZIA-RISCZKNCSA-N 0 3 339.823 3.697 20 5 EHBDHN O=[N+]([O-])c1ccc(NCCCN2CCc3ccccc3C2)c(F)c1 ZINC000513098035 1019017152 /nfs/dbraw/zinc/01/71/52/1019017152.db2.gz ZWYAGBAQNLZIMV-UHFFFAOYSA-N 0 3 329.375 3.594 20 5 EHBDHN CCN(CC)[C@H](CN[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000119109874 1019361215 /nfs/dbraw/zinc/36/12/15/1019361215.db2.gz BJBSHLLBVDYCGK-RHSMWYFYSA-N 0 3 331.416 3.922 20 5 EHBDHN COc1cccc(COCCN[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000090806559 1021090351 /nfs/dbraw/zinc/09/03/51/1021090351.db2.gz NCIMVPFIDVRXRV-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN CN1C[C@H]2C[C@@H](C1)N(C(=O)c1ccc3cc4ccccc4cc3c1)C2 ZINC001270141168 1021383532 /nfs/dbraw/zinc/38/35/32/1021383532.db2.gz SOGKHDXMNAUXNW-VFNWGFHPSA-N 0 3 330.431 3.769 20 5 EHBDHN CC[C@H](CSC)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602580038 1032998271 /nfs/dbraw/zinc/99/82/71/1032998271.db2.gz CDRFCEKJRYCXIR-SSDOTTSWSA-N 0 3 339.280 3.650 20 5 EHBDHN C[C@@H](CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nccs1 ZINC000602614534 1033007585 /nfs/dbraw/zinc/00/75/85/1033007585.db2.gz SNNBLVHNYAAQCL-VIFPVBQESA-N 0 3 345.346 3.963 20 5 EHBDHN CCC[C@]1(NCc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCOC1 ZINC000550095651 1022428529 /nfs/dbraw/zinc/42/85/29/1022428529.db2.gz ACDVMZOGDONQIX-AWEZNQCLSA-N 0 3 332.322 3.662 20 5 EHBDHN CC1(C)CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1O ZINC000438347714 1022585667 /nfs/dbraw/zinc/58/56/67/1022585667.db2.gz PIYUAIIPERJEMF-KRWDZBQOSA-N 0 3 346.452 3.916 20 5 EHBDHN Cc1ccc([C@@H](CNc2ncccc2[N+](=O)[O-])N2CCCC2)cc1 ZINC000060862597 1033095183 /nfs/dbraw/zinc/09/51/83/1033095183.db2.gz XQEOJCIXURNGFB-QGZVFWFLSA-N 0 3 326.400 3.547 20 5 EHBDHN CCN(CCOC)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000506417143 1023089550 /nfs/dbraw/zinc/08/95/50/1023089550.db2.gz PUAXCAJIDUUISU-UHFFFAOYSA-N 0 3 338.791 3.977 20 5 EHBDHN O=[N+]([O-])c1sc(CN[C@@]23C[C@@H]2CCCC3)cc1Br ZINC000602733066 1033123207 /nfs/dbraw/zinc/12/32/07/1033123207.db2.gz SGWAVFMKAJCLRP-UFBFGSQYSA-N 0 3 331.235 3.841 20 5 EHBDHN COc1cc(CN(C)[C@@H](C)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000341807622 1023354238 /nfs/dbraw/zinc/35/42/38/1023354238.db2.gz KESQCHOXCXWSDU-JTQLQIEISA-N 0 3 332.347 3.681 20 5 EHBDHN CC(C)(C)CC(C)(C)NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000053124236 1024515438 /nfs/dbraw/zinc/51/54/38/1024515438.db2.gz GEJYSFFSAJWLFC-UHFFFAOYSA-N 0 3 332.404 3.949 20 5 EHBDHN CC(C)n1cnnc1[C@H]1CCCN([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000266924388 1024663067 /nfs/dbraw/zinc/66/30/67/1024663067.db2.gz MUKRJPMPPQTOKN-CABCVRRESA-N 0 3 343.431 3.708 20 5 EHBDHN COCCN(C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000505636404 1024713272 /nfs/dbraw/zinc/71/32/72/1024713272.db2.gz KQYHNEMBSYYBCF-XFFZJAGNSA-N 0 3 326.396 3.757 20 5 EHBDHN C[C@@]1(CNCc2nc3cc([N+](=O)[O-])ccc3o2)CCOC2(CCC2)C1 ZINC000895823909 1024880409 /nfs/dbraw/zinc/88/04/09/1024880409.db2.gz UWLPNLVPJGESDQ-QGZVFWFLSA-N 0 3 345.399 3.565 20 5 EHBDHN Cc1c(CN2CCC(c3ccc(F)cn3)CC2)cccc1[N+](=O)[O-] ZINC000602903665 1033253064 /nfs/dbraw/zinc/25/30/64/1033253064.db2.gz KHRQCMNVYZLGPT-UHFFFAOYSA-N 0 3 329.375 3.817 20 5 EHBDHN Cc1c(CN2CC[C@@H](COc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000505844011 1025859017 /nfs/dbraw/zinc/85/90/17/1025859017.db2.gz CSUXFGUWZZDHHW-MRXNPFEDSA-N 0 3 326.396 3.804 20 5 EHBDHN O=[N+]([O-])c1cccc(F)c1CN1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000451622436 1026159566 /nfs/dbraw/zinc/15/95/66/1026159566.db2.gz ZXGOBXSASDKREG-PBHICJAKSA-N 0 3 334.391 3.515 20 5 EHBDHN C[C@H](NC(=O)c1cc2ccccc2c2cccnc12)C1=CCN(C)CC1 ZINC000272949625 1027192525 /nfs/dbraw/zinc/19/25/25/1027192525.db2.gz MRAIMZSQIOPHEJ-HNNXBMFYSA-N 0 3 345.446 3.768 20 5 EHBDHN CCS[C@H]1CCCC[C@@H]1NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444685665 1028130268 /nfs/dbraw/zinc/13/02/68/1028130268.db2.gz PAIQAFHEMYBTQK-ZFWWWQNUSA-N 0 3 334.445 3.625 20 5 EHBDHN CC[C@@H]1C[C@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000421391336 1028368182 /nfs/dbraw/zinc/36/81/82/1028368182.db2.gz UAFNQWCTPWXDCW-CZUORRHYSA-N 0 3 347.440 3.766 20 5 EHBDHN CCCCN1CCCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1Cl ZINC000524236643 1029013975 /nfs/dbraw/zinc/01/39/75/1029013975.db2.gz YZWNNPKZDZPTHA-GFCCVEGCSA-N 0 3 326.828 3.710 20 5 EHBDHN Cc1c(CN(C)[C@@H](C)[C@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000441042867 1029660980 /nfs/dbraw/zinc/66/09/80/1029660980.db2.gz GECBPPXFLXQJQY-IFXJQAMLSA-N 0 3 326.396 3.727 20 5 EHBDHN CC[C@H](C)N[C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000343257839 1029953273 /nfs/dbraw/zinc/95/32/73/1029953273.db2.gz ZMFIFAWYRINOJK-CMPLNLGQSA-N 0 3 338.795 3.778 20 5 EHBDHN COc1ccc(CN2CC[C@@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000532293462 1030527948 /nfs/dbraw/zinc/52/79/48/1030527948.db2.gz YJTYSAOZKAVYHG-LJQANCHMSA-N 0 3 326.396 3.767 20 5 EHBDHN Cc1cccc([C@@H]2CCCN2CCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000160082631 1030528888 /nfs/dbraw/zinc/52/88/88/1030528888.db2.gz ISJMEQPLZLDLHT-SFHVURJKSA-N 0 3 327.384 3.514 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@H](c2nc(C)no2)C1 ZINC000347365244 1031848596 /nfs/dbraw/zinc/84/85/96/1031848596.db2.gz SZUBITLGGQRBPE-OVHOFWQVSA-N 0 3 342.399 3.569 20 5 EHBDHN O=[N+]([O-])c1ccc(CNc2ccc([C@@H]3CNCCO3)cc2)c(Cl)c1 ZINC000594740329 1033511090 /nfs/dbraw/zinc/51/10/90/1033511090.db2.gz VTNSADYPWNMNKJ-KRWDZBQOSA-N 0 3 347.802 3.521 20 5 EHBDHN COc1cccc([C@@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000059372101 1033590468 /nfs/dbraw/zinc/59/04/68/1033590468.db2.gz PVBGRNJSXJXQEA-KRWDZBQOSA-N 0 3 342.395 3.819 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC(C3(O)CC3)CC2)o1 ZINC000593647874 1033609827 /nfs/dbraw/zinc/60/98/27/1033609827.db2.gz OUIDCQAKBQXNSR-UHFFFAOYSA-N 0 3 342.395 3.592 20 5 EHBDHN C[C@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCCCO1 ZINC000599044668 1033672513 /nfs/dbraw/zinc/67/25/13/1033672513.db2.gz RYDJUNZYWTUKPW-IINYFYTJSA-N 0 3 332.322 3.661 20 5 EHBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000595467664 1033821295 /nfs/dbraw/zinc/82/12/95/1033821295.db2.gz SPTZADJTEBLXAR-JZXOWHBKSA-N 0 3 336.407 3.640 20 5 EHBDHN CCOc1cc(CN2CCC[C@H]([C@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787961 1033998748 /nfs/dbraw/zinc/99/87/48/1033998748.db2.gz LAZXWPQISLFDEP-FUHWJXTLSA-N 0 3 348.443 3.775 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000599625117 1034072220 /nfs/dbraw/zinc/07/22/20/1034072220.db2.gz FZZHRHYDQOAXFV-RZGXBDKHSA-N 0 3 332.322 3.515 20 5 EHBDHN COc1ccc([C@@H]2CCN(Cc3ccccc3[N+](=O)[O-])C2)cc1F ZINC000599677016 1034084786 /nfs/dbraw/zinc/08/47/86/1034084786.db2.gz GEZXEZSPZOTISK-CQSZACIVSA-N 0 3 330.359 3.732 20 5 EHBDHN C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCCC2 ZINC000179424306 1034297339 /nfs/dbraw/zinc/29/73/39/1034297339.db2.gz MIYYSKNJWVPKIO-LBPRGKRZSA-N 0 3 331.441 3.823 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000604427981 1034375566 /nfs/dbraw/zinc/37/55/66/1034375566.db2.gz MVWJWWGIEUPJTK-QGZVFWFLSA-N 0 3 342.395 3.645 20 5 EHBDHN CC1(O)CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000179724281 1034591339 /nfs/dbraw/zinc/59/13/39/1034591339.db2.gz JTHXTBXBZNBSRA-UHFFFAOYSA-N 0 3 332.425 3.670 20 5 EHBDHN CC(C)OCCNCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000612593489 1035083371 /nfs/dbraw/zinc/08/33/71/1035083371.db2.gz BFBNUWQUNXUVSI-UHFFFAOYSA-N 0 3 343.427 3.877 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCCC12CCCCC2 ZINC000534728785 1035527593 /nfs/dbraw/zinc/52/75/93/1035527593.db2.gz OTTFKJIQWDDEBB-UHFFFAOYSA-N 0 3 331.416 3.640 20 5 EHBDHN COc1cccc(C2(CNCc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000589319604 1036357502 /nfs/dbraw/zinc/35/75/02/1036357502.db2.gz IXQDOXQKNURXRA-UHFFFAOYSA-N 0 3 330.359 3.564 20 5 EHBDHN CC(C)[C@@H](O)CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000493050287 1036580854 /nfs/dbraw/zinc/58/08/54/1036580854.db2.gz BKIQFWBDZJERCU-RBUKOAKNSA-N 0 3 328.412 3.681 20 5 EHBDHN CCOc1ccccc1OCCN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180406093 1036780756 /nfs/dbraw/zinc/78/07/56/1036780756.db2.gz CMTSMRNBLYSJGI-AWEZNQCLSA-N 0 3 330.384 3.723 20 5 EHBDHN CC[C@@H](CO)N(Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000573407123 1037507645 /nfs/dbraw/zinc/50/76/45/1037507645.db2.gz FDNITPYINLYIAO-SFHVURJKSA-N 0 3 328.412 3.676 20 5 EHBDHN COc1ccc(CNC/C(C)=C/c2cccc([N+](=O)[O-])c2)cc1O ZINC000468639247 1037674542 /nfs/dbraw/zinc/67/45/42/1037674542.db2.gz RRZMRPICZMMZHO-MDWZMJQESA-N 0 3 328.368 3.502 20 5 EHBDHN CC[C@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000341187528 1037728983 /nfs/dbraw/zinc/72/89/83/1037728983.db2.gz CUPAKXDAOCTMFW-ZBFHGGJFSA-N 0 3 341.411 3.971 20 5 EHBDHN CC[C@@H](NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000341207216 1037762621 /nfs/dbraw/zinc/76/26/21/1037762621.db2.gz JRHQUQCAQMYVRD-OAHLLOKOSA-N 0 3 327.384 3.583 20 5 EHBDHN C[C@@H](NCCCCc1ccc([N+](=O)[O-])cc1)c1cc2n(n1)CCCC2 ZINC000592387711 1037953178 /nfs/dbraw/zinc/95/31/78/1037953178.db2.gz IMNGOBOOODONND-OAHLLOKOSA-N 0 3 342.443 3.801 20 5 EHBDHN CC(C)c1ccc(CNCCOC2CCSCC2)cc1[N+](=O)[O-] ZINC000898442028 1039050009 /nfs/dbraw/zinc/05/00/09/1039050009.db2.gz ISGFFRQSGWYJTL-UHFFFAOYSA-N 0 3 338.473 3.720 20 5 EHBDHN CC[C@@]1(NCc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)CCOC1 ZINC000616487692 1039273621 /nfs/dbraw/zinc/27/36/21/1039273621.db2.gz CISCFLLVXZDXOL-GOSISDBHSA-N 0 3 346.383 3.522 20 5 EHBDHN COc1ccc(F)c(CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000549804533 1039924226 /nfs/dbraw/zinc/92/42/26/1039924226.db2.gz IMGYQCBFMDVHCO-UHFFFAOYSA-N 0 3 338.766 3.728 20 5 EHBDHN CCOc1ccc(NC(=O)CN(C)C2CCCCCC2)c([N+](=O)[O-])c1 ZINC000029166230 1040196571 /nfs/dbraw/zinc/19/65/71/1040196571.db2.gz PRCIYTYMWNLPAB-UHFFFAOYSA-N 0 3 349.431 3.587 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])c(Nc2cccc3c2OCC[C@H]3N(C)C)n1 ZINC000432926896 1040196873 /nfs/dbraw/zinc/19/68/73/1040196873.db2.gz DRGIWJWHWCUESW-OAHLLOKOSA-N 0 3 342.399 3.735 20 5 EHBDHN CCc1ccc([C@H]2CCCCCN2CCn2cc([N+](=O)[O-])cn2)o1 ZINC000174871431 1041204328 /nfs/dbraw/zinc/20/43/28/1041204328.db2.gz BEAXNIJYHRQLGZ-MRXNPFEDSA-N 0 3 332.404 3.564 20 5 EHBDHN CN(C)Cc1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000549532503 1041966012 /nfs/dbraw/zinc/96/60/12/1041966012.db2.gz ZIUGBUTZQZWLLI-UHFFFAOYSA-N 0 3 339.351 3.655 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1F ZINC000291235467 1042789310 /nfs/dbraw/zinc/78/93/10/1042789310.db2.gz UMBLVXLIQURAOC-YXJHDRRASA-N 0 3 336.407 3.640 20 5 EHBDHN C[C@@H]1CCC[C@@H](N(C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898520 1043599604 /nfs/dbraw/zinc/59/96/04/1043599604.db2.gz YMKUBPLKMLTKQD-RDTXWAMCSA-N 0 3 328.416 3.926 20 5 EHBDHN CC[C@@H](CSC)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000182134386 1044098345 /nfs/dbraw/zinc/09/83/45/1044098345.db2.gz FWVKBRDBECUJPB-LBPRGKRZSA-N 0 3 337.470 3.950 20 5 EHBDHN C[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1COc2ccccc21 ZINC000185547112 1126932793 /nfs/dbraw/zinc/93/27/93/1126932793.db2.gz XILLVHZSWMXRDZ-IAQYHMDHSA-N 0 3 332.787 3.903 20 5 EHBDHN Cc1nn(CN2CC[C@H](c3ccccc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764946919 1127558401 /nfs/dbraw/zinc/55/84/01/1127558401.db2.gz YVCKSHGHAKJKHG-INIZCTEOSA-N 0 3 336.395 3.700 20 5 EHBDHN Cc1cc(CCN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)on1 ZINC000552099695 1127578551 /nfs/dbraw/zinc/57/85/51/1127578551.db2.gz QOORYYCOJBPGTJ-IBGZPJMESA-N 0 3 337.379 3.813 20 5 EHBDHN Cc1ccc(F)cc1NC(=O)CCN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC001168603733 1128288211 /nfs/dbraw/zinc/28/82/11/1128288211.db2.gz IFJPWURNUIRXQG-CYBMUJFWSA-N 0 3 345.374 3.722 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCSc3c(F)cccc32)cc1 ZINC000765849491 1128570041 /nfs/dbraw/zinc/57/00/41/1128570041.db2.gz QLYHEOVJSSFVTD-HZPDHXFCSA-N 0 3 348.399 3.594 20 5 EHBDHN Cc1ccccc1[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C ZINC000091350139 1128642435 /nfs/dbraw/zinc/64/24/35/1128642435.db2.gz NYDSDCZNPLVQHN-IBGZPJMESA-N 0 3 341.411 3.829 20 5 EHBDHN O=[N+]([O-])c1cccc(Cl)c1CN[C@H](CCO)C1CCCCC1 ZINC000494803690 1120846829 /nfs/dbraw/zinc/84/68/29/1120846829.db2.gz HQKFRJNJDNTSGJ-OAHLLOKOSA-N 0 3 326.824 3.669 20 5 EHBDHN O=[N+]([O-])c1cccc(CCN[C@H](c2ccccc2)c2ccccn2)c1 ZINC000495007013 1120930373 /nfs/dbraw/zinc/93/03/73/1120930373.db2.gz IDPDQHCFKSJJPH-HXUWFJFHSA-N 0 3 333.391 3.912 20 5 EHBDHN COc1cccc([C@@H](CNc2c(C)cccc2[N+](=O)[O-])N(C)C)c1 ZINC000301192786 1122449696 /nfs/dbraw/zinc/44/96/96/1122449696.db2.gz SLZQNXJYIPQTIU-QGZVFWFLSA-N 0 3 329.400 3.627 20 5 EHBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@@H](C)c1c(F)cncc1F ZINC000556916372 1123200891 /nfs/dbraw/zinc/20/08/91/1123200891.db2.gz IDLJTEXNDQOAPZ-NEPJUHHUSA-N 0 3 335.354 3.940 20 5 EHBDHN Cc1ccc(NC(=O)/C=C\c2cccc([N+](=O)[O-])c2)c(CN(C)C)c1 ZINC000255584037 1129147208 /nfs/dbraw/zinc/14/72/08/1129147208.db2.gz GWMLUWCDYZXZJQ-NTMALXAHSA-N 0 3 339.395 3.617 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCOCC2(CCCC2)C1 ZINC000615838775 1123884675 /nfs/dbraw/zinc/88/46/75/1123884675.db2.gz CHYYPNGXYRDDJB-WJDWOHSUSA-N 0 3 330.428 3.891 20 5 EHBDHN CCOC(=O)CC[C@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092073641 1129532136 /nfs/dbraw/zinc/53/21/36/1129532136.db2.gz SBJSPKZBTVGACV-YXMGTMDOSA-N 0 3 346.427 3.663 20 5 EHBDHN O=[N+]([O-])c1ccc(F)cc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000281116672 1129703518 /nfs/dbraw/zinc/70/35/18/1129703518.db2.gz XFGUYLVWYCAWSQ-CGTJXYLNSA-N 0 3 336.407 3.640 20 5 EHBDHN Cc1ccc2nccc(N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2c1 ZINC000302795371 1129792183 /nfs/dbraw/zinc/79/21/83/1129792183.db2.gz OPDWVRGSBNGQLC-CQSZACIVSA-N 0 3 349.394 3.537 20 5 EHBDHN C[C@H]1CC(C)(C)C[C@](CO)(NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000740008107 1131515887 /nfs/dbraw/zinc/51/58/87/1131515887.db2.gz WSJLIYZEHPRLSQ-YVEFUNNKSA-N 0 3 340.851 3.915 20 5 EHBDHN C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2F)CCN1Cc1ccccc1 ZINC000742431374 1131729796 /nfs/dbraw/zinc/72/97/96/1131729796.db2.gz XXSLUIYRFCBGOJ-OAHLLOKOSA-N 0 3 343.402 3.835 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@H]3CCC[C@@H]32)c1F ZINC001173196491 1131997038 /nfs/dbraw/zinc/99/70/38/1131997038.db2.gz NAAHBAXLNOBTRT-GUTXKFCHSA-N 0 3 336.407 3.938 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(C)C[C@@H]1c1ccccc1 ZINC001173223485 1132005749 /nfs/dbraw/zinc/00/57/49/1132005749.db2.gz ANFJYUGABFRLNS-OXQOHEQNSA-N 0 3 339.439 3.515 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCOC[C@@H]1C1CCCCC1 ZINC001173231065 1132009438 /nfs/dbraw/zinc/00/94/38/1132009438.db2.gz JGKGABKPWVFJSP-HNAYVOBHSA-N 0 3 332.444 3.807 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H](c1ncccc1F)C1CC1 ZINC001173230561 1132009657 /nfs/dbraw/zinc/00/96/57/1132009657.db2.gz RXMFQNAMAZRWFE-SJKOYZFVSA-N 0 3 329.375 3.801 20 5 EHBDHN CCN(CCc1cccs1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000746070428 1132364987 /nfs/dbraw/zinc/36/49/87/1132364987.db2.gz NDWPWZAWDCUJMK-UHFFFAOYSA-N 0 3 330.413 3.528 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000768543571 1133158321 /nfs/dbraw/zinc/15/83/21/1133158321.db2.gz AXWLULBJFVARCX-UHFFFAOYSA-N 0 3 341.367 3.710 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@H](C)[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179348065 1133243313 /nfs/dbraw/zinc/24/33/13/1133243313.db2.gz NFFKLIRTWXZGTI-ZVZLLHMNSA-N 0 3 330.384 3.756 20 5 EHBDHN CCN(C/C=C/c1ccccc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000769483383 1133288682 /nfs/dbraw/zinc/28/86/82/1133288682.db2.gz MNSYVIMCBYMZKI-IEJURRBGSA-N 0 3 340.423 3.972 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCc3cc(C)ccc3C2)c([N+](=O)[O-])c1 ZINC001170354166 1134754403 /nfs/dbraw/zinc/75/44/03/1134754403.db2.gz HVZXSTBDMZJNNF-HNNXBMFYSA-N 0 3 340.423 3.901 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCC[C@@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC001170345844 1134759543 /nfs/dbraw/zinc/75/95/43/1134759543.db2.gz MXANIWHQPWSNIJ-RDTXWAMCSA-N 0 3 341.411 3.767 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000792913112 1134823816 /nfs/dbraw/zinc/82/38/16/1134823816.db2.gz LXXBCWHCFXSCGY-KGLIPLIRSA-N 0 3 345.226 3.619 20 5 EHBDHN CN(CCN(Cc1ccccc1[N+](=O)[O-])C1CC1)Cc1ccccc1 ZINC001192391328 1135013371 /nfs/dbraw/zinc/01/33/71/1135013371.db2.gz RTCYHTOHBAJZOW-UHFFFAOYSA-N 0 3 339.439 3.691 20 5 EHBDHN CCCC1CCC(N(C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC001194052307 1135222319 /nfs/dbraw/zinc/22/23/19/1135222319.db2.gz SMFVZMKGSIXJJO-UHFFFAOYSA-N 0 3 347.459 3.848 20 5 EHBDHN CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CCOCC1 ZINC000809969002 1135904691 /nfs/dbraw/zinc/90/46/91/1135904691.db2.gz LHLLHYSRDHXAQJ-UHFFFAOYSA-N 0 3 333.215 3.760 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCCOC(F)F ZINC000811502278 1136100602 /nfs/dbraw/zinc/10/06/02/1136100602.db2.gz OUWITYMMJRWKEU-UHFFFAOYSA-N 0 3 329.130 3.621 20 5 EHBDHN COC(=O)CCCCCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811507381 1136101098 /nfs/dbraw/zinc/10/10/98/1136101098.db2.gz ZXOWYVOATZYAPW-UHFFFAOYSA-N 0 3 349.214 3.725 20 5 EHBDHN CCN(Cc1ccc(Cl)s1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776273948 1136128326 /nfs/dbraw/zinc/12/83/26/1136128326.db2.gz FNCPWWMGZXSYGZ-CQSZACIVSA-N 0 3 340.832 3.865 20 5 EHBDHN CC[C@H]1c2ccsc2CCN1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275031 1136129045 /nfs/dbraw/zinc/12/90/45/1136129045.db2.gz FOMIBXORJSPDOV-JKSUJKDBSA-N 0 3 332.425 3.699 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000776276943 1136130622 /nfs/dbraw/zinc/13/06/22/1136130622.db2.gz LXKCYTDSODXMBI-QZTJIDSGSA-N 0 3 330.359 3.604 20 5 EHBDHN COC[C@@H](C)Oc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000850312338 1136234072 /nfs/dbraw/zinc/23/40/72/1136234072.db2.gz JHYGVEYSHYOILR-CABCVRRESA-N 0 3 344.411 3.859 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H]1COc2ccccc2C1 ZINC000850428999 1136257275 /nfs/dbraw/zinc/25/72/75/1136257275.db2.gz WNHDYTVWHTWLRC-UONOGXRCSA-N 0 3 342.395 3.505 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C)[C@@H](O)c1cccc(F)c1 ZINC000850444412 1136259998 /nfs/dbraw/zinc/25/99/98/1136259998.db2.gz JFUZKKSGQMVWSO-VNBZBWLYSA-N 0 3 348.374 3.515 20 5 EHBDHN CCc1ccc([C@@H](O)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850470244 1136265212 /nfs/dbraw/zinc/26/52/12/1136265212.db2.gz ZVKFZCPSWDFQDQ-UGSOOPFHSA-N 0 3 344.411 3.550 20 5 EHBDHN COc1cccc(C2(N[C@H](C)c3ccc(N)c([N+](=O)[O-])c3)CCC2)c1 ZINC000850567093 1136287419 /nfs/dbraw/zinc/28/74/19/1136287419.db2.gz XNNKAQRXIPEWRO-CYBMUJFWSA-N 0 3 341.411 3.916 20 5 EHBDHN Cc1nc(-c2cccc(Cl)c2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813100766 1136287627 /nfs/dbraw/zinc/28/76/27/1136287627.db2.gz WTPMFOIPQSRIQX-MRVPVSSYSA-N 0 3 340.788 3.594 20 5 EHBDHN CC(COC(=O)c1ccc(O[C@H](C)c2ccccc2)cc1)[N+](=O)[O-] ZINC000813111973 1136294931 /nfs/dbraw/zinc/29/49/31/1136294931.db2.gz YHKJIXOYPKQLQU-UONOGXRCSA-N 0 3 329.352 3.649 20 5 EHBDHN CCOc1ccc([C@H](C)N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556083 1136610286 /nfs/dbraw/zinc/61/02/86/1136610286.db2.gz NPIVZIJAADQLTF-STQMWFEESA-N 0 3 329.400 3.988 20 5 EHBDHN C[C@H](NC[C@H]1COC2(CCC(C)CC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776740097 1136620009 /nfs/dbraw/zinc/62/00/09/1136620009.db2.gz IEXHTURWYJIJHP-YHOSQGMISA-N 0 3 334.416 3.567 20 5 EHBDHN Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2Cl)c(CN(C)C)c1 ZINC000816924982 1136763780 /nfs/dbraw/zinc/76/37/80/1136763780.db2.gz CFNXSQQSYOKALQ-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000821361733 1137024647 /nfs/dbraw/zinc/02/46/47/1137024647.db2.gz WEMZFEJEVDKBFZ-UHFFFAOYSA-N 0 3 341.411 3.834 20 5 EHBDHN CO[C@@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000824592033 1137144193 /nfs/dbraw/zinc/14/41/93/1137144193.db2.gz XSFNLWBDSJEOHG-OAHLLOKOSA-N 0 3 334.803 3.596 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@]1(C)CC1(Cl)Cl ZINC000824764596 1137150858 /nfs/dbraw/zinc/15/08/58/1137150858.db2.gz CAAMCWUASWSEFR-CYBMUJFWSA-N 0 3 333.215 3.667 20 5 EHBDHN Cc1ccc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])s1 ZINC000845875043 1137316415 /nfs/dbraw/zinc/31/64/15/1137316415.db2.gz KVCGONARCLANMG-BZNIZROVSA-N 0 3 337.372 3.688 20 5 EHBDHN CCS[C@H](C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-])C(C)C ZINC000845878117 1137316431 /nfs/dbraw/zinc/31/64/31/1137316431.db2.gz ULCDRUDAXANQEF-DFBGVHRSSA-N 0 3 343.420 3.853 20 5 EHBDHN CCO[C@H](CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-])C(C)C ZINC000845876762 1137316613 /nfs/dbraw/zinc/31/66/13/1137316613.db2.gz OMFDNKPORGDDRH-VMGRFDJRSA-N 0 3 341.379 3.526 20 5 EHBDHN C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])NCc1cc(F)cnc1Cl ZINC000866365941 1137349648 /nfs/dbraw/zinc/34/96/48/1137349648.db2.gz JCZMZAAMFFUSDN-SECBINFHSA-N 0 3 341.745 3.642 20 5 EHBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3cccc(F)c3F)CC2)cc1 ZINC000866476773 1137357924 /nfs/dbraw/zinc/35/79/24/1137357924.db2.gz RVMMUUCKBCMJCG-UHFFFAOYSA-N 0 3 347.365 3.632 20 5 EHBDHN COCc1cc([C@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)ccc1OC ZINC000866539300 1137362953 /nfs/dbraw/zinc/36/29/53/1137362953.db2.gz JQFRTRQWJFLXAR-AWEZNQCLSA-N 0 3 344.411 3.909 20 5 EHBDHN C[C@H](CC(=O)Nc1cccc(F)c1)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129595 1137573132 /nfs/dbraw/zinc/57/31/32/1137573132.db2.gz REMXLQIKFZEWMM-CHWSQXEVSA-N 0 3 345.374 3.802 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNCCC[C@H]3CC3(Cl)Cl)nc2c1 ZINC000877614835 1137682935 /nfs/dbraw/zinc/68/29/35/1137682935.db2.gz NHAHAGDUTMPTDD-VIFPVBQESA-N 0 3 344.198 3.800 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000877804829 1137690498 /nfs/dbraw/zinc/69/04/98/1137690498.db2.gz FAPDISZVZOJNPL-RIEGTJTDSA-N 0 3 344.333 3.661 20 5 EHBDHN C[C@@H]1C[C@@H](C)[C@@H](C)N(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497112 1137717960 /nfs/dbraw/zinc/71/79/60/1137717960.db2.gz QTVGNSHLRMFMIN-JHJVBQTASA-N 0 3 330.388 3.511 20 5 EHBDHN Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c(CN(C)C)c1 ZINC000113912180 1137915370 /nfs/dbraw/zinc/91/53/70/1137915370.db2.gz YURXFCGCFITEOX-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN COc1cc(CN(C)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000053814353 1138048216 /nfs/dbraw/zinc/04/82/16/1138048216.db2.gz YJYWEINLOBAPBZ-UHFFFAOYSA-N 0 3 330.331 3.579 20 5 EHBDHN CCCCN(Cc1cccnc1[N+](=O)[O-])[C@H]1CCc2ncsc2C1 ZINC000886265910 1138062954 /nfs/dbraw/zinc/06/29/54/1138062954.db2.gz URWXYVAPFCGRLW-AWEZNQCLSA-N 0 3 346.456 3.606 20 5 EHBDHN CC[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000179627593 1139769593 /nfs/dbraw/zinc/76/95/93/1139769593.db2.gz QCOJKNZTCZWMNS-IRXDYDNUSA-N 0 3 336.338 3.647 20 5 EHBDHN Cc1ccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])c(CN(C)C)c1 ZINC000180863025 1139868285 /nfs/dbraw/zinc/86/82/85/1139868285.db2.gz IIGRMALKLYXUIJ-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000183392247 1140034220 /nfs/dbraw/zinc/03/42/20/1140034220.db2.gz RNZVXZWIFKYFJD-WBVHZDCISA-N 0 3 330.384 3.584 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000183392270 1140034251 /nfs/dbraw/zinc/03/42/51/1140034251.db2.gz RNZVXZWIFKYFJD-RDJZCZTQSA-N 0 3 330.384 3.584 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000269687377 1141135632 /nfs/dbraw/zinc/13/56/32/1141135632.db2.gz TVZMAYBXGOUAOA-QZTJIDSGSA-N 0 3 330.359 3.604 20 5 EHBDHN C[C@]1(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCOC1 ZINC000120157598 1014510838 /nfs/dbraw/zinc/51/08/38/1014510838.db2.gz PTGIPQHFRVUXBE-SFHVURJKSA-N 0 3 346.358 3.795 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN(C)[C@@H]1CCc2ccccc2C1 ZINC000430196375 1014813163 /nfs/dbraw/zinc/81/31/63/1014813163.db2.gz QYRIGMRLVCSBNC-QGZVFWFLSA-N 0 3 326.396 3.593 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NC[C@H]2CCCC[C@@H]2O)c2ccccc2)c1 ZINC000180612800 1016910692 /nfs/dbraw/zinc/91/06/92/1016910692.db2.gz XMNBZJCSZPKVEB-HOJAQTOUSA-N 0 3 340.423 3.825 20 5 EHBDHN CC(C)[C@H]1N(C/C=C\c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414527941 1016953971 /nfs/dbraw/zinc/95/39/71/1016953971.db2.gz NJYBVTZHILJHEM-LZCIBIBXSA-N 0 3 330.428 3.745 20 5 EHBDHN C[C@H](CC(=O)Nc1cccc(F)c1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449349566 1032464892 /nfs/dbraw/zinc/46/48/92/1032464892.db2.gz QXXPEUZVUWCBGW-OLZOCXBDSA-N 0 3 345.374 3.802 20 5 EHBDHN CC(C)(C)n1cc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449501159 1032680351 /nfs/dbraw/zinc/68/03/51/1032680351.db2.gz PARZJEHSTJVMKI-QGZVFWFLSA-N 0 3 342.443 3.926 20 5 EHBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCc1cnccc1OC ZINC000340401605 1017366243 /nfs/dbraw/zinc/36/62/43/1017366243.db2.gz XEMJSFGOYVOMCF-CQSZACIVSA-N 0 3 347.440 3.659 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@H](n2ncc3ccccc32)C1 ZINC000513412992 1019643969 /nfs/dbraw/zinc/64/39/69/1019643969.db2.gz FQJGSDCNOXFQJS-MTIYJEKLSA-N 0 3 348.406 3.905 20 5 EHBDHN COCC(C)(C)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000426314728 1021246293 /nfs/dbraw/zinc/24/62/93/1021246293.db2.gz QXMBJWVPRACZHO-GOSISDBHSA-N 0 3 328.412 3.946 20 5 EHBDHN CO[C@@H]([C@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000449633670 1032964953 /nfs/dbraw/zinc/96/49/53/1032964953.db2.gz UQPIZIORFVPSQV-SGTLLEGYSA-N 0 3 330.384 3.758 20 5 EHBDHN COc1ccccc1[C@H]1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000157895884 1021515797 /nfs/dbraw/zinc/51/57/97/1021515797.db2.gz HUKSTPBGYFEXHJ-HNNXBMFYSA-N 0 3 342.395 3.602 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1N1CCCN(Cc2ccccc2)CC1 ZINC000247353885 1021624979 /nfs/dbraw/zinc/62/49/79/1021624979.db2.gz XDIJAMQUBZNTHA-UHFFFAOYSA-N 0 3 345.830 3.961 20 5 EHBDHN C[C@@H]1C[C@H](C)CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000127274904 1021670874 /nfs/dbraw/zinc/67/08/74/1021670874.db2.gz SUSAXAMKTUKPHK-CHWSQXEVSA-N 0 3 330.388 3.513 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCCN(Cc3cccs3)C2)n1 ZINC000178201360 1022100032 /nfs/dbraw/zinc/10/00/32/1022100032.db2.gz LHOKEVPWLAWQKO-AWEZNQCLSA-N 0 3 346.456 3.684 20 5 EHBDHN Cc1cccc(CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000602652060 1033040917 /nfs/dbraw/zinc/04/09/17/1033040917.db2.gz VRVJMPQMOGHGET-UHFFFAOYSA-N 0 3 339.317 3.649 20 5 EHBDHN CC(C)OC1CC(NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000425961852 1022478490 /nfs/dbraw/zinc/47/84/90/1022478490.db2.gz VCLUQVMOQYCJSV-UHFFFAOYSA-N 0 3 332.322 3.659 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CCC[C@H](CCO)CC1 ZINC000602693293 1033073791 /nfs/dbraw/zinc/07/37/91/1033073791.db2.gz FJXRZFUUQHYYNG-LBPRGKRZSA-N 0 3 346.349 3.598 20 5 EHBDHN CC(C)(CNCc1nc2cc([N+](=O)[O-])ccc2o1)CC(F)(F)F ZINC000602716690 1033102806 /nfs/dbraw/zinc/10/28/06/1033102806.db2.gz WUHNTSWMSLIYDA-UHFFFAOYSA-N 0 3 331.294 3.804 20 5 EHBDHN O=[N+]([O-])c1sc(CNCCCc2ccco2)cc1Br ZINC000602723765 1033110648 /nfs/dbraw/zinc/11/06/48/1033110648.db2.gz SSVQUJFBJIQCEG-UHFFFAOYSA-N 0 3 345.218 3.734 20 5 EHBDHN Cc1ccc(Sc2ccc(CN[C@H](C)CO)cc2[N+](=O)[O-])cc1 ZINC000098173608 1023924278 /nfs/dbraw/zinc/92/42/78/1023924278.db2.gz NLZVMKFOGVUPKV-CYBMUJFWSA-N 0 3 332.425 3.525 20 5 EHBDHN C[C@@H](c1ccccc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000507003546 1024309182 /nfs/dbraw/zinc/30/91/82/1024309182.db2.gz WLQJUULOZPGUBZ-DZGCQCFKSA-N 0 3 329.375 3.981 20 5 EHBDHN Cc1cccc(C)c1[C@H](C)NCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000544893485 1024517807 /nfs/dbraw/zinc/51/78/07/1024517807.db2.gz FNHAUOGFAYJZQG-AWEZNQCLSA-N 0 3 327.384 3.501 20 5 EHBDHN CCOC(=O)C[C@@H](C)N(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346343883 1024667146 /nfs/dbraw/zinc/66/71/46/1024667146.db2.gz WDPPMVPAQJPMLM-CYBMUJFWSA-N 0 3 346.383 3.628 20 5 EHBDHN COc1ccccc1[C@@H](CNCc1cccc([N+](=O)[O-])c1)OC(C)C ZINC000185726861 1025700929 /nfs/dbraw/zinc/70/09/29/1025700929.db2.gz WQXKUFFFPWYSJZ-LJQANCHMSA-N 0 3 344.411 3.859 20 5 EHBDHN CCC[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)(C)C ZINC000451442255 1025973990 /nfs/dbraw/zinc/97/39/90/1025973990.db2.gz UZOBGQJVAQSSGK-CQSZACIVSA-N 0 3 332.404 3.949 20 5 EHBDHN COCCNc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000127107514 1026255317 /nfs/dbraw/zinc/25/53/17/1026255317.db2.gz ZLRRFOYRXVMOSR-HNNXBMFYSA-N 0 3 343.427 3.812 20 5 EHBDHN O=[N+]([O-])c1cccc(F)c1CNC1(Cc2ccccc2)CCOCC1 ZINC000451938132 1026383326 /nfs/dbraw/zinc/38/33/26/1026383326.db2.gz IESWQXVJHBSRPA-UHFFFAOYSA-N 0 3 344.386 3.615 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1-c1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000531110209 1026583418 /nfs/dbraw/zinc/58/34/18/1026583418.db2.gz UOBRZOIVRVDLSU-UHFFFAOYSA-N 0 3 338.367 3.682 20 5 EHBDHN O=[N+]([O-])c1ccccc1NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000366543697 1027373690 /nfs/dbraw/zinc/37/36/90/1027373690.db2.gz RZGQAMOHADHNKH-UHFFFAOYSA-N 0 3 343.349 3.812 20 5 EHBDHN Cc1cnc(NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000078668094 1028066915 /nfs/dbraw/zinc/06/69/15/1028066915.db2.gz NRPXYXQGNBOLEV-BBRMVZONSA-N 0 3 346.456 3.855 20 5 EHBDHN CCC[C@]1(CO)CCCN1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000444764442 1028252151 /nfs/dbraw/zinc/25/21/51/1028252151.db2.gz BESVWZLVJPCVKH-GOSISDBHSA-N 0 3 336.432 3.509 20 5 EHBDHN CCC[C@H](N[C@@H]1CCCc2c1cnn2C)c1cccc([N+](=O)[O-])c1 ZINC000268838642 1028601152 /nfs/dbraw/zinc/60/11/52/1028601152.db2.gz SZOSBIKPZFXMPN-DLBZAZTESA-N 0 3 328.416 3.837 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000532918390 1029069423 /nfs/dbraw/zinc/06/94/23/1029069423.db2.gz TVWJNQJALFDRQG-QANKJYHBSA-N 0 3 345.443 3.742 20 5 EHBDHN CC[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(OC)c(OC)c1 ZINC000269027661 1029072075 /nfs/dbraw/zinc/07/20/75/1029072075.db2.gz QXRYASWIBPZQOF-INIZCTEOSA-N 0 3 330.384 3.853 20 5 EHBDHN Cc1c(CNC2(c3ccccc3)CCOCC2)cccc1[N+](=O)[O-] ZINC000533060643 1029252114 /nfs/dbraw/zinc/25/21/14/1029252114.db2.gz DKXVCEZZTKRAAF-UHFFFAOYSA-N 0 3 326.396 3.699 20 5 EHBDHN CC[C@@H](C)N[C@@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000343257841 1029954813 /nfs/dbraw/zinc/95/48/13/1029954813.db2.gz ZMFIFAWYRINOJK-PWSUYJOCSA-N 0 3 338.795 3.778 20 5 EHBDHN CN(C)c1cccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000447540198 1030276089 /nfs/dbraw/zinc/27/60/89/1030276089.db2.gz JCYHWBSIDUAFGK-LJQANCHMSA-N 0 3 325.412 3.828 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(-n2cccn2)cc1 ZINC000532202644 1030476690 /nfs/dbraw/zinc/47/66/90/1030476690.db2.gz QBCQJCSTPJMDNC-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN CCOc1ccc([C@@H](C)N[C@H](C)c2cc[nH]c(=O)c2)cc1[N+](=O)[O-] ZINC000340448126 1030504980 /nfs/dbraw/zinc/50/49/80/1030504980.db2.gz GDUPUWUVPYTMNF-VXGBXAGGSA-N 0 3 331.372 3.506 20 5 EHBDHN CC(C)c1ccc(CN[C@H]2CCO[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000343409858 1030739854 /nfs/dbraw/zinc/73/98/54/1030739854.db2.gz SVSCQPVYFFNTKP-PKOBYXMFSA-N 0 3 341.411 3.733 20 5 EHBDHN CCS[C@H]1CC[C@H](N(C)Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000173487854 1033369959 /nfs/dbraw/zinc/36/99/59/1033369959.db2.gz NYBDKGJUYQAWRW-ZFWWWQNUSA-N 0 3 334.445 3.508 20 5 EHBDHN CC1(C)OC[C@H]2C[C@]21NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000598986449 1033612188 /nfs/dbraw/zinc/61/21/88/1033612188.db2.gz AFUPUDRJGIBPGS-ACJLOTCBSA-N 0 3 328.368 3.512 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H](C)c1nc(C)cs1 ZINC000595032015 1033652569 /nfs/dbraw/zinc/65/25/69/1033652569.db2.gz LCAVIGHTWWIZNH-ZYHUDNBSSA-N 0 3 335.429 3.823 20 5 EHBDHN COc1ccc([C@@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])C2CC2)cn1 ZINC000599095553 1033731714 /nfs/dbraw/zinc/73/17/14/1033731714.db2.gz GXGZCFZBSHKVNZ-APWZRJJASA-N 0 3 339.395 3.727 20 5 EHBDHN Cc1noc(CN2C[C@H](c3ccccc3)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000595545134 1033856399 /nfs/dbraw/zinc/85/63/99/1033856399.db2.gz ONLPOFYETGAMMF-OAHLLOKOSA-N 0 3 327.384 3.661 20 5 EHBDHN Cc1c(F)cccc1NC(=O)CCN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000411449396 1034884536 /nfs/dbraw/zinc/88/45/36/1034884536.db2.gz GEJQVHKLTXVYAD-ZDUSSCGKSA-N 0 3 345.374 3.722 20 5 EHBDHN CC1=C(c2ccco2)CN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000548930073 1034940976 /nfs/dbraw/zinc/94/09/76/1034940976.db2.gz FEWRPDQNDCLJNM-UHFFFAOYSA-N 0 3 328.368 3.746 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCc2cccnc2)c2ccccc2)c1 ZINC000180073387 1035368960 /nfs/dbraw/zinc/36/89/60/1035368960.db2.gz OIKPHVQNGNCQHU-HXUWFJFHSA-N 0 3 333.391 3.912 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](C)c1nc(C)cs1 ZINC000595032012 1037164353 /nfs/dbraw/zinc/16/43/53/1037164353.db2.gz LCAVIGHTWWIZNH-CMPLNLGQSA-N 0 3 335.429 3.823 20 5 EHBDHN CO[C@@H](CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000549390316 1037620288 /nfs/dbraw/zinc/62/02/88/1037620288.db2.gz ZNXWRVLFIYPQAX-IBGZPJMESA-N 0 3 326.396 3.947 20 5 EHBDHN CC[C@@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341221646 1037785248 /nfs/dbraw/zinc/78/52/48/1037785248.db2.gz QVBHBQJKBYYJCC-CXAGYDPISA-N 0 3 327.384 3.663 20 5 EHBDHN CO[C@H]1CCC[C@@H]1CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000540328651 1037827013 /nfs/dbraw/zinc/82/70/13/1037827013.db2.gz OWBCTZQYDFUUMM-CJNGLKHVSA-N 0 3 347.440 3.623 20 5 EHBDHN COc1ccc(CN[C@]2(C)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000538707804 1038483966 /nfs/dbraw/zinc/48/39/66/1038483966.db2.gz ZHBCCTQTSQUUEQ-LJQANCHMSA-N 0 3 326.396 3.945 20 5 EHBDHN CCOC(=O)CC1CCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000485797561 1039568174 /nfs/dbraw/zinc/56/81/74/1039568174.db2.gz YMRYJNNHRSFLCG-CQSZACIVSA-N 0 3 334.416 3.629 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CN(CCO)CC1CCCCC1 ZINC000485884329 1039671681 /nfs/dbraw/zinc/67/16/81/1039671681.db2.gz RLBIHMWTBJUYAH-UHFFFAOYSA-N 0 3 326.824 3.623 20 5 EHBDHN COc1ccc([C@H]2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3)C2)cc1 ZINC000489177919 1039701359 /nfs/dbraw/zinc/70/13/59/1039701359.db2.gz UFNRFKHHGYNPEY-INIZCTEOSA-N 0 3 342.395 3.602 20 5 EHBDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298577 1039813536 /nfs/dbraw/zinc/81/35/36/1039813536.db2.gz WZEQYKDAVIBUKV-NEPJUHHUSA-N 0 3 341.839 3.943 20 5 EHBDHN COc1c([O-])ccc(C[NH2+][C@H](C)CCCC(F)(F)F)c1[N+](=O)[O-] ZINC000894028784 1039994201 /nfs/dbraw/zinc/99/42/01/1039994201.db2.gz JHLBJNPGJSLHEY-SECBINFHSA-N 0 3 336.310 3.520 20 5 EHBDHN CN(C)Cc1cccc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000429844233 1040166257 /nfs/dbraw/zinc/16/62/57/1040166257.db2.gz XNHKCNFQMAYXSF-UHFFFAOYSA-N 0 3 341.411 3.573 20 5 EHBDHN CC(C)(NCc1cccc(-n2cccn2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000151022799 1040501844 /nfs/dbraw/zinc/50/18/44/1040501844.db2.gz LYSDDRSBYMFMJQ-UHFFFAOYSA-N 0 3 336.395 3.805 20 5 EHBDHN C[C@@H](N[C@@H]1CC2CCC1CC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000433062302 1040581863 /nfs/dbraw/zinc/58/18/63/1040581863.db2.gz SUIZOFDZNNGMAK-NEQJSVFRSA-N 0 3 342.399 3.874 20 5 EHBDHN C[C@@H](N[C@H]1CC2CCC1CC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000433062403 1040582341 /nfs/dbraw/zinc/58/23/41/1040582341.db2.gz SUIZOFDZNNGMAK-OCLKLICZSA-N 0 3 342.399 3.874 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1c(C)c(F)ccc1[N+](=O)[O-] ZINC000843814064 1041014770 /nfs/dbraw/zinc/01/47/70/1041014770.db2.gz GLCNHWCVYNRYNS-UHFFFAOYSA-N 0 3 345.374 3.665 20 5 EHBDHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000107070916 1041814707 /nfs/dbraw/zinc/81/47/07/1041814707.db2.gz UVIVOMFVYMNLDJ-NEPJUHHUSA-N 0 3 347.802 3.926 20 5 EHBDHN COc1cc(CN(C)C2CCCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000053778436 1041841125 /nfs/dbraw/zinc/84/11/25/1041841125.db2.gz ZEPCXNOROFWZAZ-UHFFFAOYSA-N 0 3 344.358 3.969 20 5 EHBDHN O=[N+]([O-])c1ccc2nc(NC[C@@H]3CCCCN3C3CC3)sc2c1 ZINC000764940158 1127552474 /nfs/dbraw/zinc/55/24/74/1127552474.db2.gz FXUAOWQRKVNPTB-ZDUSSCGKSA-N 0 3 332.429 3.633 20 5 EHBDHN COc1ccc2c(c1)nccc2NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000765472708 1127617249 /nfs/dbraw/zinc/61/72/49/1127617249.db2.gz OHGSGLOZFWYXFI-UHFFFAOYSA-N 0 3 339.351 3.772 20 5 EHBDHN COc1cc(NC[C@H](c2ccc(C)o2)N2CCCC2)ccc1[N+](=O)[O-] ZINC000301418002 1127742794 /nfs/dbraw/zinc/74/27/94/1127742794.db2.gz RJCSZIRDDYJVKQ-MRXNPFEDSA-N 0 3 345.399 3.754 20 5 EHBDHN CC[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000765846229 1128550203 /nfs/dbraw/zinc/55/02/03/1128550203.db2.gz WKNYNNZKOFQCNA-DLBZAZTESA-N 0 3 336.338 3.647 20 5 EHBDHN CN(C)[C@@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000301794642 1129084366 /nfs/dbraw/zinc/08/43/66/1129084366.db2.gz PWNPQHPBVMUTAL-HNNXBMFYSA-N 0 3 339.317 3.727 20 5 EHBDHN CCN(CC)C(=O)CCCNc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000181503875 1124899155 /nfs/dbraw/zinc/89/91/55/1124899155.db2.gz RRYTWYYIPJEURT-UHFFFAOYSA-N 0 3 344.415 3.512 20 5 EHBDHN COCCOc1cccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000080347079 1129348170 /nfs/dbraw/zinc/34/81/70/1129348170.db2.gz VRLRCPWQYIDMHW-UHFFFAOYSA-N 0 3 344.411 3.645 20 5 EHBDHN C[C@H]1CCC[C@H](C)N(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000125235370 1129672867 /nfs/dbraw/zinc/67/28/67/1129672867.db2.gz QCRDQFUORISOLM-STQMWFEESA-N 0 3 330.388 3.655 20 5 EHBDHN CCCCN(CC)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000131788039 1129841360 /nfs/dbraw/zinc/84/13/60/1129841360.db2.gz QLEBCFBIOQDKTP-NSHDSACASA-N 0 3 327.812 3.697 20 5 EHBDHN CCCCN(CC)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000131788236 1129841618 /nfs/dbraw/zinc/84/16/18/1129841618.db2.gz QLEBCFBIOQDKTP-LLVKDONJSA-N 0 3 327.812 3.697 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@@H]2C[C@H](O)c2cccs2)c1 ZINC000304785582 1129902178 /nfs/dbraw/zinc/90/21/78/1129902178.db2.gz OKOPZWXTGXKPDX-ZBFHGGJFSA-N 0 3 332.425 3.744 20 5 EHBDHN O=C(CN(C1CCC1)C1CCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000429165614 1129906044 /nfs/dbraw/zinc/90/60/44/1129906044.db2.gz SODKQOHEUCAUSN-UHFFFAOYSA-N 0 3 337.807 3.594 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000245710534 1130297562 /nfs/dbraw/zinc/29/75/62/1130297562.db2.gz FGHSMVRJFPVCSV-IUODEOHRSA-N 0 3 341.415 3.531 20 5 EHBDHN Cc1nc(C(C)(C)NCCCOc2ccc([N+](=O)[O-])cc2)sc1C ZINC000173959685 1130326213 /nfs/dbraw/zinc/32/62/13/1130326213.db2.gz WNVDNQNASSIPBQ-UHFFFAOYSA-N 0 3 349.456 3.962 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NC[C@H]2CCC[C@@H](O)C2)c2ccccc2)c1 ZINC000245953410 1130334527 /nfs/dbraw/zinc/33/45/27/1130334527.db2.gz LMXDYXDCLQPVJV-CWFSZBLJSA-N 0 3 340.423 3.825 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC[C@H]1CCN1Cc1ccccc1 ZINC000716276188 1131447262 /nfs/dbraw/zinc/44/72/62/1131447262.db2.gz HLOPVCLOQYJZOG-QGZVFWFLSA-N 0 3 345.830 3.612 20 5 EHBDHN O=C1CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H]2CCCC[C@@H]12 ZINC001172908404 1131887635 /nfs/dbraw/zinc/88/76/35/1131887635.db2.gz MDOITLZGSHBJDY-QRQLOZEOSA-N 0 3 342.439 3.676 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@H]3CCC[C@@H]3C2)c1F ZINC001173178275 1131992221 /nfs/dbraw/zinc/99/22/21/1131992221.db2.gz ACFXDYLKKMQTEN-BFHYXJOUSA-N 0 3 336.407 3.796 20 5 EHBDHN NCc1ccc2c(n1)N(c1cc3ccccc3c([N+](=O)[O-])c1)CCC2 ZINC001169591357 1132790023 /nfs/dbraw/zinc/79/00/23/1132790023.db2.gz HSMJGECGIGLINJ-UHFFFAOYSA-N 0 3 334.379 3.686 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCNCc2ccccc2OCC2CC2)cc1 ZINC001177683769 1133091165 /nfs/dbraw/zinc/09/11/65/1133091165.db2.gz UIKNJYRJTYFGLL-UHFFFAOYSA-N 0 3 342.395 3.552 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCOC3CCCC3)o2)cc1 ZINC001177729826 1133093696 /nfs/dbraw/zinc/09/36/96/1133093696.db2.gz YGUVXEIIZLSVDN-UHFFFAOYSA-N 0 3 330.384 3.904 20 5 EHBDHN COC[C@@H](CC(C)(C)C)NCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001179034822 1133225313 /nfs/dbraw/zinc/22/53/13/1133225313.db2.gz RBIYFMLAXAOKNA-GFCCVEGCSA-N 0 3 346.374 3.737 20 5 EHBDHN CSC1(CNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC001181243406 1133468300 /nfs/dbraw/zinc/46/83/00/1133468300.db2.gz HEELFSMZWFWRED-UHFFFAOYSA-N 0 3 334.363 3.989 20 5 EHBDHN Cc1cc(NCCCN2CCc3ccccc3C2)c([N+](=O)[O-])s1 ZINC001184821546 1133994688 /nfs/dbraw/zinc/99/46/88/1133994688.db2.gz SYUNJHGZIGUJFT-UHFFFAOYSA-N 0 3 331.441 3.825 20 5 EHBDHN CC[C@](C)(NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000775386016 1134696845 /nfs/dbraw/zinc/69/68/45/1134696845.db2.gz BULSBCPZARIDEB-IBGZPJMESA-N 0 3 341.411 3.757 20 5 EHBDHN COc1ccc(C[C@@H](C)N(C)Cc2ccc(Cl)nc2)c([N+](=O)[O-])c1 ZINC001170352937 1134754448 /nfs/dbraw/zinc/75/44/48/1134754448.db2.gz UXLQYHAPMPFGMH-GFCCVEGCSA-N 0 3 349.818 3.715 20 5 EHBDHN CN(CCN(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC001191682329 1134899580 /nfs/dbraw/zinc/89/95/80/1134899580.db2.gz PQAPSIRHYHCXDL-UHFFFAOYSA-N 0 3 325.412 3.696 20 5 EHBDHN CCCNCc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000101588381 1135356470 /nfs/dbraw/zinc/35/64/70/1135356470.db2.gz QTZXYBLCEONBMJ-UHFFFAOYSA-N 0 3 330.384 3.682 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2cnn(CN3CCC[C@@H](C4CC4)C3)c2)c1 ZINC000808230212 1135632703 /nfs/dbraw/zinc/63/27/03/1135632703.db2.gz GWRPIHXARIERKT-MRXNPFEDSA-N 0 3 326.400 3.538 20 5 EHBDHN C[C@]1(NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@@H]1C1CC1 ZINC000809975083 1135908142 /nfs/dbraw/zinc/90/81/42/1135908142.db2.gz WBLBBOCRVJDJNN-CABCVRRESA-N 0 3 345.226 3.949 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C)[C@@H](O)c1ccc(C)cc1 ZINC000850468338 1136265268 /nfs/dbraw/zinc/26/52/68/1136265268.db2.gz BOMPPMDNXVNXJC-IQUTYRLHSA-N 0 3 344.411 3.685 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C)[C@H](O)c1ccc(C)cc1 ZINC000850468339 1136265309 /nfs/dbraw/zinc/26/53/09/1136265309.db2.gz BOMPPMDNXVNXJC-KSMMKXTCSA-N 0 3 344.411 3.685 20 5 EHBDHN COc1cccc(C2(N[C@@H](C)c3ccc(N)c([N+](=O)[O-])c3)CCC2)c1 ZINC000850567094 1136287363 /nfs/dbraw/zinc/28/73/63/1136287363.db2.gz XNNKAQRXIPEWRO-ZDUSSCGKSA-N 0 3 341.411 3.916 20 5 EHBDHN Cc1ccc(-c2ccc(C(=O)OCC(C)[N+](=O)[O-])c(F)c2)cc1C ZINC000813102572 1136288138 /nfs/dbraw/zinc/28/81/38/1136288138.db2.gz SCQWNCKZAVCNBR-ZDUSSCGKSA-N 0 3 331.343 3.932 20 5 EHBDHN CCOc1ccccc1-c1cccc(C(=O)OCC(C)[N+](=O)[O-])c1 ZINC000813103914 1136288546 /nfs/dbraw/zinc/28/85/46/1136288546.db2.gz IBXIEMFPSKHPMW-ZDUSSCGKSA-N 0 3 329.352 3.574 20 5 EHBDHN CC(C)c1ccc(-c2nc(C(=O)OCC(C)[N+](=O)[O-])cs2)cc1 ZINC000813113683 1136294794 /nfs/dbraw/zinc/29/47/94/1136294794.db2.gz HUKSWYCYZZIVBW-LLVKDONJSA-N 0 3 334.397 3.756 20 5 EHBDHN CSc1ccc([C@@H](CNc2cc(N)ccc2[N+](=O)[O-])N(C)C)cc1 ZINC000814959665 1136532075 /nfs/dbraw/zinc/53/20/75/1136532075.db2.gz JUAASLNLRSXMQK-QGZVFWFLSA-N 0 3 346.456 3.614 20 5 EHBDHN C[C@H]1CCC[C@@]1(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816660469 1136746030 /nfs/dbraw/zinc/74/60/30/1136746030.db2.gz FURJEYKQAJZKCY-LKFCYVNXSA-N 0 3 333.215 3.542 20 5 EHBDHN CC(=O)N(C)c1ccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000858494775 1136973199 /nfs/dbraw/zinc/97/31/99/1136973199.db2.gz NLVSQEPOWHJLBB-CQSZACIVSA-N 0 3 341.411 3.737 20 5 EHBDHN CC(C)N(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCC1 ZINC000173480079 1137160079 /nfs/dbraw/zinc/16/00/79/1137160079.db2.gz RXLGMFDNNKOHMP-UHFFFAOYSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H](CSc1ccccc1)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362092 1137215336 /nfs/dbraw/zinc/21/53/36/1137215336.db2.gz XSEZFLYHLCEVTM-KDOFPFPSSA-N 0 3 346.452 3.741 20 5 EHBDHN Cc1ccc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cc1 ZINC000845872735 1137315868 /nfs/dbraw/zinc/31/58/68/1137315868.db2.gz MXYZEVSIUZDJHY-FZKQIMNGSA-N 0 3 331.343 3.626 20 5 EHBDHN CC([C@H](OC(=O)CCc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845874225 1137316065 /nfs/dbraw/zinc/31/60/65/1137316065.db2.gz YJZIRLBEZGCSOV-UGSOOPFHSA-N 0 3 331.343 3.708 20 5 EHBDHN CC([C@@H](OC(=O)C1(F)CCCCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845877763 1137316478 /nfs/dbraw/zinc/31/64/78/1137316478.db2.gz GTXUYQYAPFWLRJ-SMDDNHRTSA-N 0 3 327.327 3.748 20 5 EHBDHN CC(C)(C)OC(=O)CCC1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001171862311 1137516402 /nfs/dbraw/zinc/51/64/02/1137516402.db2.gz JZSBWSWZMWWSOJ-UHFFFAOYSA-N 0 3 348.443 3.929 20 5 EHBDHN Cc1ccc([C@H](C)NC[C@H](O)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000124746338 1137608314 /nfs/dbraw/zinc/60/83/14/1137608314.db2.gz HJDYQJLKPRJTHQ-GTNSWQLSSA-N 0 3 336.338 3.566 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1cccc(CN(C)C)c1 ZINC000873990780 1137608935 /nfs/dbraw/zinc/60/89/35/1137608935.db2.gz DHILXIQIHFWONL-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000877804828 1137690391 /nfs/dbraw/zinc/69/03/91/1137690391.db2.gz FAPDISZVZOJNPL-DGFSRKRXSA-N 0 3 344.333 3.661 20 5 EHBDHN CC[C@@H](C)[C@H](C)NCc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878365899 1137712914 /nfs/dbraw/zinc/71/29/14/1137712914.db2.gz GBDINKNRDGSTPV-ZJUUUORDSA-N 0 3 338.795 3.822 20 5 EHBDHN C[C@@H]1C[C@H](C)[C@H](C)N(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497110 1137717938 /nfs/dbraw/zinc/71/79/38/1137717938.db2.gz QTVGNSHLRMFMIN-AGIUHOORSA-N 0 3 330.388 3.511 20 5 EHBDHN C[C@H](NC(C)(C)c1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000348312990 1137938029 /nfs/dbraw/zinc/93/80/29/1137938029.db2.gz FJZPRGCJDKJXFU-NSHDSACASA-N 0 3 333.413 3.508 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@@H](c2ncccn2)C1 ZINC000886685949 1138115129 /nfs/dbraw/zinc/11/51/29/1138115129.db2.gz HGJWUBWRTKQUAU-HUUCEWRRSA-N 0 3 326.400 3.634 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H](C)[C@@H](C)C1 ZINC000123078693 1138266035 /nfs/dbraw/zinc/26/60/35/1138266035.db2.gz XWJJRVJVCAPJGK-AGIUHOORSA-N 0 3 330.388 3.684 20 5 EHBDHN Cc1ccccc1NC(=O)CCN[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181810927 1139933146 /nfs/dbraw/zinc/93/31/46/1139933146.db2.gz KCWCRHZLQRZONC-HNNXBMFYSA-N 0 3 341.411 3.891 20 5 EHBDHN CC1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)OCCCO1 ZINC000192252467 1140514867 /nfs/dbraw/zinc/51/48/67/1140514867.db2.gz IEKGOWZYPNJHIL-UHFFFAOYSA-N 0 3 348.424 3.566 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC[C@@H]2Cn2cnc3ccccc32)cc1 ZINC000339905526 1015873765 /nfs/dbraw/zinc/87/37/65/1015873765.db2.gz MGMABUBANYZJQR-QGZVFWFLSA-N 0 3 336.395 3.609 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H](C[C@H]2CCOC2)c2ccccc2)cc1F ZINC000278746246 1032290578 /nfs/dbraw/zinc/29/05/78/1032290578.db2.gz WTGCZHRXNOOWDM-QAPCUYQASA-N 0 3 344.386 3.991 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CC4(C3)CCCOC4)s2)cc1 ZINC000459615898 1032352910 /nfs/dbraw/zinc/35/29/10/1032352910.db2.gz ZQOJRMMYHDPVNJ-UHFFFAOYSA-N 0 3 344.436 3.936 20 5 EHBDHN Cc1cccc(C)c1[C@@H](C)N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000544893824 1017260076 /nfs/dbraw/zinc/26/00/76/1017260076.db2.gz MUWINFAPGHEBSM-HUUCEWRRSA-N 0 3 341.411 3.889 20 5 EHBDHN Cc1ccccc1[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000537290974 1032596054 /nfs/dbraw/zinc/59/60/54/1032596054.db2.gz UFNGJJRKNSDGKA-LJQANCHMSA-N 0 3 339.395 3.583 20 5 EHBDHN CC(C)c1ccc(CN2CC[C@H](Cc3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000093870288 1032917339 /nfs/dbraw/zinc/91/73/39/1032917339.db2.gz MSMMPSGWHNIFKM-MRXNPFEDSA-N 0 3 342.443 3.516 20 5 EHBDHN C[C@@H](CCc1ccccc1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602504462 1032938353 /nfs/dbraw/zinc/93/83/53/1032938353.db2.gz QMZHDYZZYFHZFX-ZDUSSCGKSA-N 0 3 325.368 3.847 20 5 EHBDHN C[C@@H](NCCc1cccc([N+](=O)[O-])c1)c1nc2c(s1)CCCC2 ZINC000090909891 1021689177 /nfs/dbraw/zinc/68/91/77/1021689177.db2.gz SZIHIUOGQUYUAW-GFCCVEGCSA-N 0 3 331.441 3.823 20 5 EHBDHN CN1CC2(C1)CCN(C(=O)c1c3ccccc3nc3ccccc31)CC2 ZINC001270260923 1022115843 /nfs/dbraw/zinc/11/58/43/1022115843.db2.gz IWUOSASWXSXDOK-UHFFFAOYSA-N 0 3 345.446 3.556 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(-n2cncn2)cc1 ZINC000178325495 1022668722 /nfs/dbraw/zinc/66/87/22/1022668722.db2.gz IVXIAYLPIPWLEZ-KGLIPLIRSA-N 0 3 337.383 3.587 20 5 EHBDHN CCCN(Cc1cccc([N+](=O)[O-])c1)C[C@H]1COc2ccccc2O1 ZINC000610705516 1023276589 /nfs/dbraw/zinc/27/65/89/1023276589.db2.gz RIBLUEHQPADKBV-KRWDZBQOSA-N 0 3 342.395 3.647 20 5 EHBDHN C[C@H](C[C@@H]1CCOC1)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610740640 1023403057 /nfs/dbraw/zinc/40/30/57/1023403057.db2.gz XERKNQOIYCNJKG-OLZOCXBDSA-N 0 3 347.440 3.623 20 5 EHBDHN CCC(C)(C)N1CCN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000594074726 1033147196 /nfs/dbraw/zinc/14/71/96/1033147196.db2.gz OJEKVLRWVYTQMC-UHFFFAOYSA-N 0 3 348.447 3.550 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CC[C@@H](c3ccc4cccnc4n3)C2)c1 ZINC000602883985 1033233475 /nfs/dbraw/zinc/23/34/75/1033233475.db2.gz AFVYLFHFBCOFBK-MRXNPFEDSA-N 0 3 334.379 3.528 20 5 EHBDHN C[C@H](c1ccc(F)c(F)c1)N(C)CCOc1cccc([N+](=O)[O-])c1 ZINC000515123991 1025034564 /nfs/dbraw/zinc/03/45/64/1025034564.db2.gz SHVSOWIRZUZHPQ-GFCCVEGCSA-N 0 3 336.338 3.945 20 5 EHBDHN O=[N+]([O-])c1cccc(F)c1CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000438996711 1025385191 /nfs/dbraw/zinc/38/51/91/1025385191.db2.gz PPOLSGIVJKGAMM-XCRHUMRWSA-N 0 3 336.407 3.640 20 5 EHBDHN CC[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000738417608 1026076764 /nfs/dbraw/zinc/07/67/64/1026076764.db2.gz RAQBFCDBVOTHAZ-DLBZAZTESA-N 0 3 336.338 3.647 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc(CN3CC[C@H](C4CCCC4)C3)n2)cc1 ZINC000420958745 1027928831 /nfs/dbraw/zinc/92/88/31/1027928831.db2.gz CLPIMNJYUZYSMP-HNNXBMFYSA-N 0 3 342.399 3.657 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCCOC3)o2)c(Cl)c1 ZINC000237816836 1028067830 /nfs/dbraw/zinc/06/78/30/1028067830.db2.gz WKGHKOCGGMVQNA-NSHDSACASA-N 0 3 336.775 3.777 20 5 EHBDHN CC[C@H](c1ccc(F)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496892 1028090651 /nfs/dbraw/zinc/09/06/51/1028090651.db2.gz TUFRHUSGOXDCPR-NVXWUHKLSA-N 0 3 344.390 3.766 20 5 EHBDHN CCOc1ccc([C@@H](C)NCCOc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000504920411 1029044885 /nfs/dbraw/zinc/04/48/85/1029044885.db2.gz OPQFEIWPMLFPRP-CYBMUJFWSA-N 0 3 348.374 3.862 20 5 EHBDHN CCOc1ccc2c(c1)CCN(CCc1ccc([N+](=O)[O-])cc1)C2 ZINC000441094293 1029792840 /nfs/dbraw/zinc/79/28/40/1029792840.db2.gz JMYRABPVDWYWNJ-UHFFFAOYSA-N 0 3 326.396 3.594 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCc1ccc2[nH]ccc2c1 ZINC000441241133 1030090426 /nfs/dbraw/zinc/09/04/26/1030090426.db2.gz YGHFIVMSDHDCAV-UHFFFAOYSA-N 0 3 339.395 3.807 20 5 EHBDHN O=[N+]([O-])c1ccccc1C[C@@H](NCc1cnc(C2CC2)o1)C1CC1 ZINC000453380192 1030204502 /nfs/dbraw/zinc/20/45/02/1030204502.db2.gz ZELNETKONSDMFI-MRXNPFEDSA-N 0 3 327.384 3.571 20 5 EHBDHN CCCc1ncc(CN[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)o1 ZINC000453393419 1030242014 /nfs/dbraw/zinc/24/20/14/1030242014.db2.gz RQDFVYMYYWWJLX-INIZCTEOSA-N 0 3 329.400 3.646 20 5 EHBDHN C[C@@H]1CCCC[C@H]1N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623421 1030793172 /nfs/dbraw/zinc/79/31/72/1030793172.db2.gz AFUFJFGCNGIEKP-IAQYHMDHSA-N 0 3 339.823 3.697 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCC[C@H]3CC3(F)F)cs2)c1 ZINC000598647459 1033363691 /nfs/dbraw/zinc/36/36/91/1033363691.db2.gz MMFZUENCXBDAJG-NSHDSACASA-N 0 3 339.367 3.853 20 5 EHBDHN CC1(C)OC[C@@H]2C[C@@]21NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000598986454 1033611862 /nfs/dbraw/zinc/61/18/62/1033611862.db2.gz AFUPUDRJGIBPGS-SCLBCKFNSA-N 0 3 328.368 3.512 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCC[C@H]3CCCOC3)cs2)c1 ZINC000598985019 1033632873 /nfs/dbraw/zinc/63/28/73/1033632873.db2.gz GMRUNOCJLUPRFK-CYBMUJFWSA-N 0 3 347.440 3.625 20 5 EHBDHN Cc1csc([C@@H](C)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000599046697 1033678105 /nfs/dbraw/zinc/67/81/05/1033678105.db2.gz KQQYNGHVANYEKC-LLVKDONJSA-N 0 3 330.413 3.734 20 5 EHBDHN COc1cccc(OC)c1CN[C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000595075793 1033693382 /nfs/dbraw/zinc/69/33/82/1033693382.db2.gz YVZPSVOVHIKPBZ-AWEZNQCLSA-N 0 3 344.411 3.723 20 5 EHBDHN C[C@H](CCO)N(C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000593694701 1033803343 /nfs/dbraw/zinc/80/33/43/1033803343.db2.gz QGXVPDLDYFUOPN-CYBMUJFWSA-N 0 3 348.374 3.729 20 5 EHBDHN COc1ccc([C@H]2CCN(Cc3ccccc3[N+](=O)[O-])C2)cc1F ZINC000599677014 1034084556 /nfs/dbraw/zinc/08/45/56/1034084556.db2.gz GEZXEZSPZOTISK-AWEZNQCLSA-N 0 3 330.359 3.732 20 5 EHBDHN COc1cc(N[C@@H]2CCN(C(C)(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596336137 1034179030 /nfs/dbraw/zinc/17/90/30/1034179030.db2.gz NAYWQKQIFSODNZ-SNVBAGLBSA-N 0 3 327.812 3.542 20 5 EHBDHN C[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCO1 ZINC000179397387 1034280331 /nfs/dbraw/zinc/28/03/31/1034280331.db2.gz IVNIQRFEIFZRBQ-ZDUSSCGKSA-N 0 3 332.425 3.934 20 5 EHBDHN COCC1(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000594509789 1034591207 /nfs/dbraw/zinc/59/12/07/1034591207.db2.gz HGZBWDALZYGBRU-GOSISDBHSA-N 0 3 326.396 3.700 20 5 EHBDHN Cc1c([C@H](C)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000164535598 1035655202 /nfs/dbraw/zinc/65/52/02/1035655202.db2.gz IDXIPSDFYFZKEP-UONOGXRCSA-N 0 3 349.431 3.563 20 5 EHBDHN CCN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCO1 ZINC000511504783 1035905094 /nfs/dbraw/zinc/90/50/94/1035905094.db2.gz AMEBYCYLYMQKHH-MRXNPFEDSA-N 0 3 330.384 3.856 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000056201702 1036139974 /nfs/dbraw/zinc/13/99/74/1036139974.db2.gz NWINZMQIQHUXKZ-ZIAGYGMSSA-N 0 3 327.384 3.581 20 5 EHBDHN COc1cc(CN2CCC[C@H]2C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000609133524 1036566860 /nfs/dbraw/zinc/56/68/60/1036566860.db2.gz DXBGFJMOFRBVPT-LBPRGKRZSA-N 0 3 342.342 3.579 20 5 EHBDHN C[C@H](N[C@H]1CCCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191290605 1036890546 /nfs/dbraw/zinc/89/05/46/1036890546.db2.gz GKIYEJFGJXXJCQ-FZMZJTMJSA-N 0 3 330.388 3.874 20 5 EHBDHN Cc1c(CN[C@H](c2cccs2)C2(CO)CCC2)cccc1[N+](=O)[O-] ZINC000452063513 1036944995 /nfs/dbraw/zinc/94/49/95/1036944995.db2.gz WRAKPRLZWBALLD-QGZVFWFLSA-N 0 3 346.452 3.958 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC(C)(C)C[C@H]1C ZINC000412031153 1036991396 /nfs/dbraw/zinc/99/13/96/1036991396.db2.gz AMUPJCXCPXKGKX-NEPJUHHUSA-N 0 3 330.388 3.826 20 5 EHBDHN Cc1ccc([C@@H](C)NC[C@@H](O)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000271800031 1037295647 /nfs/dbraw/zinc/29/56/47/1037295647.db2.gz PESJYSWBMYYIKQ-PIGZYNQJSA-N 0 3 336.338 3.566 20 5 EHBDHN CCN(CCC1CC1)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000760883250 1037553599 /nfs/dbraw/zinc/55/35/99/1037553599.db2.gz BCSWVQAHHDNSMV-NSHDSACASA-N 0 3 339.823 3.697 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCCSCC(F)(F)F ZINC000698969981 1037638866 /nfs/dbraw/zinc/63/88/66/1037638866.db2.gz YKHALEIRQMPSMV-UHFFFAOYSA-N 0 3 328.743 3.633 20 5 EHBDHN COc1cc(F)c([C@@H](C)NCCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000540150520 1037623206 /nfs/dbraw/zinc/62/32/06/1037623206.db2.gz GKDSVGXZMXYZBZ-GFCCVEGCSA-N 0 3 348.374 3.644 20 5 EHBDHN COc1ccc(CN[C@@H]2c3cc(F)ccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000540173948 1037642464 /nfs/dbraw/zinc/64/24/64/1037642464.db2.gz NLMBMVKLTCKRAJ-VOJFVSQTSA-N 0 3 330.359 3.766 20 5 EHBDHN CCC1CCC(N(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C2CC2)CC1 ZINC000053169652 1037941828 /nfs/dbraw/zinc/94/18/28/1037941828.db2.gz USTRLUGOHKITEW-UHFFFAOYSA-N 0 3 345.443 3.627 20 5 EHBDHN O=[N+]([O-])c1cc(CN2CCCC[C@H]2C2CCC2)c2c(c1)COCO2 ZINC000592198794 1037943585 /nfs/dbraw/zinc/94/35/85/1037943585.db2.gz VEMHYIQHBODJLP-KRWDZBQOSA-N 0 3 332.400 3.616 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nnc(CN3CCCC[C@H]3C3CCC3)o2)cc1 ZINC000592198765 1037943934 /nfs/dbraw/zinc/94/39/34/1037943934.db2.gz SGJFKDBSDBHXHL-INIZCTEOSA-N 0 3 342.399 3.799 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCCC[C@H]2OC(F)F)c(Cl)c1 ZINC000500568118 1039000415 /nfs/dbraw/zinc/00/04/15/1039000415.db2.gz GFUOHJIBSAXTCY-CHWSQXEVSA-N 0 3 334.750 3.888 20 5 EHBDHN CCN(CCn1ccc([N+](=O)[O-])n1)Cc1ccc(Cl)c(Cl)c1 ZINC000478424268 1039445536 /nfs/dbraw/zinc/44/55/36/1039445536.db2.gz DACBECVLIVEIDU-UHFFFAOYSA-N 0 3 343.214 3.620 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](SC)C(C)(C)C ZINC000542315658 1040735558 /nfs/dbraw/zinc/73/55/58/1040735558.db2.gz UJUWOJIACNVBET-HNNXBMFYSA-N 0 3 326.462 3.861 20 5 EHBDHN Cc1cc(N[C@H]2CCN(C3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549507293 1041394768 /nfs/dbraw/zinc/39/47/68/1041394768.db2.gz BDSDDNUMFNHJTO-JTQLQIEISA-N 0 3 329.322 3.571 20 5 EHBDHN Cc1cc(C)cc([C@H](C)N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000107072390 1041814971 /nfs/dbraw/zinc/81/49/71/1041814971.db2.gz BZGFPRFSLOUBKH-GJZGRUSLSA-N 0 3 341.411 3.889 20 5 EHBDHN Cc1ccc(Sc2ccc(CNC[C@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000120374446 1042772297 /nfs/dbraw/zinc/77/22/97/1042772297.db2.gz NFPBVMLHPWXHLB-ZDUSSCGKSA-N 0 3 332.425 3.525 20 5 EHBDHN CC[C@@H]1CCC[C@H]1N[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000279239363 1043639920 /nfs/dbraw/zinc/63/99/20/1043639920.db2.gz JWOLGSLRJKRMCZ-YWPYICTPSA-N 0 3 330.388 3.874 20 5 EHBDHN Cc1ccc(C[C@@H](CO)NCc2ccc(Cl)cc2[N+](=O)[O-])cc1C ZINC001658277486 1126261882 /nfs/dbraw/zinc/26/18/82/1126261882.db2.gz VJBRVAQFBYPHPR-KRWDZBQOSA-N 0 3 348.830 3.558 20 5 EHBDHN CCC[C@@H](NCc1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000130942101 1129007448 /nfs/dbraw/zinc/00/74/48/1129007448.db2.gz SCRZCZNSPCWDQL-QGZVFWFLSA-N 0 3 342.399 3.716 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN[C@@H](c2ccccc2)c2ccccn2)cc1 ZINC000326435869 1121942430 /nfs/dbraw/zinc/94/24/30/1121942430.db2.gz XSBDVODAGNDQSK-FQEVSTJZSA-N 0 3 333.391 3.912 20 5 EHBDHN Cc1cc([N+](=O)[O-])cnc1NCC(C)(C)N1CCc2ccccc2C1 ZINC000301189935 1122321072 /nfs/dbraw/zinc/32/10/72/1122321072.db2.gz LURSTZFXMPVHLG-UHFFFAOYSA-N 0 3 340.427 3.547 20 5 EHBDHN Cc1c(CNCc2ccc(NC(=O)C(C)C)cc2)cccc1[N+](=O)[O-] ZINC000917134654 1122529372 /nfs/dbraw/zinc/52/93/72/1122529372.db2.gz ICFZEFPJELYIIT-UHFFFAOYSA-N 0 3 341.411 3.788 20 5 EHBDHN CCC(CC)CN(CC)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000917454074 1122611156 /nfs/dbraw/zinc/61/11/56/1122611156.db2.gz HNKPORXRMHVWPY-UHFFFAOYSA-N 0 3 331.420 3.569 20 5 EHBDHN CC[C@H]1c2ccccc2CCN1CCOc1ccccc1[N+](=O)[O-] ZINC000609625622 1123627943 /nfs/dbraw/zinc/62/79/43/1123627943.db2.gz CXKDLVUASJAOFQ-KRWDZBQOSA-N 0 3 326.396 3.983 20 5 EHBDHN Cc1cc(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)n[nH]1 ZINC000610009948 1123712963 /nfs/dbraw/zinc/71/29/63/1123712963.db2.gz JHBGLJACZUSOSD-UHFFFAOYSA-N 0 3 328.397 3.645 20 5 EHBDHN CCOC(=O)CC[C@@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255687114 1129180697 /nfs/dbraw/zinc/18/06/97/1129180697.db2.gz SBJSPKZBTVGACV-HWYHOQROSA-N 0 3 346.427 3.663 20 5 EHBDHN CC[C@@H](NC[C@@H](O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000124766186 1129632102 /nfs/dbraw/zinc/63/21/02/1129632102.db2.gz MJVFNPVQPBLENV-IAGOWNOFSA-N 0 3 336.338 3.647 20 5 EHBDHN Cc1cc(N[C@H]2CCN(c3ccccn3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302092074 1129767655 /nfs/dbraw/zinc/76/76/55/1129767655.db2.gz QAAYOFWGKYLXGO-AWEZNQCLSA-N 0 3 349.394 3.537 20 5 EHBDHN Cc1cc(NCCc2cn3ccccc3n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302183791 1129771733 /nfs/dbraw/zinc/77/17/33/1129771733.db2.gz OPKPKIRTKGAURN-UHFFFAOYSA-N 0 3 347.378 3.754 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@@H]2C[C@@H](O)c2cccs2)c1 ZINC000304785579 1129902147 /nfs/dbraw/zinc/90/21/47/1129902147.db2.gz OKOPZWXTGXKPDX-GDBMZVCRSA-N 0 3 332.425 3.744 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N[C@@H](C)c2cccc(C)n2)c1F ZINC001173188035 1131993433 /nfs/dbraw/zinc/99/34/33/1131993433.db2.gz HYLOYPCRNVIIBO-OLZOCXBDSA-N 0 3 347.390 3.728 20 5 EHBDHN CC(C)C[C@@H](N)c1nc2ccccc2n1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168990237 1132634515 /nfs/dbraw/zinc/63/45/15/1132634515.db2.gz YUOIIIBSAMEHOZ-RRFJBIMHSA-N 0 3 330.432 3.700 20 5 EHBDHN CCCCN(CCn1ccc([N+](=O)[O-])n1)Cc1c(C)oc(C)c1C ZINC001176364866 1132922722 /nfs/dbraw/zinc/92/27/22/1132922722.db2.gz IBOFVOFMXPKANA-UHFFFAOYSA-N 0 3 334.420 3.612 20 5 EHBDHN Cc1ccc(CN2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246257 1133250711 /nfs/dbraw/zinc/25/07/11/1133250711.db2.gz YOWMXNWIGUYFLE-UYAOXDASSA-N 0 3 340.423 3.991 20 5 EHBDHN Cc1cc(CCNCc2cc([N+](=O)[O-])ccc2Cl)cc(C)c1O ZINC000786827238 1133905103 /nfs/dbraw/zinc/90/51/03/1133905103.db2.gz KXQVNKJPONPNQI-UHFFFAOYSA-N 0 3 334.803 3.903 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000774826211 1134026825 /nfs/dbraw/zinc/02/68/25/1134026825.db2.gz LYFBRKSBJYRBIJ-MRXNPFEDSA-N 0 3 341.367 3.710 20 5 EHBDHN C[C@H]1[C@@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907257 1134115687 /nfs/dbraw/zinc/11/56/87/1134115687.db2.gz GHVBJHIXGZQUFS-GUYCJALGSA-N 0 3 341.367 3.881 20 5 EHBDHN CN(C)CC(C)(C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC001186639733 1134241306 /nfs/dbraw/zinc/24/13/06/1134241306.db2.gz NMTZLVXHCTWNJW-UHFFFAOYSA-N 0 3 341.411 3.578 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCC[C@@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344942 1134758894 /nfs/dbraw/zinc/75/88/94/1134758894.db2.gz FSOCCLMTBDCXFX-DGCLKSJQSA-N 0 3 328.359 3.512 20 5 EHBDHN CC(C)O[C@H]1C[C@H](NCc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001170386073 1134762610 /nfs/dbraw/zinc/76/26/10/1134762610.db2.gz MJQXZTJMKUYTKS-GJZGRUSLSA-N 0 3 326.824 3.930 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(C(C)(C)O)cc1 ZINC000775568707 1135095931 /nfs/dbraw/zinc/09/59/31/1135095931.db2.gz PUHSZCBCSXZTRD-CQSZACIVSA-N 0 3 328.412 3.981 20 5 EHBDHN COCCN(Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CC[C@H](C)C1 ZINC001193974791 1135208268 /nfs/dbraw/zinc/20/82/68/1135208268.db2.gz CKHAOLVFLRTEFN-WFASDCNBSA-N 0 3 326.824 3.885 20 5 EHBDHN CC[C@H]1CN(CC)CCN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001194325122 1135257037 /nfs/dbraw/zinc/25/70/37/1135257037.db2.gz QCTLGZVJTYAVNA-ZDUSSCGKSA-N 0 3 345.365 3.530 20 5 EHBDHN CC[C@@H](c1ccccc1OC)N(C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834344 1135332622 /nfs/dbraw/zinc/33/26/22/1135332622.db2.gz FWOAMEDKWYVDSD-ROUUACIJSA-N 0 3 344.411 3.720 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1COC2(CCCCC2)O1 ZINC000776169987 1136020338 /nfs/dbraw/zinc/02/03/38/1136020338.db2.gz HKDIOKNAVBVMNS-GDBMZVCRSA-N 0 3 334.416 3.630 20 5 EHBDHN CCC(O)(CC)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811493175 1136093558 /nfs/dbraw/zinc/09/35/58/1136093558.db2.gz FVXFKRJQOZMKOD-UHFFFAOYSA-N 0 3 335.231 3.932 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c1 ZINC000776252649 1136101850 /nfs/dbraw/zinc/10/18/50/1136101850.db2.gz VJRKOVPMYLCWCY-NUEKZKHPSA-N 0 3 336.819 3.686 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C)[C@](C)(O)c1ccccc1 ZINC000850477248 1136266867 /nfs/dbraw/zinc/26/68/67/1136266867.db2.gz RVHFBJJGKQXJLT-NJSLBKSFSA-N 0 3 344.411 3.550 20 5 EHBDHN CC(COC(=O)CCCc1cc(Cl)sc1Cl)[N+](=O)[O-] ZINC000813111152 1136294900 /nfs/dbraw/zinc/29/49/00/1136294900.db2.gz PAMPIIBUNSLDHQ-ZETCQYMHSA-N 0 3 326.201 3.586 20 5 EHBDHN Cc1ccc([C@@H](C)NCCC(=O)OCc2ccccc2)cc1[N+](=O)[O-] ZINC000776606178 1136471359 /nfs/dbraw/zinc/47/13/59/1136471359.db2.gz SVOCKDCWUVLEQO-OAHLLOKOSA-N 0 3 342.395 3.687 20 5 EHBDHN CC([C@@H](OC(=O)C[C@@H](C)c1ccco1)c1ccccc1F)[N+](=O)[O-] ZINC000860854564 1137081220 /nfs/dbraw/zinc/08/12/20/1137081220.db2.gz CUVQYCIIYGQGAY-BWACUDIHSA-N 0 3 335.331 3.862 20 5 EHBDHN CSCC1(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])CC1 ZINC000845875806 1137316138 /nfs/dbraw/zinc/31/61/38/1137316138.db2.gz CLFDFLNLEZHRIH-XHDPSFHLSA-N 0 3 341.404 3.609 20 5 EHBDHN Cc1sccc1CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845880020 1137316876 /nfs/dbraw/zinc/31/68/76/1137316876.db2.gz JXXVBKGLANAQSY-QLJPJBMISA-N 0 3 337.372 3.688 20 5 EHBDHN CCCc1nc(C)c(CN[C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])o1 ZINC000866364866 1137349744 /nfs/dbraw/zinc/34/97/44/1137349744.db2.gz QLIZIXNZVWQIDK-LLVKDONJSA-N 0 3 335.379 3.704 20 5 EHBDHN CCCC[C@](CC)(Nc1cc2c(cc1[N+](=O)[O-])CNC2)C(=O)OCC ZINC001171230865 1137355185 /nfs/dbraw/zinc/35/51/85/1137355185.db2.gz IGHOSZCHNXZSHN-SFHVURJKSA-N 0 3 349.431 3.512 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCCN2CCC(c3ccco3)CC2)cc1 ZINC001171835214 1137515456 /nfs/dbraw/zinc/51/54/56/1137515456.db2.gz UWSUVRMWRYMVKF-UHFFFAOYSA-N 0 3 330.384 3.836 20 5 EHBDHN C[C@H](CC(=O)N(C)c1ccccc1)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129788 1137573106 /nfs/dbraw/zinc/57/31/06/1137573106.db2.gz TZLRSULDVHQSIH-HUUCEWRRSA-N 0 3 341.411 3.687 20 5 EHBDHN COCCCOc1ccc(CNCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000873126907 1137590830 /nfs/dbraw/zinc/59/08/30/1137590830.db2.gz YVMSJVVLQPVCFS-UHFFFAOYSA-N 0 3 344.411 3.608 20 5 EHBDHN CC(C)[C@@H]1CCCCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878111750 1137703022 /nfs/dbraw/zinc/70/30/22/1137703022.db2.gz CYPDGDZSYOCBNN-AWEZNQCLSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@@H]1CC[C@H](NCc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000878447309 1137716294 /nfs/dbraw/zinc/71/62/94/1137716294.db2.gz LKKDUMIJSFZSMP-BZPMIXESSA-N 0 3 330.388 3.559 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H](c2ccc(F)cc2)C2CCOCC2)cc1 ZINC000883200686 1137848245 /nfs/dbraw/zinc/84/82/45/1137848245.db2.gz OSHNMPPEZOFPTB-LJQANCHMSA-N 0 3 344.386 3.991 20 5 EHBDHN CC(C)OCCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113313371 1137912520 /nfs/dbraw/zinc/91/25/20/1137912520.db2.gz VHFUTLBQOKTUSJ-UHFFFAOYSA-N 0 3 335.429 3.623 20 5 EHBDHN CC(C)N(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCC1 ZINC000068449324 1138084743 /nfs/dbraw/zinc/08/47/43/1138084743.db2.gz KINOLPWFJGJEPZ-UHFFFAOYSA-N 0 3 330.388 3.798 20 5 EHBDHN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384752 1139486955 /nfs/dbraw/zinc/48/69/55/1139486955.db2.gz KDLXXJFYCIOTSV-JBEBIEQOSA-N 0 3 346.452 3.568 20 5 EHBDHN CC(=O)Nc1ccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000182004591 1139945100 /nfs/dbraw/zinc/94/51/00/1139945100.db2.gz LVMMPFBQSBWWDZ-QWHCGFSZSA-N 0 3 327.384 3.965 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC(c3ccsc3)CC2)c1 ZINC000186947525 1140229244 /nfs/dbraw/zinc/22/92/44/1140229244.db2.gz LBYACTQSEWDPAG-QGZVFWFLSA-N 0 3 332.425 3.569 20 5 EHBDHN C[C@@H](O)c1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192724023 1140547252 /nfs/dbraw/zinc/54/72/52/1140547252.db2.gz HMAYABNBDWIFCQ-YJYMSZOUSA-N 0 3 326.396 3.815 20 5 EHBDHN CC(C)(C)[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000270667646 1141253520 /nfs/dbraw/zinc/25/35/20/1141253520.db2.gz PUWIRWCJPKVYCF-WFASDCNBSA-N 0 3 326.824 3.932 20 5 EHBDHN C[C@@H](NC(=O)Nc1cccc(CN(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000271617043 1141406690 /nfs/dbraw/zinc/40/66/90/1141406690.db2.gz DHUVAVMTZIJLRI-CYBMUJFWSA-N 0 3 342.399 3.539 20 5 EHBDHN C[C@@H]1CN(c2ccc3ccc4ccc(Cl)nc4c3n2)[C@H](C)CN1C ZINC001164643635 719205239 /nfs/dbraw/zinc/20/52/39/719205239.db2.gz ZVADVIGMJFPKTK-CHWSQXEVSA-N 0 3 340.858 3.965 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000359872787 1015883249 /nfs/dbraw/zinc/88/32/49/1015883249.db2.gz PRWIPTCMUMLVSI-HKUYNNGSSA-N 0 3 326.396 3.771 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](N[C@H]2CCc3c[nH]nc3C2)c2ccccc2)c1 ZINC000359895404 1015910413 /nfs/dbraw/zinc/91/04/13/1015910413.db2.gz GWIYINRSQQWNND-PXNSSMCTSA-N 0 3 348.406 3.554 20 5 EHBDHN CC[C@H](C)[C@@H](N)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000430383826 1016578415 /nfs/dbraw/zinc/57/84/15/1016578415.db2.gz JJRXJNYEOLBISG-YVEFUNNKSA-N 0 3 343.383 3.699 20 5 EHBDHN C[C@H](CN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1cccc(Cl)c1 ZINC000376652497 1016954136 /nfs/dbraw/zinc/95/41/36/1016954136.db2.gz QVFSSXCEHUBPOO-CYBMUJFWSA-N 0 3 348.834 3.885 20 5 EHBDHN C[C@@H](O)C[C@H]1CCCCCN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000388351923 1017970350 /nfs/dbraw/zinc/97/03/50/1017970350.db2.gz ADDQDXSPZZGJQF-TZMCWYRMSA-N 0 3 326.824 3.764 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCO[C@@H](c3cccnc3)C2)c(Cl)c1 ZINC000449537528 1032751371 /nfs/dbraw/zinc/75/13/71/1032751371.db2.gz ROULNGUMQAKOPG-RHSMWYFYSA-N 0 3 347.802 3.653 20 5 EHBDHN CO[C@H]([C@@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000449633532 1032966180 /nfs/dbraw/zinc/96/61/80/1032966180.db2.gz ULVVFSATIJVLKE-KZULUSFZSA-N 0 3 330.384 3.758 20 5 EHBDHN CCS[C@H]1CCC[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602567747 1032979092 /nfs/dbraw/zinc/97/90/92/1032979092.db2.gz KUHCFNCHZQNZDN-YPMHNXCESA-N 0 3 335.429 3.890 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c(Cl)c1 ZINC000519673846 1021602448 /nfs/dbraw/zinc/60/24/48/1021602448.db2.gz WWWYECZGVHFEKA-IMJJTQAJSA-N 0 3 336.819 3.686 20 5 EHBDHN CC(C)[C@@H]1CCN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498574 1022107048 /nfs/dbraw/zinc/10/70/48/1022107048.db2.gz YFWBLTLOKRLXGT-TZMCWYRMSA-N 0 3 330.388 3.684 20 5 EHBDHN C[C@H](CCCC(F)(F)F)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602634743 1033047273 /nfs/dbraw/zinc/04/72/73/1033047273.db2.gz PDRSSHWEOVTTFR-SECBINFHSA-N 0 3 331.294 3.947 20 5 EHBDHN CCOCC(C)(C)NCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000550256787 1022894889 /nfs/dbraw/zinc/89/48/89/1022894889.db2.gz LJYBPHGXWQFKQT-UHFFFAOYSA-N 0 3 348.399 3.768 20 5 EHBDHN Cn1cc(CN2CC(c3ccccc3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000602728096 1033118210 /nfs/dbraw/zinc/11/82/10/1033118210.db2.gz IQKBBDJZCLPOOD-UHFFFAOYSA-N 0 3 348.406 3.595 20 5 EHBDHN COc1c([O-])ccc(C[NH2+][C@H](C)C2CCC(F)(F)CC2)c1[N+](=O)[O-] ZINC000895226024 1024010636 /nfs/dbraw/zinc/01/06/36/1024010636.db2.gz QYDDDBYVVXUNOM-SNVBAGLBSA-N 0 3 344.358 3.613 20 5 EHBDHN CCOC(=O)CCC1CCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000610997467 1024020203 /nfs/dbraw/zinc/02/02/03/1024020203.db2.gz TTZIOQFXLQUOMW-CQSZACIVSA-N 0 3 334.416 3.711 20 5 EHBDHN COc1cc(CN(C)C[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000514103226 1024134440 /nfs/dbraw/zinc/13/44/40/1024134440.db2.gz ANBYODPNHVEAQY-CQSZACIVSA-N 0 3 344.411 3.848 20 5 EHBDHN CCC(CC)CN(CC)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000514116749 1024138842 /nfs/dbraw/zinc/13/88/42/1024138842.db2.gz LQEFOQIIXXZGGM-UHFFFAOYSA-N 0 3 332.404 3.903 20 5 EHBDHN CC(C)[C@H](O)C1(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000538488155 1024398495 /nfs/dbraw/zinc/39/84/95/1024398495.db2.gz RJSDUQXHEYPKQK-SFHVURJKSA-N 0 3 344.411 3.742 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)c(F)c1 ZINC000326792088 1024654374 /nfs/dbraw/zinc/65/43/74/1024654374.db2.gz XTQLEUGSPOEJPM-NXHRZFHOSA-N 0 3 336.407 3.640 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425371667 1024895536 /nfs/dbraw/zinc/89/55/36/1024895536.db2.gz LOIXXGCCCVUSCF-NAASZUNDSA-N 0 3 342.439 3.889 20 5 EHBDHN O=[N+]([O-])c1cccc(F)c1CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000438996706 1025380543 /nfs/dbraw/zinc/38/05/43/1025380543.db2.gz PPOLSGIVJKGAMM-MZMPZRCHSA-N 0 3 336.407 3.640 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1ccc(Cn2ccnc2)cc1 ZINC000521460596 1025397631 /nfs/dbraw/zinc/39/76/31/1025397631.db2.gz GJJMWARHYMZHKT-IBGZPJMESA-N 0 3 348.406 3.617 20 5 EHBDHN C[C@@H](C(=O)Nc1ccc(CN(C)C)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000563273444 1025503078 /nfs/dbraw/zinc/50/30/78/1025503078.db2.gz PIWDZMQQEFFBNS-GFCCVEGCSA-N 0 3 345.374 3.538 20 5 EHBDHN COCCNc1ccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000127077428 1025689535 /nfs/dbraw/zinc/68/95/35/1025689535.db2.gz VTGPNKKCOKUGPG-HNNXBMFYSA-N 0 3 343.427 3.812 20 5 EHBDHN COC[C@@H](Cc1ccccc1)N(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000475141483 1026234304 /nfs/dbraw/zinc/23/43/04/1026234304.db2.gz WCQGTNDXSBZOFG-KEEQEYLASA-N 0 3 340.423 3.798 20 5 EHBDHN Cc1cccc([C@H](C)N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000452090389 1026485072 /nfs/dbraw/zinc/48/50/72/1026485072.db2.gz QTZMHRINOQBAJZ-UONOGXRCSA-N 0 3 327.384 3.581 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN(CCCO)[C@H]1CCCc2ccccc21 ZINC000531164058 1026637047 /nfs/dbraw/zinc/63/70/47/1026637047.db2.gz NHOVJQJFRLQHAR-FQEVSTJZSA-N 0 3 340.423 3.857 20 5 EHBDHN COc1ccc(CN2CCC[C@@H]2Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000520041893 1026680304 /nfs/dbraw/zinc/68/03/04/1026680304.db2.gz SPEZHJMTPANVMC-QGZVFWFLSA-N 0 3 344.386 3.950 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000340335843 1026982395 /nfs/dbraw/zinc/98/23/95/1026982395.db2.gz KHQZJFDSXIIRAH-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@H](CC(F)(F)F)C2)cc1 ZINC000420955709 1027926175 /nfs/dbraw/zinc/92/61/75/1027926175.db2.gz WZCMMJLKOBGGRV-GFCCVEGCSA-N 0 3 332.322 3.638 20 5 EHBDHN Cc1c(CN(C)[C@H](C)[C@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000441042865 1029660114 /nfs/dbraw/zinc/66/01/14/1029660114.db2.gz GECBPPXFLXQJQY-AUUYWEPGSA-N 0 3 326.396 3.727 20 5 EHBDHN C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCc2occc21 ZINC000152250479 1029869132 /nfs/dbraw/zinc/86/91/32/1029869132.db2.gz NKGFMOUZDSTNGN-BLLLJJGKSA-N 0 3 343.383 3.572 20 5 EHBDHN CC[C@@H](C)N[C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000343257842 1029954301 /nfs/dbraw/zinc/95/43/01/1029954301.db2.gz ZMFIFAWYRINOJK-ZYHUDNBSSA-N 0 3 338.795 3.778 20 5 EHBDHN COc1cc2c(cc1OC)[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000453249879 1029977093 /nfs/dbraw/zinc/97/70/93/1029977093.db2.gz VZNKNBVYUKNORW-SJCJKPOMSA-N 0 3 342.395 3.950 20 5 EHBDHN Cc1cc(-c2noc([C@H](C)N3[C@@H](C)CC[C@@H]3C)n2)cc([N+](=O)[O-])c1 ZINC000453299252 1030047585 /nfs/dbraw/zinc/04/75/85/1030047585.db2.gz WZUKBQZBRLIXAJ-AVGNSLFASA-N 0 3 330.388 3.887 20 5 EHBDHN C[C@@H]1C[C@@H](C)[C@H](C)N(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000475728743 1031659972 /nfs/dbraw/zinc/65/99/72/1031659972.db2.gz CPDQPXJSTPIIGJ-UPJWGTAASA-N 0 3 330.388 3.511 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nnc(CN(C3CC3)C3CCCCC3)o2)cc1 ZINC000078534149 1033390772 /nfs/dbraw/zinc/39/07/72/1033390772.db2.gz ZKWJLOXVAMSPJM-UHFFFAOYSA-N 0 3 342.399 3.942 20 5 EHBDHN O=[N+]([O-])c1ccc2[nH]cc(CCN[C@@H]3CCCc4scnc43)c2c1 ZINC000599047532 1033676191 /nfs/dbraw/zinc/67/61/91/1033676191.db2.gz ZUFWWIOMGXPOGZ-OAHLLOKOSA-N 0 3 342.424 3.742 20 5 EHBDHN CCCN(Cc1onc(C)c1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000595295168 1033721300 /nfs/dbraw/zinc/72/13/00/1033721300.db2.gz HJPDJXFRESIAMN-MRXNPFEDSA-N 0 3 329.400 3.661 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595747221 1033980112 /nfs/dbraw/zinc/98/01/12/1033980112.db2.gz IHYFDYCGZWCNKI-MOXGXCLJSA-N 0 3 340.423 3.754 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@H](C)[C@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000599625103 1034072806 /nfs/dbraw/zinc/07/28/06/1034072806.db2.gz FZZHRHYDQOAXFV-LFNDISMMSA-N 0 3 332.322 3.515 20 5 EHBDHN C/C(=C\C(=O)Nc1ccccc1CN(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000785216470 1034299655 /nfs/dbraw/zinc/29/96/55/1034299655.db2.gz CTDIWOINISGOGC-WYMLVPIESA-N 0 3 339.395 3.698 20 5 EHBDHN Cc1c([C@H](C)NCCNC(=O)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000089666374 1035522019 /nfs/dbraw/zinc/52/20/19/1035522019.db2.gz KEQGFXVDOFJAJL-HNNXBMFYSA-N 0 3 347.459 3.640 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccccc1-n1ccnc1 ZINC000152241799 1036204523 /nfs/dbraw/zinc/20/45/23/1036204523.db2.gz LPWIBCFNBDYASN-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CC[C@]2(C1)CCc1ccccc1O2 ZINC000589518865 1036489107 /nfs/dbraw/zinc/48/91/07/1036489107.db2.gz XERZGQCLGKBYTM-FQEVSTJZSA-N 0 3 338.407 3.873 20 5 EHBDHN C[C@@H](N[C@H]1CCCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191290620 1036889436 /nfs/dbraw/zinc/88/94/36/1036889436.db2.gz GKIYEJFGJXXJCQ-RISCZKNCSA-N 0 3 330.388 3.874 20 5 EHBDHN CCN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCOC1 ZINC000463034344 1037691797 /nfs/dbraw/zinc/69/17/97/1037691797.db2.gz FDAWHMYEHAFEON-ZDUSSCGKSA-N 0 3 332.425 3.934 20 5 EHBDHN C[C@@H](CNCc1c(Cl)nc(Cl)n1C)c1ccccc1[N+](=O)[O-] ZINC000897469083 1038055034 /nfs/dbraw/zinc/05/50/34/1038055034.db2.gz CUBWCVGYKXTOIZ-VIFPVBQESA-N 0 3 343.214 3.528 20 5 EHBDHN CCOc1ccc(NC(=O)CN(CC)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000027284698 1040159558 /nfs/dbraw/zinc/15/95/58/1040159558.db2.gz ZCJXGSVTEYWXTJ-UHFFFAOYSA-N 0 3 349.431 3.587 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@H](Nc3ccccc3)C2)c1 ZINC000490038757 1040304484 /nfs/dbraw/zinc/30/44/84/1040304484.db2.gz AEFIMTHKCRHYSB-KRWDZBQOSA-N 0 3 341.411 3.550 20 5 EHBDHN CCCCC[C@@H]1CCCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000486782288 1040441196 /nfs/dbraw/zinc/44/11/96/1040441196.db2.gz UJBUFUDKSBNXCH-MRXNPFEDSA-N 0 3 333.432 3.602 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CC[C@H](c2ccc(O)cc2)C1 ZINC000600213369 1040850165 /nfs/dbraw/zinc/85/01/65/1040850165.db2.gz CSVDCTNAEJCRGZ-HNNXBMFYSA-N 0 3 342.395 3.689 20 5 EHBDHN C[C@@H](N[C@H](C)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000107070920 1041814699 /nfs/dbraw/zinc/81/46/99/1041814699.db2.gz UVIVOMFVYMNLDJ-VXGBXAGGSA-N 0 3 347.802 3.926 20 5 EHBDHN C[C@@H](O)CN(Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000541999091 1043002147 /nfs/dbraw/zinc/00/21/47/1043002147.db2.gz VGLVYDOGEBNJNV-GFCCVEGCSA-N 0 3 326.824 3.764 20 5 EHBDHN Cc1ccc(F)cc1NC(=O)CCN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC001168603734 1128288337 /nfs/dbraw/zinc/28/83/37/1128288337.db2.gz IFJPWURNUIRXQG-ZDUSSCGKSA-N 0 3 345.374 3.722 20 5 EHBDHN Cc1cc(Br)ccc1CNCc1ccc([N+](=O)[O-])cc1 ZINC000111388634 1120359012 /nfs/dbraw/zinc/35/90/12/1120359012.db2.gz HYSPEQKERWPOSX-UHFFFAOYSA-N 0 3 335.201 3.956 20 5 EHBDHN CC1(C)CC[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)O1 ZINC000495183564 1120981189 /nfs/dbraw/zinc/98/11/89/1120981189.db2.gz YDAUCDOQEMGMCE-CQSZACIVSA-N 0 3 330.384 3.902 20 5 EHBDHN C[C@@H]1CCC[C@@H](NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000193327966 1121113843 /nfs/dbraw/zinc/11/38/43/1121113843.db2.gz AOTOWFIEKIJMBT-LALPHHSUSA-N 0 3 330.388 3.559 20 5 EHBDHN CCN(CC(C)C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153752574 1121690416 /nfs/dbraw/zinc/69/04/16/1121690416.db2.gz YFIYZZNISMOZAH-NSHDSACASA-N 0 3 327.812 3.553 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 ZINC000078989287 1129220574 /nfs/dbraw/zinc/22/05/74/1129220574.db2.gz CNCWZPNQNDTMET-QWHCGFSZSA-N 0 3 328.368 3.778 20 5 EHBDHN Cc1cc([N+](=O)[O-])cnc1Nc1cccc(CN2CCSCC2)c1 ZINC000301960915 1129458339 /nfs/dbraw/zinc/45/83/39/1129458339.db2.gz QMEKVRFCKRIUEH-UHFFFAOYSA-N 0 3 344.440 3.591 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CNCCc2nc3c(s2)CCC3)c1 ZINC000922718306 1129639608 /nfs/dbraw/zinc/63/96/08/1129639608.db2.gz SHGSKDFBPRBTMU-UHFFFAOYSA-N 0 3 337.832 3.526 20 5 EHBDHN C[C@@H]1CCC[C@@H](NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1C ZINC000163016271 1129915914 /nfs/dbraw/zinc/91/59/14/1129915914.db2.gz JDODQEOSTWJJNY-LALPHHSUSA-N 0 3 330.388 3.559 20 5 EHBDHN NCc1c(F)cccc1N[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172897911 1131881357 /nfs/dbraw/zinc/88/13/57/1131881357.db2.gz DFYZSIBZAYIZAD-AWEZNQCLSA-N 0 3 329.375 3.552 20 5 EHBDHN Cc1ccc(N2CCN([C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC001173224336 1132005233 /nfs/dbraw/zinc/00/52/33/1132005233.db2.gz DTBCUJJLDCHKJB-QGZVFWFLSA-N 0 3 339.439 3.656 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1COc2ccc(Cl)cc21 ZINC001173226264 1132007097 /nfs/dbraw/zinc/00/70/97/1132007097.db2.gz WRXLIIRFLWUSLI-BDJLRTHQSA-N 0 3 332.787 3.903 20 5 EHBDHN C[C@H]1COC[C@@H]1NCc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001179644933 1133265944 /nfs/dbraw/zinc/26/59/44/1133265944.db2.gz AQHBBWLNBTUIFF-HZMBPMFUSA-N 0 3 336.775 3.633 20 5 EHBDHN CCN(C/C=C\c1ccccc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000769483388 1133289434 /nfs/dbraw/zinc/28/94/34/1133289434.db2.gz MNSYVIMCBYMZKI-LZVBJTEYSA-N 0 3 340.423 3.972 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN(C)[C@H](CCO)c1ccccc1 ZINC001179950538 1133304482 /nfs/dbraw/zinc/30/44/82/1133304482.db2.gz DXJNCYMNZRBBBL-LJQANCHMSA-N 0 3 328.412 3.767 20 5 EHBDHN CN(Cc1c2ccccc2c(Cl)c2ccccc21)[C@H]1CCNC1=O ZINC000770378157 1133415914 /nfs/dbraw/zinc/41/59/14/1133415914.db2.gz DPPZPTDFHGZLGY-SFHVURJKSA-N 0 3 338.838 3.967 20 5 EHBDHN COc1cccc2c1CC[C@@H]2N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788631774 1134153717 /nfs/dbraw/zinc/15/37/17/1134153717.db2.gz MWZZSBBOSVDGHN-BZNIZROVSA-N 0 3 327.384 3.524 20 5 EHBDHN Cc1cc(N2C[C@H]3CCN(Cc4ccccc4)[C@H]3C2)c([N+](=O)[O-])s1 ZINC001186773546 1134256599 /nfs/dbraw/zinc/25/65/99/1134256599.db2.gz VXAICZMHCCTJSH-WBVHZDCISA-N 0 3 343.452 3.675 20 5 EHBDHN COc1ccc(C[C@@H](C)NC2(c3ccccc3F)CC2)c([N+](=O)[O-])c1 ZINC001170313507 1134746035 /nfs/dbraw/zinc/74/60/35/1134746035.db2.gz NOPPKRMZLZERTA-CYBMUJFWSA-N 0 3 344.386 3.952 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCC[C@@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC001170329063 1134749159 /nfs/dbraw/zinc/74/91/59/1134749159.db2.gz NVNNDWBXFAZDSU-RDTXWAMCSA-N 0 3 341.411 3.767 20 5 EHBDHN CCC[C@H](NCc1ccc([N+](=O)[O-])cc1F)[C@H](O)c1ccccc1 ZINC000793239066 1134885798 /nfs/dbraw/zinc/88/57/98/1134885798.db2.gz QJWPSNUTAPMPAD-ZWKOTPCHSA-N 0 3 332.375 3.726 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CNC[C@]2(CO)C[C@H]2c2ccccc2)c1 ZINC000810165506 1135929413 /nfs/dbraw/zinc/92/94/13/1135929413.db2.gz URSKPJDDCSLDJD-WMZOPIPTSA-N 0 3 346.814 3.504 20 5 EHBDHN CN(C)Cc1cccc(-n2c3ccccc3cc3c(=O)c(N)ccc2-3)c1 ZINC001201403759 1136012883 /nfs/dbraw/zinc/01/28/83/1136012883.db2.gz UGAOBPCEZRQOAA-UHFFFAOYSA-N 0 3 343.430 3.739 20 5 EHBDHN C[C@H](NCc1ccc(O[C@H]2CCOC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000850312277 1136233882 /nfs/dbraw/zinc/23/38/82/1136233882.db2.gz GTRFHDNWSGEFDH-LIRRHRJNSA-N 0 3 342.395 3.613 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H](Cn1ccnc1)C(C)(C)C ZINC000850424805 1136256592 /nfs/dbraw/zinc/25/65/92/1136256592.db2.gz HMQWRFRQCMUZLW-CXAGYDPISA-N 0 3 346.431 3.565 20 5 EHBDHN CC(COC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)[N+](=O)[O-] ZINC000813111046 1136294101 /nfs/dbraw/zinc/29/41/01/1136294101.db2.gz BAJZACJUCKVFMQ-IBDUZEINSA-N 0 3 337.681 3.580 20 5 EHBDHN CC(COC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1)[N+](=O)[O-] ZINC000813107937 1136294156 /nfs/dbraw/zinc/29/41/56/1136294156.db2.gz RVRTUWSVYGMIEZ-BLLLJJGKSA-N 0 3 349.383 3.868 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776591250 1136451092 /nfs/dbraw/zinc/45/10/92/1136451092.db2.gz IETFKUXXOIPIBY-OALUTQOASA-N 0 3 344.386 3.995 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC(c3cccc(F)c3)CC2)cc1 ZINC000776593612 1136454223 /nfs/dbraw/zinc/45/42/23/1136454223.db2.gz YRWYPEIJGNOSGK-IBGZPJMESA-N 0 3 344.386 3.647 20 5 EHBDHN CC([C@@H](OC(=O)c1ccc(C(F)F)o1)c1ccccc1F)[N+](=O)[O-] ZINC000860854803 1137081355 /nfs/dbraw/zinc/08/13/55/1137081355.db2.gz JQLLRYYMKPDYIM-AMIZOPFISA-N 0 3 343.257 3.920 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1Cl ZINC000824696978 1137147076 /nfs/dbraw/zinc/14/70/76/1137147076.db2.gz WUUHAZPOHMBJTC-LXZKKBNFSA-N 0 3 338.835 3.764 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@H]2CCO[C@@H](c3ccncc3)C2)c1 ZINC000824949073 1137159064 /nfs/dbraw/zinc/15/90/64/1137159064.db2.gz XGIRVTLZIPFVQN-WMLDXEAASA-N 0 3 347.802 3.653 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@@H]1CCO[C@@H](c2ccccn2)C1 ZINC000825085720 1137164764 /nfs/dbraw/zinc/16/47/64/1137164764.db2.gz MOGLIQJLZBDVDW-RHSMWYFYSA-N 0 3 347.802 3.653 20 5 EHBDHN CC(C)Oc1cccc(CN(C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000120567906 1137286516 /nfs/dbraw/zinc/28/65/16/1137286516.db2.gz XSBASRNQSNHPMO-LJQANCHMSA-N 0 3 344.411 3.547 20 5 EHBDHN CC([C@H](OC(=O)[C@@H]1Cc2ccc(F)cc21)c1ccccc1F)[N+](=O)[O-] ZINC000845875601 1137316102 /nfs/dbraw/zinc/31/61/02/1137316102.db2.gz AEMXYMISTRLIKL-FNDUUJAJSA-N 0 3 347.317 3.554 20 5 EHBDHN CC([C@H](OC(=O)[C@H](F)Cc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845873713 1137316317 /nfs/dbraw/zinc/31/63/17/1137316317.db2.gz DRPICCPHTINLGT-JLZZUVOBSA-N 0 3 349.333 3.656 20 5 EHBDHN CC([C@@H](OC(=O)C(F)=C1CCCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845877045 1137316452 /nfs/dbraw/zinc/31/64/52/1137316452.db2.gz DNLMYIBHGUWAIR-MEBBXXQBSA-N 0 3 325.311 3.873 20 5 EHBDHN C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])NCc1cc(F)cnc1Cl ZINC000866365943 1137349790 /nfs/dbraw/zinc/34/97/90/1137349790.db2.gz JCZMZAAMFFUSDN-VIFPVBQESA-N 0 3 341.745 3.642 20 5 EHBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)c1nccnc1C ZINC000872133455 1137573447 /nfs/dbraw/zinc/57/34/47/1137573447.db2.gz MUJNYDNKMCBGII-KGLIPLIRSA-N 0 3 346.456 3.915 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H](CCCO)c1ccccc1 ZINC000873059119 1137589092 /nfs/dbraw/zinc/58/90/92/1137589092.db2.gz NORCEBLIXYUQJH-SFHVURJKSA-N 0 3 328.412 3.815 20 5 EHBDHN O=[N+]([O-])c1cnn(C2CC(NCc3ccc(Cl)cc3Cl)C2)c1 ZINC000876887265 1137664596 /nfs/dbraw/zinc/66/45/96/1137664596.db2.gz QESGOWVCWYVMIL-UHFFFAOYSA-N 0 3 341.198 3.591 20 5 EHBDHN C[C@@H]1CC[C@@H](NCc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C1 ZINC000878447311 1137716344 /nfs/dbraw/zinc/71/63/44/1137716344.db2.gz LKKDUMIJSFZSMP-MBNYWOFBSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@H]1CCCC[C@@]1(C)NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878699154 1137725525 /nfs/dbraw/zinc/72/55/25/1137725525.db2.gz NYOQHZFUAZQRBJ-YVEFUNNKSA-N 0 3 330.388 3.703 20 5 EHBDHN CC(C)(C)[C@H]1CCCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000332128110 1137932593 /nfs/dbraw/zinc/93/25/93/1137932593.db2.gz MYNZGYISBVNNQF-CQSZACIVSA-N 0 3 330.388 3.655 20 5 EHBDHN CC1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)OCCCO1 ZINC000192248861 1140514389 /nfs/dbraw/zinc/51/43/89/1140514389.db2.gz WKMQJDVDNRHAOE-UHFFFAOYSA-N 0 3 348.424 3.566 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@H]2c2cccc(F)c2)c1 ZINC000269684243 1141135474 /nfs/dbraw/zinc/13/54/74/1141135474.db2.gz SHZCKIMIUIZJOO-ZWKOTPCHSA-N 0 3 330.359 3.604 20 5 EHBDHN C[C@H](NC[C@@H](O)c1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000271518382 1141385437 /nfs/dbraw/zinc/38/54/37/1141385437.db2.gz PWECTCXBUYORTC-ZUZCIYMTSA-N 0 3 338.766 3.772 20 5 EHBDHN CCN(CC)Cc1cccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c1 ZINC000036763402 520758690 /nfs/dbraw/zinc/75/86/90/520758690.db2.gz GRXUJLNRNROHRJ-UHFFFAOYSA-N 0 3 341.411 3.997 20 5 EHBDHN O=[N+]([O-])c1ccc(CCNCc2conc2Cc2ccccc2)cc1 ZINC000584304966 1032103478 /nfs/dbraw/zinc/10/34/78/1032103478.db2.gz SOSDFYFZASMUPV-UHFFFAOYSA-N 0 3 337.379 3.506 20 5 EHBDHN Cc1ccc(CN(CCO)[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000536683109 1032146113 /nfs/dbraw/zinc/14/61/13/1032146113.db2.gz JZBNCHCRKCRQKA-LJQANCHMSA-N 0 3 340.423 3.775 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1F ZINC000278746251 1032291127 /nfs/dbraw/zinc/29/11/27/1032291127.db2.gz WTGCZHRXNOOWDM-YJBOKZPZSA-N 0 3 344.386 3.991 20 5 EHBDHN C[C@H]1CCCC[C@]1(C)NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000459609979 1032325843 /nfs/dbraw/zinc/32/58/43/1032325843.db2.gz KAEMWYLJRDKTIT-SJCJKPOMSA-N 0 3 330.388 3.703 20 5 EHBDHN C[C@H](CCCc1cccnc1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000459633757 1032350434 /nfs/dbraw/zinc/35/04/34/1032350434.db2.gz FBGRFDCVXCGNRY-CYBMUJFWSA-N 0 3 340.383 3.632 20 5 EHBDHN C[C@H](CC(=O)Nc1ccc(F)cc1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449347810 1032464902 /nfs/dbraw/zinc/46/49/02/1032464902.db2.gz JEMLJERUFPXPMY-OLZOCXBDSA-N 0 3 345.374 3.802 20 5 EHBDHN COc1ccc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1O ZINC000449506991 1032691271 /nfs/dbraw/zinc/69/12/71/1032691271.db2.gz ZZYMDYKZVKYOMK-INIZCTEOSA-N 0 3 342.395 3.689 20 5 EHBDHN CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](C)C(C)C ZINC000118833159 1017586995 /nfs/dbraw/zinc/58/69/95/1017586995.db2.gz PODNLXLQYKZLNB-LLVKDONJSA-N 0 3 327.812 3.553 20 5 EHBDHN CC(C)[C@@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000015549965 1018758392 /nfs/dbraw/zinc/75/83/92/1018758392.db2.gz HPUBOAXCUVUVJJ-KBXCAEBGSA-N 0 3 341.411 3.909 20 5 EHBDHN CO[C@@]1(C)CCCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000280651995 1020567002 /nfs/dbraw/zinc/56/70/02/1020567002.db2.gz ZGZXJYCHAWXCHH-SFHVURJKSA-N 0 3 345.399 3.641 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCO[C@@H](c3cccs3)C2)c(F)c1 ZINC000449625261 1032923327 /nfs/dbraw/zinc/92/33/27/1032923327.db2.gz OHGQONVWGGOLNJ-IUODEOHRSA-N 0 3 336.388 3.805 20 5 EHBDHN Cc1c(CN2CC[C@@H](n3ncc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000510417368 1020818924 /nfs/dbraw/zinc/81/89/24/1020818924.db2.gz PSRKECAYOSWZQN-QGZVFWFLSA-N 0 3 336.395 3.700 20 5 EHBDHN Cc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1[N+](=O)[O-] ZINC000060551350 1020905383 /nfs/dbraw/zinc/90/53/83/1020905383.db2.gz QIWQXZUXYLBEFE-UHFFFAOYSA-N 0 3 339.395 3.751 20 5 EHBDHN C[C@@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccs1 ZINC000602561033 1032972390 /nfs/dbraw/zinc/97/23/90/1032972390.db2.gz PPYSTWHLKCFFGX-LLVKDONJSA-N 0 3 331.397 3.766 20 5 EHBDHN COc1cc(CN2CC[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453582 1021624107 /nfs/dbraw/zinc/62/41/07/1021624107.db2.gz HQKURWMNINJHKO-JQWIXIFHSA-N 0 3 342.342 3.579 20 5 EHBDHN COc1cc(CN2CC[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453583 1021624191 /nfs/dbraw/zinc/62/41/91/1021624191.db2.gz HQKURWMNINJHKO-PWSUYJOCSA-N 0 3 342.342 3.579 20 5 EHBDHN C[C@@H](NC[C@@H](c1c(F)cccc1F)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000120777130 1022150901 /nfs/dbraw/zinc/15/09/01/1022150901.db2.gz WGQQNTBSFAUFHA-PXAZEXFGSA-N 0 3 349.381 3.827 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(Cc3cnn(C4CCC4)c3)C2)cc1 ZINC000894719612 1022791427 /nfs/dbraw/zinc/79/14/27/1022791427.db2.gz PEHRBYNKUVQWSP-QGZVFWFLSA-N 0 3 340.427 3.896 20 5 EHBDHN Cn1cc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C2CC2)n1 ZINC000894723772 1022821292 /nfs/dbraw/zinc/82/12/92/1022821292.db2.gz PLIIYLSILZFIIR-INIZCTEOSA-N 0 3 340.427 3.585 20 5 EHBDHN CCOC(=O)CC1(NCc2ccc([N+](=O)[O-])cc2Cl)CCCC1 ZINC000434615030 1024198197 /nfs/dbraw/zinc/19/81/97/1024198197.db2.gz LKFQVJQIIPILTA-UHFFFAOYSA-N 0 3 340.807 3.604 20 5 EHBDHN CCCN(Cc1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1 ZINC000071809504 1024441887 /nfs/dbraw/zinc/44/18/87/1024441887.db2.gz WBZKUHYBJCNKNS-KRWDZBQOSA-N 0 3 342.395 3.647 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000425236344 1024488388 /nfs/dbraw/zinc/48/83/88/1024488388.db2.gz JUSFOBATSWYLCF-OAHLLOKOSA-N 0 3 340.427 3.936 20 5 EHBDHN Cc1cccc(NC2CCN([C@H](C)c3ccncc3)CC2)c1[N+](=O)[O-] ZINC000425239294 1024497043 /nfs/dbraw/zinc/49/70/43/1024497043.db2.gz NSCOVPKNPXUDKD-OAHLLOKOSA-N 0 3 340.427 3.936 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCCOc1ccc(F)cc1 ZINC000507914772 1024761749 /nfs/dbraw/zinc/76/17/49/1024761749.db2.gz QBGVVVQVDLHNMA-UHFFFAOYSA-N 0 3 348.374 3.691 20 5 EHBDHN COCCNCc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000237353995 1025057771 /nfs/dbraw/zinc/05/77/71/1025057771.db2.gz KQXSPKOCGDQTMM-UHFFFAOYSA-N 0 3 332.425 3.790 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CN[C@@H]3C[C@@H]4CCC[C@@H]34)cs2)c1 ZINC000897952465 1033258439 /nfs/dbraw/zinc/25/84/39/1033258439.db2.gz GRIRILLYCPDBSO-IUIKQTSFSA-N 0 3 329.425 3.997 20 5 EHBDHN O=[N+]([O-])c1sc(CN[C@@H]2C[C@@H]3CCC[C@H]23)cc1Br ZINC000897958706 1033259001 /nfs/dbraw/zinc/25/90/01/1033259001.db2.gz MHSGWLQUHKNQQL-OVYXKVPISA-N 0 3 331.235 3.697 20 5 EHBDHN C[C@H](c1ccccc1)[C@H](O)CNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000451057565 1025482417 /nfs/dbraw/zinc/48/24/17/1025482417.db2.gz UBQJIRRJWXGPFN-RDTXWAMCSA-N 0 3 328.412 3.584 20 5 EHBDHN CCOc1cc(CN2CCC[C@@]3(CCSC3)C2)ccc1[N+](=O)[O-] ZINC000451961647 1026399195 /nfs/dbraw/zinc/39/91/95/1026399195.db2.gz DUUZEKKEGVTDSL-QGZVFWFLSA-N 0 3 336.457 3.713 20 5 EHBDHN COc1cc(C[NH2+]C[C@]2(C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1[O-] ZINC000339445876 1026565418 /nfs/dbraw/zinc/56/54/18/1026565418.db2.gz SOUWWHOEGVXOIB-BEFAXECRSA-N 0 3 342.395 3.592 20 5 EHBDHN CC(=O)c1ccc(NC[C@H](C)N(C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000347318094 1026580902 /nfs/dbraw/zinc/58/09/02/1026580902.db2.gz RKXZWMLXMKUJCN-AWEZNQCLSA-N 0 3 341.411 3.730 20 5 EHBDHN COc1ccc(CN(C)CCCOc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000520042851 1026702765 /nfs/dbraw/zinc/70/27/65/1026702765.db2.gz IVBQWBKFHIFTHL-UHFFFAOYSA-N 0 3 348.374 3.643 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@@H](CC(F)F)c2ccccc2)cc1 ZINC000421001441 1027980452 /nfs/dbraw/zinc/98/04/52/1027980452.db2.gz WUXNZTOWQRTZRH-INIZCTEOSA-N 0 3 336.338 3.960 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3CCCO3)o2)c(Cl)c1 ZINC000237816151 1028067440 /nfs/dbraw/zinc/06/74/40/1028067440.db2.gz GNWYAQUDWJKXAO-LBPRGKRZSA-N 0 3 336.775 3.777 20 5 EHBDHN CN(C)c1cccc([C@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000525271930 1029768076 /nfs/dbraw/zinc/76/80/76/1029768076.db2.gz VNGKAPBOZWYRSO-LJQANCHMSA-N 0 3 325.412 3.998 20 5 EHBDHN CC[C@H](C)N[C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000343272874 1030039682 /nfs/dbraw/zinc/03/96/82/1030039682.db2.gz VXJHWFBFDQRZTJ-GWCFXTLKSA-N 0 3 338.795 3.778 20 5 EHBDHN C[C@H](NC[C@H](c1c(F)cccc1F)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000120777279 1030092215 /nfs/dbraw/zinc/09/22/15/1030092215.db2.gz WGQQNTBSFAUFHA-YVEFUNNKSA-N 0 3 349.381 3.827 20 5 EHBDHN COc1ccc(C2CCN(Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000525821509 1030147571 /nfs/dbraw/zinc/14/75/71/1030147571.db2.gz ZXKMZGZKHQDKOE-UHFFFAOYSA-N 0 3 326.396 3.983 20 5 EHBDHN CCOc1ccc([C@@H](C)N2CCC[C@@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000453365347 1030181207 /nfs/dbraw/zinc/18/12/07/1030181207.db2.gz LVARIAAIFKWXAN-RDTXWAMCSA-N 0 3 334.416 3.557 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H](c2ccccc2)C2(CO)CCCC2)cc1 ZINC000453609603 1030399948 /nfs/dbraw/zinc/39/99/48/1030399948.db2.gz GIYMBUOBPMZENW-IBGZPJMESA-N 0 3 340.423 3.978 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCC2(O)CCC2)c2ccccc2)c1 ZINC000551570959 1031463135 /nfs/dbraw/zinc/46/31/35/1031463135.db2.gz JWKSXWPGXWLIDN-SFHVURJKSA-N 0 3 326.396 3.579 20 5 EHBDHN CC(C)[C@@H]1CCCC[C@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000460350128 1033530869 /nfs/dbraw/zinc/53/08/69/1033530869.db2.gz UWKZVLKNBSREBN-JKSUJKDBSA-N 0 3 344.415 3.949 20 5 EHBDHN COC[C@H](Cc1ccccc1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595011469 1033605213 /nfs/dbraw/zinc/60/52/13/1033605213.db2.gz HOQPSTJSHXREKQ-HOCLYGCPSA-N 0 3 344.411 3.512 20 5 EHBDHN CCc1cnc(CCN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)s1 ZINC000595024998 1033616419 /nfs/dbraw/zinc/61/64/19/1033616419.db2.gz JDBTUXKKCKIXCF-LLVKDONJSA-N 0 3 335.429 3.516 20 5 EHBDHN C[C@H](c1ccccc1)[C@@H](O)CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000595000223 1033626398 /nfs/dbraw/zinc/62/63/98/1033626398.db2.gz HWDXZNAIIIXRLV-PXAZEXFGSA-N 0 3 334.803 3.502 20 5 EHBDHN C[C@@H](c1ccccc1)[C@@H](O)CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000595000224 1033626641 /nfs/dbraw/zinc/62/66/41/1033626641.db2.gz HWDXZNAIIIXRLV-SJCJKPOMSA-N 0 3 334.803 3.502 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](c1ccsc1)N(C)C ZINC000595002982 1033628115 /nfs/dbraw/zinc/62/81/15/1033628115.db2.gz AMTRFQWLQNIGDN-MLGOLLRUSA-N 0 3 349.456 3.618 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](Cc1ccccc1)OC ZINC000595043244 1033663107 /nfs/dbraw/zinc/66/31/07/1033663107.db2.gz VNZOECWUPMQWSG-PBHICJAKSA-N 0 3 344.411 3.512 20 5 EHBDHN C[C@@H](c1ccc(F)c(F)c1)N(C)CCOc1ccccc1[N+](=O)[O-] ZINC000603841253 1033964618 /nfs/dbraw/zinc/96/46/18/1033964618.db2.gz ZRQVWDSMAGYQGP-LBPRGKRZSA-N 0 3 336.338 3.945 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CCC(c2ccccc2)CC1 ZINC000603841090 1033965006 /nfs/dbraw/zinc/96/50/06/1033965006.db2.gz WPFSTNXLXQZWEO-UHFFFAOYSA-N 0 3 326.396 3.853 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCCC2(CC2)CC1 ZINC000599672175 1034081194 /nfs/dbraw/zinc/08/11/94/1034081194.db2.gz BXCKGCQLPWALNM-CYBMUJFWSA-N 0 3 342.399 3.972 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000612593290 1035084482 /nfs/dbraw/zinc/08/44/82/1035084482.db2.gz ZMXSRVXWQQCWNQ-MAUKXSAKSA-N 0 3 348.349 3.883 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCCN(c2ccccc2)CC1 ZINC000511460751 1035472334 /nfs/dbraw/zinc/47/23/34/1035472334.db2.gz MUDQTTOAUDYIRC-TWGQIWQCSA-N 0 3 337.423 3.820 20 5 EHBDHN C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1nccn1-c1ccccc1 ZINC000588311571 1035898420 /nfs/dbraw/zinc/89/84/20/1035898420.db2.gz BFMAXWCDNYGRRB-OAHLLOKOSA-N 0 3 336.395 3.674 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](C)Oc1ccc(C)cc1 ZINC000462733793 1037335101 /nfs/dbraw/zinc/33/51/01/1037335101.db2.gz KLNYEVJAVQIMNF-OAHLLOKOSA-N 0 3 344.411 3.859 20 5 EHBDHN Cc1cc(N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461959428 1038697314 /nfs/dbraw/zinc/69/73/14/1038697314.db2.gz PLTVMAQXRFUFKC-QAPCUYQASA-N 0 3 329.375 3.900 20 5 EHBDHN CC[C@H](C)CN(CC)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298580 1039814809 /nfs/dbraw/zinc/81/48/09/1039814809.db2.gz WZEQYKDAVIBUKV-NWDGAFQWSA-N 0 3 341.839 3.943 20 5 EHBDHN COc1cccc(C2CCN(Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000512590313 1040216238 /nfs/dbraw/zinc/21/62/38/1040216238.db2.gz LKORVDAEQBGHTL-UHFFFAOYSA-N 0 3 326.396 3.983 20 5 EHBDHN O=[N+]([O-])c1cc(CNC/C=C/c2ccncc2)cc(C(F)(F)F)c1 ZINC000487182173 1040770834 /nfs/dbraw/zinc/77/08/34/1040770834.db2.gz ANSBIAUKUYWCLP-OWOJBTEDSA-N 0 3 337.301 3.812 20 5 EHBDHN O=[N+]([O-])c1ccc(S[C@@H]2CCCN(Cc3ccccc3)C2)cn1 ZINC000425289232 1041096167 /nfs/dbraw/zinc/09/61/67/1041096167.db2.gz ZCYUOCBMWBBVOP-MRXNPFEDSA-N 0 3 329.425 3.747 20 5 EHBDHN C[C@H](NC(=O)Nc1cccc(CN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000047505612 1041682490 /nfs/dbraw/zinc/68/24/90/1041682490.db2.gz SZXQKYQCQQGDLZ-ZDUSSCGKSA-N 0 3 342.399 3.539 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1F ZINC000291235459 1042787927 /nfs/dbraw/zinc/78/79/27/1042787927.db2.gz UMBLVXLIQURAOC-KYJSFNMBSA-N 0 3 336.407 3.640 20 5 EHBDHN C[C@H](NC[C@@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000122134960 1042864818 /nfs/dbraw/zinc/86/48/18/1042864818.db2.gz CNMRHKJZMPPCFJ-YOEHRIQHSA-N 0 3 329.400 3.676 20 5 EHBDHN CC1(C)C[C@H](NC[C@@H](O)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000279132145 1043401059 /nfs/dbraw/zinc/40/10/59/1043401059.db2.gz RCKHGSWUZVNISL-JKSUJKDBSA-N 0 3 332.425 3.702 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(-n2ccnc2)cc1 ZINC000765357700 1127601059 /nfs/dbraw/zinc/60/10/59/1127601059.db2.gz CEGHVNWIDSGYDN-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN Cc1noc(C)c1CCNc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000272786583 1122231916 /nfs/dbraw/zinc/23/19/16/1122231916.db2.gz BJSAWJCZHKRBRA-UHFFFAOYSA-N 0 3 326.356 3.711 20 5 EHBDHN CN1CCC[C@@H]1CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000920486194 1123374727 /nfs/dbraw/zinc/37/47/27/1123374727.db2.gz SGADYMTWMPUJBV-MRVPVSSYSA-N 0 3 337.729 3.773 20 5 EHBDHN CC(C)[C@@H]1CCCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000609631910 1123635114 /nfs/dbraw/zinc/63/51/14/1123635114.db2.gz MUMZMQFNIXYZOR-CQSZACIVSA-N 0 3 334.416 3.719 20 5 EHBDHN COc1ccc(CN2CC[C@H](Cc3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000609916176 1123691948 /nfs/dbraw/zinc/69/19/48/1123691948.db2.gz DAXPKVNPBPKQIV-MRXNPFEDSA-N 0 3 344.386 3.807 20 5 EHBDHN Cc1cc(N2CCC(c3ncc[nH]3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272809810 1124636906 /nfs/dbraw/zinc/63/69/06/1124636906.db2.gz GTNMKCOQJRJXBO-UHFFFAOYSA-N 0 3 337.383 3.559 20 5 EHBDHN C[C@@H]1CCC[C@H](C)CN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000131027492 1129376225 /nfs/dbraw/zinc/37/62/25/1129376225.db2.gz YSYQPZBNUGZPQI-QWHCGFSZSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H](O)CCN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000093481053 1129590586 /nfs/dbraw/zinc/59/05/86/1129590586.db2.gz ZDFLICLIUBYECU-NSHDSACASA-N 0 3 338.791 3.711 20 5 EHBDHN Cc1ccccc1C(C)(C)NCC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000555611994 1129715429 /nfs/dbraw/zinc/71/54/29/1129715429.db2.gz PANXSOGQZWQNFE-UHFFFAOYSA-N 0 3 341.411 3.675 20 5 EHBDHN C[C@@H]1CCC[C@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]1C ZINC000163022244 1129916207 /nfs/dbraw/zinc/91/62/07/1129916207.db2.gz DSWMIKYBYNOFEG-JMSVASOKSA-N 0 3 330.388 3.559 20 5 EHBDHN CCOc1ccc(OCCNC(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000429241366 1130205635 /nfs/dbraw/zinc/20/56/35/1130205635.db2.gz ZQUCLCWPRPWERU-UHFFFAOYSA-N 0 3 344.411 3.897 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000245518112 1130228258 /nfs/dbraw/zinc/22/82/58/1130228258.db2.gz HJXJVCGQFUZNQS-ZIAGYGMSSA-N 0 3 334.416 3.628 20 5 EHBDHN CC[C@@H]1CCCN(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000738253927 1131464996 /nfs/dbraw/zinc/46/49/96/1131464996.db2.gz JGKOCTGGKYHMCV-OAHLLOKOSA-N 0 3 328.416 3.928 20 5 EHBDHN Cc1ccccc1N1CCN([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173230378 1132007998 /nfs/dbraw/zinc/00/79/98/1132007998.db2.gz XTSDBGREKOJVSV-QGZVFWFLSA-N 0 3 339.439 3.656 20 5 EHBDHN Cc1cc(N2CCN(C)CC2)ccc1Nc1cc([N+](=O)[O-])ccc1F ZINC001175737109 1132749090 /nfs/dbraw/zinc/74/90/90/1132749090.db2.gz ULOXZIOSNYUSCL-UHFFFAOYSA-N 0 3 344.390 3.538 20 5 EHBDHN CC1(C)CO[C@@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001179516014 1133254823 /nfs/dbraw/zinc/25/48/23/1133254823.db2.gz OVBYFGAHKXKOMS-MRXNPFEDSA-N 0 3 330.384 3.760 20 5 EHBDHN COc1cc2c(cc1F)CC[C@@H]2N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788815717 1134176675 /nfs/dbraw/zinc/17/66/75/1134176675.db2.gz DPAYQIPTXJRSAC-HWPZZCPQSA-N 0 3 345.374 3.663 20 5 EHBDHN CCN1CCN(c2cccc(Nc3c(F)cccc3[N+](=O)[O-])c2)CC1 ZINC001186195932 1134180634 /nfs/dbraw/zinc/18/06/34/1134180634.db2.gz UPYWSBBWOCXRNE-UHFFFAOYSA-N 0 3 344.390 3.619 20 5 EHBDHN CCOC(=O)CC1(NCc2cc(Cl)ccc2[N+](=O)[O-])CCCC1 ZINC000789389573 1134260931 /nfs/dbraw/zinc/26/09/31/1134260931.db2.gz VCOOSIADBIKXCQ-UHFFFAOYSA-N 0 3 340.807 3.604 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCC[C@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346411 1134759512 /nfs/dbraw/zinc/75/95/12/1134759512.db2.gz NMMLDMXVCYYKEB-KDOFPFPSSA-N 0 3 341.411 3.767 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCC(C(F)F)CC2)c([N+](=O)[O-])c1 ZINC001170351666 1134760822 /nfs/dbraw/zinc/76/08/22/1134760822.db2.gz HAZSDBYGYQNYIT-NSHDSACASA-N 0 3 328.359 3.512 20 5 EHBDHN COCCN(Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CC[C@@H](C)C1 ZINC001193974789 1135208316 /nfs/dbraw/zinc/20/83/16/1135208316.db2.gz CKHAOLVFLRTEFN-IUODEOHRSA-N 0 3 326.824 3.885 20 5 EHBDHN COc1cc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)c([N+](=O)[O-])cc1[O-] ZINC001199053508 1135876474 /nfs/dbraw/zinc/87/64/74/1135876474.db2.gz ZZWVRQRXCPJPNJ-VNHYZAJKSA-N 0 3 334.416 3.758 20 5 EHBDHN Cc1cccc2c1OC[C@@H](NCc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000810178225 1135934603 /nfs/dbraw/zinc/93/46/03/1135934603.db2.gz LTEJPMXLVLYWDG-HNNXBMFYSA-N 0 3 332.787 3.650 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]12 ZINC000850408733 1136252108 /nfs/dbraw/zinc/25/21/08/1136252108.db2.gz DKDUECWWROSBLJ-USXIJHARSA-N 0 3 332.762 3.815 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@]1(C)CC1(Cl)Cl ZINC000850472520 1136265787 /nfs/dbraw/zinc/26/57/87/1136265787.db2.gz JCLSFXVHPCWKSN-RNCFNFMXSA-N 0 3 333.215 3.838 20 5 EHBDHN CC(COC(=O)c1ccc(SCc2ccccc2)cc1)[N+](=O)[O-] ZINC000813103520 1136288078 /nfs/dbraw/zinc/28/80/78/1136288078.db2.gz CSLINWIHKGRIDZ-CYBMUJFWSA-N 0 3 331.393 3.801 20 5 EHBDHN Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813103834 1136288515 /nfs/dbraw/zinc/28/85/15/1136288515.db2.gz UWXUWODVUPOFDN-NSHDSACASA-N 0 3 348.424 3.599 20 5 EHBDHN Cc1nc2c(s1)[C@H](N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815614990 1136618975 /nfs/dbraw/zinc/61/89/75/1136618975.db2.gz FZLIGKXWBWCEJI-NOZJJQNGSA-N 0 3 332.429 3.670 20 5 EHBDHN C[C@H](NCc1ccc(F)c(CN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000173419316 1137095291 /nfs/dbraw/zinc/09/52/91/1137095291.db2.gz KGHAPCFSIXJUNV-ZDUSSCGKSA-N 0 3 331.391 3.646 20 5 EHBDHN Cc1ccc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cc1 ZINC000845872737 1137315817 /nfs/dbraw/zinc/31/58/17/1137315817.db2.gz MXYZEVSIUZDJHY-UGSOOPFHSA-N 0 3 331.343 3.626 20 5 EHBDHN CCS[C@H](C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-])C(C)C ZINC000845878120 1137316559 /nfs/dbraw/zinc/31/65/59/1137316559.db2.gz ULCDRUDAXANQEF-GLQYFDAESA-N 0 3 343.420 3.853 20 5 EHBDHN COCCOc1ccc([C@@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000866538543 1137362819 /nfs/dbraw/zinc/36/28/19/1137362819.db2.gz BYSCENTUAWEWIH-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCc1csc(C)n1 ZINC000872020010 1137565041 /nfs/dbraw/zinc/56/50/41/1137565041.db2.gz BXHCORWZPWCFFY-JTQLQIEISA-N 0 3 337.470 3.975 20 5 EHBDHN CCOc1cc(CN2CCC[C@H](OC3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000872279227 1137577647 /nfs/dbraw/zinc/57/76/47/1137577647.db2.gz CXBDOVCVHGONNY-KRWDZBQOSA-N 0 3 348.443 3.917 20 5 EHBDHN CN1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc2ccccc2c2cccnc12 ZINC000874842445 1137624561 /nfs/dbraw/zinc/62/45/61/1137624561.db2.gz HMSGIULCUUKMML-VQTJNVASSA-N 0 3 345.446 3.697 20 5 EHBDHN C[C@@H]1CCC[C@H](C)N(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878128344 1137703647 /nfs/dbraw/zinc/70/36/47/1137703647.db2.gz CNZLIJAJKLBCMY-OLZOCXBDSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@H]1CCCC[C@@H]1N(C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476032 1137717353 /nfs/dbraw/zinc/71/73/53/1137717353.db2.gz VJXRXJWQEBZFJR-JSGCOSHPSA-N 0 3 330.388 3.655 20 5 EHBDHN CC[C@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CC1(C)C ZINC000878717754 1137726184 /nfs/dbraw/zinc/72/61/84/1137726184.db2.gz HMOVDFAQZNHOBT-STQMWFEESA-N 0 3 330.388 3.559 20 5 EHBDHN Cc1ccc(CN2CC[C@@H](c3ccc4cccnc4n3)C2)cc1[N+](=O)[O-] ZINC000878904335 1137731641 /nfs/dbraw/zinc/73/16/41/1137731641.db2.gz LJALWGDTVZAHQZ-QGZVFWFLSA-N 0 3 348.406 3.836 20 5 EHBDHN CC(C)n1cnnc1[C@@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000118861035 1137936117 /nfs/dbraw/zinc/93/61/17/1137936117.db2.gz UBSOWEIZGBFNTQ-GOEBONIOSA-N 0 3 343.431 3.708 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@H](c2ncccn2)C1 ZINC000886685948 1138115146 /nfs/dbraw/zinc/11/51/46/1138115146.db2.gz HGJWUBWRTKQUAU-GJZGRUSLSA-N 0 3 326.400 3.634 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CC[C@H](COCc3ccccc3)C2)cc1 ZINC000075863914 1138128938 /nfs/dbraw/zinc/12/89/38/1138128938.db2.gz QTXAKXKAMYCKCZ-SFHVURJKSA-N 0 3 326.396 3.634 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000152570274 1139098228 /nfs/dbraw/zinc/09/82/28/1139098228.db2.gz DLYYNJPGUGGIDL-XJKSGUPXSA-N 0 3 347.415 3.540 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC[C@H]2C[C@H](O)c2cccs2)cc1 ZINC000267463488 1140794082 /nfs/dbraw/zinc/79/40/82/1140794082.db2.gz TVBWOBSWKPVSCE-HOTGVXAUSA-N 0 3 332.425 3.744 20 5 EHBDHN C[C@@H](N[C@H](C)c1ccc2c(c1)CC(=O)N2C)c1ccc([N+](=O)[O-])cc1 ZINC000267460857 1140794349 /nfs/dbraw/zinc/79/43/49/1140794349.db2.gz VBFIZNNVCDHYPJ-CHWSQXEVSA-N 0 3 339.395 3.526 20 5 EHBDHN CC(C)CN1CCN(c2cc3ccc(Cl)nc3cc2[N+](=O)[O-])CC1 ZINC001164663157 719340250 /nfs/dbraw/zinc/34/02/50/719340250.db2.gz VHBOBDDCJSKWOH-UHFFFAOYSA-N 0 3 348.834 3.574 20 5 EHBDHN CO[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000536667703 1032065651 /nfs/dbraw/zinc/06/56/51/1032065651.db2.gz LUIADKGRZAHMBF-LBPRGKRZSA-N 0 3 336.775 3.729 20 5 EHBDHN COCCOc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000154079331 1014968510 /nfs/dbraw/zinc/96/85/10/1014968510.db2.gz LLYHVQFODBKKIK-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN CCOC[C@H](NCc1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000233778156 1015771553 /nfs/dbraw/zinc/77/15/53/1015771553.db2.gz DHTSDAMBZSUIDT-ZDUSSCGKSA-N 0 3 345.237 3.508 20 5 EHBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCc1ccc(F)cn1 ZINC000349207503 1016925104 /nfs/dbraw/zinc/92/51/04/1016925104.db2.gz HUXNSPYEGDJWIM-CYBMUJFWSA-N 0 3 335.404 3.789 20 5 EHBDHN CCCCn1cc(CNC/C=C/c2ccccc2[N+](=O)[O-])c(C)n1 ZINC000538455943 1032383521 /nfs/dbraw/zinc/38/35/21/1032383521.db2.gz ZNTBQHUAVNJPED-VQHVLOKHSA-N 0 3 328.416 3.703 20 5 EHBDHN Cc1cc(C)cc([C@H](C)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000537115610 1032527441 /nfs/dbraw/zinc/52/74/41/1032527441.db2.gz JJLYBMYQDDQGJM-LSDHHAIUSA-N 0 3 341.411 3.889 20 5 EHBDHN O=[N+]([O-])c1cc(CNCC[C@@H]2CSc3ccccc3O2)cs1 ZINC000592372658 1032673328 /nfs/dbraw/zinc/67/33/28/1032673328.db2.gz IGLQXLFWTSOMDW-GFCCVEGCSA-N 0 3 336.438 3.689 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@]1(CO)C[C@@H]1c1ccccc1 ZINC000289927272 1032675824 /nfs/dbraw/zinc/67/58/24/1032675824.db2.gz SRCUMVJZGINAQJ-AEFFLSMTSA-N 0 3 346.814 3.504 20 5 EHBDHN COCCN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC(C)C ZINC000549366013 1018530013 /nfs/dbraw/zinc/53/00/13/1018530013.db2.gz BWWOJZUELQFZRD-UHFFFAOYSA-N 0 3 334.338 3.718 20 5 EHBDHN COc1cc(CN(C(C)C)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000183019908 1019920200 /nfs/dbraw/zinc/92/02/00/1019920200.db2.gz UHEKNEGTBCKGAK-UHFFFAOYSA-N 0 3 332.347 3.824 20 5 EHBDHN CC(C)(C)[C@@H]1CCCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000280577326 1020480433 /nfs/dbraw/zinc/48/04/33/1020480433.db2.gz SMIFVZKJEVKUKJ-CQSZACIVSA-N 0 3 344.415 3.903 20 5 EHBDHN CC[C@@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000341187518 1021063003 /nfs/dbraw/zinc/06/30/03/1021063003.db2.gz CUPAKXDAOCTMFW-GDBMZVCRSA-N 0 3 341.411 3.971 20 5 EHBDHN CC(C)(C)[C@@H]1OCCC[C@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602549543 1032959117 /nfs/dbraw/zinc/95/91/17/1032959117.db2.gz DKFQMDQCTKHNJU-YVEFUNNKSA-N 0 3 347.415 3.667 20 5 EHBDHN C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000518562182 1021320031 /nfs/dbraw/zinc/32/00/31/1021320031.db2.gz BHSTZGIQJXBDNX-KZNWIGSXSA-N 0 3 344.436 3.670 20 5 EHBDHN COC(=O)CC1(NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000516478909 1021474816 /nfs/dbraw/zinc/47/48/16/1021474816.db2.gz QABLFUNTZPCWHH-UHFFFAOYSA-N 0 3 346.408 3.509 20 5 EHBDHN Cn1cc(-c2ccccc2CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])cn1 ZINC000516784302 1021728272 /nfs/dbraw/zinc/72/82/72/1021728272.db2.gz KOZCXDBKSCSEPO-LJQANCHMSA-N 0 3 348.406 3.772 20 5 EHBDHN O=[N+]([O-])c1ccc(CCNCc2nc3ccccc3n2C2CC2)cc1 ZINC000602619279 1033013835 /nfs/dbraw/zinc/01/38/35/1033013835.db2.gz WTFWIKPMPHCIBG-UHFFFAOYSA-N 0 3 336.395 3.612 20 5 EHBDHN COc1ccc2c(c1)[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])CCO2 ZINC000341562067 1022343833 /nfs/dbraw/zinc/34/38/33/1022343833.db2.gz SEEODPMZTORROK-UKINESCASA-N 0 3 340.379 3.730 20 5 EHBDHN Cc1ccccc1NC(=O)C[C@@H](C)NCc1cccc([N+](=O)[O-])c1C ZINC000477727135 1022720092 /nfs/dbraw/zinc/72/00/92/1022720092.db2.gz WSAQRPMUIXZKJY-CQSZACIVSA-N 0 3 341.411 3.719 20 5 EHBDHN Cn1ncc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1C1CC1 ZINC000894720599 1022792226 /nfs/dbraw/zinc/79/22/26/1022792226.db2.gz WKFBELZSPMPLEY-MRXNPFEDSA-N 0 3 340.427 3.585 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)C1CCC(C)(C)CC1 ZINC000127578714 1022934842 /nfs/dbraw/zinc/93/48/42/1022934842.db2.gz GZMAAAAOMRJULW-UHFFFAOYSA-N 0 3 333.432 3.742 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(CCCO)CC(C)(C)C ZINC000518058054 1022963470 /nfs/dbraw/zinc/96/34/70/1022963470.db2.gz AXJGCKGYOBXQQJ-UHFFFAOYSA-N 0 3 338.448 3.613 20 5 EHBDHN O=[N+]([O-])c1sc(CNCC[C@@H]2CC2(F)F)cc1Br ZINC000602714376 1033099556 /nfs/dbraw/zinc/09/95/56/1033099556.db2.gz HVIIPFDFIZDSAV-ZCFIWIBFSA-N 0 3 341.177 3.554 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNC3CCC4(CC4(F)F)CC3)nc2c1 ZINC000602718975 1033104936 /nfs/dbraw/zinc/10/49/36/1033104936.db2.gz MIZRHZGHTOVJLP-UHFFFAOYSA-N 0 3 337.326 3.794 20 5 EHBDHN C[C@]1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO[C@@H]1C1CC1 ZINC000543242500 1023156053 /nfs/dbraw/zinc/15/60/53/1023156053.db2.gz QWYHRVXJECBNQF-MOPGFXCFSA-N 0 3 342.395 3.902 20 5 EHBDHN C[C@@H](C[C@H]1CCOC1)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610740641 1023403628 /nfs/dbraw/zinc/40/36/28/1023403628.db2.gz XERKNQOIYCNJKG-QWHCGFSZSA-N 0 3 347.440 3.623 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](c2ccccc2OC)C1 ZINC000157922556 1033164895 /nfs/dbraw/zinc/16/48/95/1033164895.db2.gz UNBPSGMSOBISAB-CQSZACIVSA-N 0 3 342.395 3.602 20 5 EHBDHN CCOc1ccccc1[C@H](CC(C)C)NCCn1cc([N+](=O)[O-])cn1 ZINC000342246461 1024544476 /nfs/dbraw/zinc/54/44/76/1024544476.db2.gz RNLIXXPZDCGKNL-KRWDZBQOSA-N 0 3 346.431 3.567 20 5 EHBDHN Cc1c(CN[C@@H](c2cccs2)C2(CO)CCC2)cccc1[N+](=O)[O-] ZINC000452063512 1026458210 /nfs/dbraw/zinc/45/82/10/1026458210.db2.gz WRAKPRLZWBALLD-KRWDZBQOSA-N 0 3 346.452 3.958 20 5 EHBDHN CCC[C@H](C)NC(=O)[C@H]1CCCN([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000075676541 1027194518 /nfs/dbraw/zinc/19/45/18/1027194518.db2.gz AHCIWVCVONQCCL-JYJNAYRXSA-N 0 3 347.459 3.673 20 5 EHBDHN Cc1ccc(C[C@@H](C)N(C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444636459 1028089457 /nfs/dbraw/zinc/08/94/57/1028089457.db2.gz DIKBJSFOCJYLQY-CQSZACIVSA-N 0 3 338.411 3.843 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502601892 1028421739 /nfs/dbraw/zinc/42/17/39/1028421739.db2.gz RKMPLWBIGKFKMM-GOSISDBHSA-N 0 3 346.814 3.740 20 5 EHBDHN Cc1cc(N)cc(CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000423487876 1028476614 /nfs/dbraw/zinc/47/66/14/1028476614.db2.gz YAIRJCYASZRPIT-GOSISDBHSA-N 0 3 325.412 3.998 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000532918389 1029067849 /nfs/dbraw/zinc/06/78/49/1029067849.db2.gz TVWJNQJALFDRQG-OWQGQXMQSA-N 0 3 345.443 3.742 20 5 EHBDHN CCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000532935224 1029099922 /nfs/dbraw/zinc/09/99/22/1029099922.db2.gz WYSUJZKEKIQDEX-LLVKDONJSA-N 0 3 327.812 3.553 20 5 EHBDHN Cc1cccc([C@H]2CCCN2CCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000159857545 1030396157 /nfs/dbraw/zinc/39/61/57/1030396157.db2.gz FTMJYEYWXIIASL-LJQANCHMSA-N 0 3 341.411 3.904 20 5 EHBDHN Cc1cccc([C@@H]2CCCN2CCOc2cccc([N+](=O)[O-])c2)n1 ZINC000159870278 1030418376 /nfs/dbraw/zinc/41/83/76/1030418376.db2.gz JNXQIBNMAWEEAN-SFHVURJKSA-N 0 3 327.384 3.514 20 5 EHBDHN CCC[C@H](C)[C@@H]1CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267980 1030515255 /nfs/dbraw/zinc/51/52/55/1030515255.db2.gz PLWBTDCXRCYIBG-GUYCJALGSA-N 0 3 334.416 3.862 20 5 EHBDHN CO[C@H](CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000550894735 1030773654 /nfs/dbraw/zinc/77/36/54/1030773654.db2.gz GOMVSSDVNMRYBR-MOPGFXCFSA-N 0 3 326.396 3.699 20 5 EHBDHN CCOc1ccc([C@H](C)NCc2ccc([C@H](C)O)cc2)cc1[N+](=O)[O-] ZINC000179406823 1030825757 /nfs/dbraw/zinc/82/57/57/1030825757.db2.gz LUEIYBIKKWIFHM-KBPBESRZSA-N 0 3 344.411 3.898 20 5 EHBDHN C[C@@H]1C[C@@H](C)[C@H](C)N(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737965 1031704970 /nfs/dbraw/zinc/70/49/70/1031704970.db2.gz HERGFMCDWSRMQA-UPJWGTAASA-N 0 3 330.388 3.511 20 5 EHBDHN Cn1cccc1[C@H]1CCCCN1CCOc1ccc([N+](=O)[O-])cc1 ZINC000472312499 1031771108 /nfs/dbraw/zinc/77/11/08/1031771108.db2.gz DXUSMCVFXVQFBC-GOSISDBHSA-N 0 3 329.400 3.539 20 5 EHBDHN C[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000594489943 1033393196 /nfs/dbraw/zinc/39/31/96/1033393196.db2.gz IDRAROJLZIBBQO-WBMJQRKESA-N 0 3 340.379 3.704 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCCNc1ccccc1 ZINC000595011084 1033607948 /nfs/dbraw/zinc/60/79/48/1033607948.db2.gz WUZGMUPPLJYXKI-CQSZACIVSA-N 0 3 329.400 3.756 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1c(C2CCC2)cnn1C ZINC000594984274 1033619443 /nfs/dbraw/zinc/61/94/43/1033619443.db2.gz QPIIBPYWRFSQFW-NTEUORMPSA-N 0 3 340.427 3.789 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(Cc3cc(CO)ccc3F)C2)cc1 ZINC000599434159 1033935639 /nfs/dbraw/zinc/93/56/39/1033935639.db2.gz SLEATYOPWADEBI-INIZCTEOSA-N 0 3 344.386 3.606 20 5 EHBDHN COCCCOC1CCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000347354745 1034881472 /nfs/dbraw/zinc/88/14/72/1034881472.db2.gz IJCOPRVQEOXXIT-SSZFMOIBSA-N 0 3 348.443 3.516 20 5 EHBDHN COC(=O)CC1(NCc2ccc([N+](=O)[O-])cc2Cl)CCCCC1 ZINC000541072704 1035951878 /nfs/dbraw/zinc/95/18/78/1035951878.db2.gz WRJOUSAOOKRCLK-UHFFFAOYSA-N 0 3 340.807 3.604 20 5 EHBDHN Cc1ccc([C@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000056201742 1036139423 /nfs/dbraw/zinc/13/94/23/1036139423.db2.gz YEWDODNKXBSBLW-UONOGXRCSA-N 0 3 327.384 3.581 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCC(=O)Nc1ccccc1 ZINC000164985520 1036180792 /nfs/dbraw/zinc/18/07/92/1036180792.db2.gz WWWAZKIOKYDYQX-CQSZACIVSA-N 0 3 327.384 3.583 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCN2CCCCC2)c2ccccc2)c1 ZINC000491383416 1037437516 /nfs/dbraw/zinc/43/75/16/1037437516.db2.gz RKUXIADBPDDEFC-FQEVSTJZSA-N 0 3 339.439 3.760 20 5 EHBDHN CCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC(C)C ZINC000532490393 1037527800 /nfs/dbraw/zinc/52/78/00/1037527800.db2.gz VJBFKZMTOHXYOW-UHFFFAOYSA-N 0 3 327.812 3.555 20 5 EHBDHN COc1cc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)c([N+](=O)[O-])cc1[O-] ZINC000491599204 1037578291 /nfs/dbraw/zinc/57/82/91/1037578291.db2.gz PAPHHIBAQDNBLO-NSHDSACASA-N 0 3 344.358 3.614 20 5 EHBDHN CC(C)C[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000540341426 1037847914 /nfs/dbraw/zinc/84/79/14/1037847914.db2.gz KLJOLBAEGRXLNR-QGZVFWFLSA-N 0 3 341.411 3.910 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nnc(CN3CCCC[C@@H]3C3CCC3)o2)cc1 ZINC000592198766 1037944131 /nfs/dbraw/zinc/94/41/31/1037944131.db2.gz SGJFKDBSDBHXHL-MRXNPFEDSA-N 0 3 342.399 3.799 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccccc1-n1cccn1 ZINC000539040339 1038649645 /nfs/dbraw/zinc/64/96/45/1038649645.db2.gz OQJHAZKVUJWXQT-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN Cc1ccc([C@@H](C)NCCNC(=O)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000539088787 1038677653 /nfs/dbraw/zinc/67/76/53/1038677653.db2.gz ZIEZUOCBXLDHJY-OAHLLOKOSA-N 0 3 347.459 3.640 20 5 EHBDHN C[C@H](CN(Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)CO)c1ccccc1 ZINC000554283188 1039157788 /nfs/dbraw/zinc/15/77/88/1039157788.db2.gz LTWQNZYKMSEIJD-CABCVRRESA-N 0 3 346.402 3.720 20 5 EHBDHN Cc1cc(NCCc2ccc(CO)cc2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302103618 1042896439 /nfs/dbraw/zinc/89/64/39/1042896439.db2.gz WEISVOMQXUICPQ-UHFFFAOYSA-N 0 3 337.379 3.598 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@H]1CC=CCC1 ZINC000344030517 1043124311 /nfs/dbraw/zinc/12/43/11/1043124311.db2.gz BUJRFLLTAWBUPM-KBPBESRZSA-N 0 3 342.399 3.994 20 5 EHBDHN Cc1nn(CN(C)CCc2ccc(F)cc2)c2ccc([N+](=O)[O-])cc12 ZINC000764910006 1127550689 /nfs/dbraw/zinc/55/06/89/1127550689.db2.gz RMMAGBGRHMGTMD-UHFFFAOYSA-N 0 3 342.374 3.524 20 5 EHBDHN CC(C)C[C@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000542486179 1120609623 /nfs/dbraw/zinc/60/96/23/1120609623.db2.gz YPVMKENUQWEDPL-HIFRSBDPSA-N 0 3 326.824 3.932 20 5 EHBDHN CC1(C)CC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)O1 ZINC000495165379 1120973497 /nfs/dbraw/zinc/97/34/97/1120973497.db2.gz DTVMSKXWZPOMJG-MRXNPFEDSA-N 0 3 330.384 3.902 20 5 EHBDHN Cc1c(CN2CCCO[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000609233631 1121825527 /nfs/dbraw/zinc/82/55/27/1121825527.db2.gz FMCLMZOGDWGEHI-IBGZPJMESA-N 0 3 326.396 3.867 20 5 EHBDHN Cc1cccc(C)c1CN1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000610001044 1123710588 /nfs/dbraw/zinc/71/05/88/1123710588.db2.gz WGIHVQJLMUWRQT-UHFFFAOYSA-N 0 3 325.412 3.534 20 5 EHBDHN C[C@@](CO)(NCc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000610140409 1123734695 /nfs/dbraw/zinc/73/46/95/1123734695.db2.gz WGARNWADZXNQSL-INIZCTEOSA-N 0 3 326.824 3.669 20 5 EHBDHN CCC1(CC)[C@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H](C)[C@@H]1OC ZINC000617549836 1124648861 /nfs/dbraw/zinc/64/88/61/1124648861.db2.gz NKVAACKMBDSRIP-LQAWEQHXSA-N 0 3 347.415 3.665 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)[C@@H](C)c1ccco1 ZINC000069070376 1129420678 /nfs/dbraw/zinc/42/06/78/1129420678.db2.gz HACRBZABMGNPOG-ZDUSSCGKSA-N 0 3 331.372 3.518 20 5 EHBDHN C[C@@H]1CCC[C@H](C)N(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000125433618 1129691819 /nfs/dbraw/zinc/69/18/19/1129691819.db2.gz FOXKSGOKCFWXCY-OLZOCXBDSA-N 0 3 330.388 3.655 20 5 EHBDHN Cc1ncc([N+](=O)[O-])n1CCN[C@H](C)c1oc2ccccc2c1C ZINC000602810627 1129904116 /nfs/dbraw/zinc/90/41/16/1129904116.db2.gz NELRYIGNPOPTOY-GFCCVEGCSA-N 0 3 328.372 3.505 20 5 EHBDHN C[C@@H](NCc1ccc(Cn2ccnc2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000173316607 1130205315 /nfs/dbraw/zinc/20/53/15/1130205315.db2.gz YJUXMNCGNUFARK-OAHLLOKOSA-N 0 3 336.395 3.690 20 5 EHBDHN Cc1cnn([C@@H]2CCCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000245514987 1130228300 /nfs/dbraw/zinc/22/83/00/1130228300.db2.gz CXSDBPBANURGEM-NVXWUHKLSA-N 0 3 328.416 3.806 20 5 EHBDHN COc1ccc(OCCN2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000173455532 1130233908 /nfs/dbraw/zinc/23/39/08/1130233908.db2.gz JWXDANVZGVWJKS-CQSZACIVSA-N 0 3 348.424 3.881 20 5 EHBDHN CC[C@@H](C)[C@@H]1CCCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059324 1131461890 /nfs/dbraw/zinc/46/18/90/1131461890.db2.gz XKSQBTZGXBOLFE-PBHICJAKSA-N 0 3 343.431 3.711 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@](C)(F)CC2)c1F ZINC001173178943 1131991986 /nfs/dbraw/zinc/99/19/86/1131991986.db2.gz CHZIUHQIWCWBSP-SJCJKPOMSA-N 0 3 342.386 3.888 20 5 EHBDHN COc1ccc(F)c(F)c1CN[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173218556 1132003110 /nfs/dbraw/zinc/00/31/10/1132003110.db2.gz QBEBLBWYMFXLQM-NSHDSACASA-N 0 3 336.338 3.602 20 5 EHBDHN COc1ccc(F)c(F)c1CN[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173218554 1132003434 /nfs/dbraw/zinc/00/34/34/1132003434.db2.gz QBEBLBWYMFXLQM-LLVKDONJSA-N 0 3 336.338 3.602 20 5 EHBDHN COc1ccc(Nc2cccc3c2OCC[C@@H]3N(C)C)cc1[N+](=O)[O-] ZINC001176362067 1132920498 /nfs/dbraw/zinc/92/04/98/1132920498.db2.gz RSNKWOCLYJCATA-HNNXBMFYSA-N 0 3 343.383 3.732 20 5 EHBDHN CC1(C)C[C@]1(C)CNCc1c(Br)cccc1[N+](=O)[O-] ZINC001179468525 1133253378 /nfs/dbraw/zinc/25/33/78/1133253378.db2.gz GIPPFGVQGNJSQN-CQSZACIVSA-N 0 3 327.222 3.883 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000817544621 1133533677 /nfs/dbraw/zinc/53/36/77/1133533677.db2.gz CDMLATGMIVSRKS-UHFFFAOYSA-N 0 3 341.411 3.834 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC[C@H]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000774826207 1134026457 /nfs/dbraw/zinc/02/64/57/1134026457.db2.gz LYFBRKSBJYRBIJ-INIZCTEOSA-N 0 3 341.367 3.710 20 5 EHBDHN CC1(C)C[C@H](NC[C@H](O)c2ccccc2F)c2cc([N+](=O)[O-])ccc21 ZINC000788580594 1134147260 /nfs/dbraw/zinc/14/72/60/1134147260.db2.gz NRNJOBPQKMEBDJ-ROUUACIJSA-N 0 3 344.386 3.780 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN[C@H]2COCc3cccc(Cl)c32)cc1 ZINC000788590158 1134148712 /nfs/dbraw/zinc/14/87/12/1134148712.db2.gz UTAFRRSNYUFLSB-INIZCTEOSA-N 0 3 332.787 3.652 20 5 EHBDHN COc1ccccc1C[C@H]1CCCN1Cc1ccc([N+](=O)[O-])cc1F ZINC001190597235 1134725030 /nfs/dbraw/zinc/72/50/30/1134725030.db2.gz KXABDFKOJAHTDH-MRXNPFEDSA-N 0 3 344.386 3.950 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCC(F)(F)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC001170335492 1134752345 /nfs/dbraw/zinc/75/23/45/1134752345.db2.gz OOKZWXWHLAQASX-GFCCVEGCSA-N 0 3 342.386 3.902 20 5 EHBDHN CCS[C@H]1CCCC[C@H]1NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879227 1134811003 /nfs/dbraw/zinc/81/10/03/1134811003.db2.gz GPKSEPOWJBUJNU-HIFRSBDPSA-N 0 3 339.417 3.657 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(CNC[C@@H]2CCCO2)o1 ZINC000078968757 1135141021 /nfs/dbraw/zinc/14/10/21/1135141021.db2.gz OFYCTSJKFFWJHS-LBPRGKRZSA-N 0 3 336.775 3.777 20 5 EHBDHN CC[C@H](C)[C@](C)(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811479550 1136097487 /nfs/dbraw/zinc/09/74/87/1136097487.db2.gz HVRXDBQZIDHSQR-LKFCYVNXSA-N 0 3 335.231 3.788 20 5 EHBDHN C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274363 1136129952 /nfs/dbraw/zinc/12/99/52/1136129952.db2.gz HFTLOTDYQPDFFQ-APPDUMDISA-N 0 3 336.338 3.599 20 5 EHBDHN O=[N+]([O-])c1cc(Br)ccc1SCCN1CCCC1 ZINC000776433594 1136188287 /nfs/dbraw/zinc/18/82/87/1136188287.db2.gz XFMRJERVBIQMMR-UHFFFAOYSA-N 0 3 331.235 3.545 20 5 EHBDHN COc1ccc(-c2cc(C(=O)OCC(C)[N+](=O)[O-])sc2C)cc1 ZINC000813102521 1136288177 /nfs/dbraw/zinc/28/81/77/1136288177.db2.gz HOCZKHBDNJHLQJ-SNVBAGLBSA-N 0 3 335.381 3.554 20 5 EHBDHN CC(COC(=O)[C@@H](Oc1ccc(Cl)cc1)c1ccccc1)[N+](=O)[O-] ZINC000813102525 1136288436 /nfs/dbraw/zinc/28/84/36/1136288436.db2.gz HQZDZEGUAXTKGC-LRDDRELGSA-N 0 3 349.770 3.669 20 5 EHBDHN CC(COC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)[N+](=O)[O-] ZINC000813107363 1136293984 /nfs/dbraw/zinc/29/39/84/1136293984.db2.gz MNXYQDPXPZOJJZ-MXMFLMJRSA-N 0 3 335.356 3.776 20 5 EHBDHN Cc1cc(C(=O)OCC(C)[N+](=O)[O-])c(C)n1[C@H](C)c1ccccc1 ZINC000813111326 1136294910 /nfs/dbraw/zinc/29/49/10/1136294910.db2.gz GLDHHZMRTIPRDT-ZIAGYGMSSA-N 0 3 330.384 3.536 20 5 EHBDHN C[C@H]1CCCC[C@@H]1N(C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000173190368 1136341502 /nfs/dbraw/zinc/34/15/02/1136341502.db2.gz OADQQRRUZPCSFL-WFASDCNBSA-N 0 3 330.388 3.655 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCN(c3ccccc3F)C2)cc1Cl ZINC000814178679 1136411992 /nfs/dbraw/zinc/41/19/92/1136411992.db2.gz ZHWLJEPMPXZVIH-ZDUSSCGKSA-N 0 3 349.793 3.756 20 5 EHBDHN CN(Cc1ccc(Cl)c(F)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597183 1136457675 /nfs/dbraw/zinc/45/76/75/1136457675.db2.gz HUDNGQVMXAIFMK-INIZCTEOSA-N 0 3 338.766 3.553 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc2c(c1)CCCO2)c1ccc(N)c([N+](=O)[O-])c1 ZINC000853240422 1136521601 /nfs/dbraw/zinc/52/16/01/1136521601.db2.gz GZWASNNHGHUPCA-QWHCGFSZSA-N 0 3 341.411 3.914 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CCO[C@@H](c3ccccn3)C2)c1 ZINC000825085056 1137164828 /nfs/dbraw/zinc/16/48/28/1137164828.db2.gz JACRHWSWDROSMM-CXAGYDPISA-N 0 3 347.802 3.653 20 5 EHBDHN CC(C)Oc1cccc(CN(C)C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000120567736 1137286562 /nfs/dbraw/zinc/28/65/62/1137286562.db2.gz XSBASRNQSNHPMO-IBGZPJMESA-N 0 3 344.411 3.547 20 5 EHBDHN CC([C@H](OC(=O)[C@H]1C[C@@H]1c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882193 1137317147 /nfs/dbraw/zinc/31/71/47/1137317147.db2.gz NWJZSXCVXTXKJA-ANRZDRKOSA-N 0 3 343.354 3.879 20 5 EHBDHN C[C@H](NC[C@@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872038693 1137566885 /nfs/dbraw/zinc/56/68/85/1137566885.db2.gz OZMBRPKQGUDYRT-DZGCQCFKSA-N 0 3 332.375 3.551 20 5 EHBDHN CN1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc2ccccc2c2cccnc12 ZINC000874842443 1137624456 /nfs/dbraw/zinc/62/44/56/1137624456.db2.gz HMSGIULCUUKMML-PMACEKPBSA-N 0 3 345.446 3.697 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CC[C@@]2(C1)OCc1ccccc12 ZINC000877399189 1137675434 /nfs/dbraw/zinc/67/54/34/1137675434.db2.gz LSGHKIAYAUQZBO-FQEVSTJZSA-N 0 3 338.407 3.843 20 5 EHBDHN CC(C)c1cc([C@@H]2CCCN(Cc3ccccc3[N+](=O)[O-])C2)[nH]n1 ZINC000877783878 1137689750 /nfs/dbraw/zinc/68/97/50/1137689750.db2.gz JIAWHZLGUSCPCL-CQSZACIVSA-N 0 3 328.416 3.821 20 5 EHBDHN CC(C)c1cc([C@@H]2CCCN(Cc3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC000877783878 1137689751 /nfs/dbraw/zinc/68/97/51/1137689751.db2.gz JIAWHZLGUSCPCL-CQSZACIVSA-N 0 3 328.416 3.821 20 5 EHBDHN CCN(Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCC1 ZINC000877963274 1137697208 /nfs/dbraw/zinc/69/72/08/1137697208.db2.gz CMIOSTCLQGCWRT-UHFFFAOYSA-N 0 3 330.388 3.799 20 5 EHBDHN C[C@@H]1CCC[C@@H](C)N(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878128343 1137703601 /nfs/dbraw/zinc/70/36/01/1137703601.db2.gz CNZLIJAJKLBCMY-CHWSQXEVSA-N 0 3 330.388 3.655 20 5 EHBDHN CC1(C)CCCC[C@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878446570 1137716292 /nfs/dbraw/zinc/71/62/92/1137716292.db2.gz PDLUDBCLAGWANT-CQSZACIVSA-N 0 3 330.388 3.703 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCC(F)CC1 ZINC000878989309 1137734454 /nfs/dbraw/zinc/73/44/54/1137734454.db2.gz ITTCYPOFGMFCBZ-HIFPTAJRSA-N 0 3 348.378 3.651 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCC2(CCCCO2)CC1 ZINC000880455628 1137778909 /nfs/dbraw/zinc/77/89/09/1137778909.db2.gz AIGUBAFJJZAXCO-UHFFFAOYSA-N 0 3 334.416 3.529 20 5 EHBDHN CC[C@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCCOC1 ZINC000880469360 1137779611 /nfs/dbraw/zinc/77/96/11/1137779611.db2.gz KEDDAQTURDFCBJ-PBHICJAKSA-N 0 3 345.399 3.545 20 5 EHBDHN Cc1nc(C2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)[nH]c1C ZINC000886659477 1138109872 /nfs/dbraw/zinc/10/98/72/1138109872.db2.gz NJPKUZUAFUPNJC-UHFFFAOYSA-N 0 3 348.834 3.968 20 5 EHBDHN CCOC(=O)C1CCC(N(CC)Cc2csc([N+](=O)[O-])c2)CC1 ZINC000338379738 1138874600 /nfs/dbraw/zinc/87/46/00/1138874600.db2.gz ODNXEBJGRCJAGZ-UHFFFAOYSA-N 0 3 340.445 3.600 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000152743664 1139106506 /nfs/dbraw/zinc/10/65/06/1139106506.db2.gz NXZPLSONPVDFBG-SJCJKPOMSA-N 0 3 348.374 3.517 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000182911799 1140000539 /nfs/dbraw/zinc/00/05/39/1140000539.db2.gz DJQBSAGIKSFGQZ-HDMKZQKVSA-N 0 3 328.416 3.744 20 5 EHBDHN O=[N+]([O-])c1cc(CNCCc2ccccc2OC(F)F)cs1 ZINC000190883165 1140422371 /nfs/dbraw/zinc/42/23/71/1140422371.db2.gz IWDXRYLNCYXZEK-UHFFFAOYSA-N 0 3 328.340 3.590 20 5 EHBDHN CC(C)n1cnnc1[C@@H]1CCCN([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000266924394 1140738585 /nfs/dbraw/zinc/73/85/85/1140738585.db2.gz MUKRJPMPPQTOKN-HUUCEWRRSA-N 0 3 343.431 3.708 20 5 EHBDHN CCc1nc(C)c([C@H](C)N(C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625586 1141128390 /nfs/dbraw/zinc/12/83/90/1141128390.db2.gz CJVFZWRAJVFQOA-SWLSCSKDSA-N 0 3 349.456 3.649 20 5 EHBDHN Cc1ccc(NC2CCN([C@@H](C)c3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000269928375 1141158785 /nfs/dbraw/zinc/15/87/85/1141158785.db2.gz MMGFFCICUKZIMP-HNNXBMFYSA-N 0 3 340.427 3.936 20 5 EHBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCc1c(C)noc1C ZINC000271202081 1141323419 /nfs/dbraw/zinc/32/34/19/1141323419.db2.gz ZMRQFEVSIXCTMA-CYBMUJFWSA-N 0 3 335.429 3.860 20 5 EHBDHN C[C@@H](NC[C@H](O)c1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000271518374 1141386092 /nfs/dbraw/zinc/38/60/92/1141386092.db2.gz PWECTCXBUYORTC-BMIGLBTASA-N 0 3 338.766 3.772 20 5 EHBDHN C[C@H](NCCCCc1ccc([N+](=O)[O-])cc1)c1cn2ccccc2n1 ZINC000568304507 370704115 /nfs/dbraw/zinc/70/41/15/370704115.db2.gz RXGYUNJTMCFDQT-HNNXBMFYSA-N 0 3 338.411 3.916 20 5 EHBDHN COc1ccc([C@H](CNc2ccc([N+](=O)[O-])cc2)N2CCCC2)cc1 ZINC000022342871 212292290 /nfs/dbraw/zinc/29/22/90/212292290.db2.gz GMHFVJTVRKLQAD-IBGZPJMESA-N 0 3 341.411 3.852 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN[C@H](C)[C@H]1Oc2ccccc2[C@@H]1C ZINC000430219830 1015086806 /nfs/dbraw/zinc/08/68/06/1015086806.db2.gz NWZFVASZVGGNBO-QUJCMNEKSA-N 0 3 342.395 3.646 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@H](CC2CC2)C1 ZINC000339670819 1015491921 /nfs/dbraw/zinc/49/19/21/1015491921.db2.gz FUFRMWBBMHGYDF-GXTWGEPZSA-N 0 3 342.399 3.828 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000340334871 1016959922 /nfs/dbraw/zinc/95/99/22/1016959922.db2.gz VDCLWSTVWHQJIG-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN C[C@@H]1CCCC[C@@]1(C)NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000459622520 1032333994 /nfs/dbraw/zinc/33/39/94/1032333994.db2.gz YKHNGMOLPDLXTB-SJKOYZFVSA-N 0 3 330.388 3.703 20 5 EHBDHN COc1cccc(COCCN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000090806472 1032597823 /nfs/dbraw/zinc/59/78/23/1032597823.db2.gz BQDHJNHQLPMIRZ-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN CCc1ncc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449495978 1032665576 /nfs/dbraw/zinc/66/55/76/1032665576.db2.gz FRTSOAGWFZMLTM-AWEZNQCLSA-N 0 3 331.441 3.993 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@@]1(CO)C[C@H]1c1ccccc1 ZINC000289927273 1032676666 /nfs/dbraw/zinc/67/66/66/1032676666.db2.gz SRCUMVJZGINAQJ-FUHWJXTLSA-N 0 3 346.814 3.504 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNC2CC(C(F)(F)F)C2)c1 ZINC000574074634 1032692028 /nfs/dbraw/zinc/69/20/28/1032692028.db2.gz YEVZXOZZSACPSP-UHFFFAOYSA-N 0 3 340.248 3.627 20 5 EHBDHN C[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000118850289 1017992708 /nfs/dbraw/zinc/99/27/08/1017992708.db2.gz DOGKNZKQZLWAKG-IOASZLSFSA-N 0 3 342.399 3.798 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCO[C@H](c3ccncc3)C2)c(Cl)c1 ZINC000449544019 1032736635 /nfs/dbraw/zinc/73/66/35/1032736635.db2.gz VAWJUWVJTBOIIH-PBHICJAKSA-N 0 3 347.802 3.653 20 5 EHBDHN C[C@H]1CCCC[C@@H]1N(C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548075195 1018999051 /nfs/dbraw/zinc/99/90/51/1018999051.db2.gz XGALUINHRBIZIA-FZMZJTMJSA-N 0 3 339.823 3.697 20 5 EHBDHN COC[C@H](C)N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000510422310 1020867398 /nfs/dbraw/zinc/86/73/98/1020867398.db2.gz SXVOWXNDAGCSFJ-NSHDSACASA-N 0 3 338.791 3.975 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(CCCO)[C@@H]2CCc3ccccc32)cc1F ZINC000276270536 1020983900 /nfs/dbraw/zinc/98/39/00/1020983900.db2.gz CSXDPFDLTXTHKC-GOSISDBHSA-N 0 3 344.386 3.606 20 5 EHBDHN C[C@@H](NC[C@@H](O)c1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000187419811 1021090644 /nfs/dbraw/zinc/09/06/44/1021090644.db2.gz VKNPKYQIIMLSQJ-QLJPJBMISA-N 0 3 338.766 3.772 20 5 EHBDHN CC(C)(CNCc1nc2cc([N+](=O)[O-])ccc2o1)c1cccs1 ZINC000602557286 1032970067 /nfs/dbraw/zinc/97/00/67/1032970067.db2.gz NNCGYPDCVBFTIM-UHFFFAOYSA-N 0 3 331.397 3.865 20 5 EHBDHN CCS[C@@H]1CCC[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602567745 1032978687 /nfs/dbraw/zinc/97/86/87/1032978687.db2.gz KUHCFNCHZQNZDN-DGCLKSJQSA-N 0 3 335.429 3.890 20 5 EHBDHN CCC(CC)[C@@H]1C[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)CCO1 ZINC000602590254 1032988553 /nfs/dbraw/zinc/98/85/53/1032988553.db2.gz YGCNKDOCWISTEA-GUYCJALGSA-N 0 3 347.415 3.809 20 5 EHBDHN CN(Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCC(F)(F)CC1 ZINC000602663830 1033061078 /nfs/dbraw/zinc/06/10/78/1033061078.db2.gz WHPHDZPMCDWBFE-UHFFFAOYSA-N 0 3 325.315 3.746 20 5 EHBDHN COc1c([O-])ccc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)c1[N+](=O)[O-] ZINC000894579723 1022582453 /nfs/dbraw/zinc/58/24/53/1022582453.db2.gz AGUQYGUFNBXVDA-LLVKDONJSA-N 0 3 344.358 3.614 20 5 EHBDHN O=[N+]([O-])c1sc(CN[C@]23C[C@H]2CCCC3)cc1Br ZINC000602733064 1033124548 /nfs/dbraw/zinc/12/45/48/1033124548.db2.gz SGWAVFMKAJCLRP-PRHODGIISA-N 0 3 331.235 3.841 20 5 EHBDHN CCc1ccc([C@H]2CCCCCN2CCn2ccc([N+](=O)[O-])n2)o1 ZINC000176259672 1023945165 /nfs/dbraw/zinc/94/51/65/1023945165.db2.gz WJVMGTDWXNOLEJ-OAHLLOKOSA-N 0 3 332.404 3.564 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(CC(C)C)CC(C)(C)C ZINC000474206887 1024578378 /nfs/dbraw/zinc/57/83/78/1024578378.db2.gz HLGYJVPBUOLCPO-UHFFFAOYSA-N 0 3 335.448 3.846 20 5 EHBDHN COC1(OC)CC2(CN(Cc3cccc([N+](=O)[O-])c3C)[C@H]2C(C)C)C1 ZINC000895987852 1025044516 /nfs/dbraw/zinc/04/45/16/1025044516.db2.gz JJVFVQXOQDVVSG-KRWDZBQOSA-N 0 3 348.443 3.513 20 5 EHBDHN COc1ccc(OCCN2CCC(C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC001167548598 1025301430 /nfs/dbraw/zinc/30/14/30/1025301430.db2.gz CIQRUNPGKVXBLA-UHFFFAOYSA-N 0 3 348.443 3.884 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@H](c2ccn(C)n2)C1 ZINC000896493847 1025495866 /nfs/dbraw/zinc/49/58/66/1025495866.db2.gz WOBMZGKROULLQA-HKBKRHGFSA-N 0 3 340.427 3.611 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@H](c3ncc4n3CCCC4)C2)c1 ZINC000281881085 1025633400 /nfs/dbraw/zinc/63/34/00/1025633400.db2.gz AJDVYKRUQGYTBW-INIZCTEOSA-N 0 3 340.427 3.507 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000420945039 1027905916 /nfs/dbraw/zinc/90/59/16/1027905916.db2.gz KEZDZFBYOUDFNJ-GFCCVEGCSA-N 0 3 332.322 3.638 20 5 EHBDHN CN(CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(Br)o1 ZINC000523701636 1028553730 /nfs/dbraw/zinc/55/37/30/1028553730.db2.gz VLHBLMKOQPJUCS-UHFFFAOYSA-N 0 3 339.189 3.625 20 5 EHBDHN CCOc1ccc([C@H](C)NCCOc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000504920412 1029044330 /nfs/dbraw/zinc/04/43/30/1029044330.db2.gz OPQFEIWPMLFPRP-ZDUSSCGKSA-N 0 3 348.374 3.862 20 5 EHBDHN Cc1nccn1CCCCN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000130307976 1029359554 /nfs/dbraw/zinc/35/95/54/1029359554.db2.gz OGQWYZAVJRLONJ-UHFFFAOYSA-N 0 3 328.416 3.545 20 5 EHBDHN C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCc2occc21 ZINC000152250566 1029868692 /nfs/dbraw/zinc/86/86/92/1029868692.db2.gz NKGFMOUZDSTNGN-MLGOLLRUSA-N 0 3 343.383 3.572 20 5 EHBDHN CCCc1ncc(CN[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)o1 ZINC000453393421 1030242095 /nfs/dbraw/zinc/24/20/95/1030242095.db2.gz RQDFVYMYYWWJLX-MRXNPFEDSA-N 0 3 329.400 3.646 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc1 ZINC000237998390 1030807905 /nfs/dbraw/zinc/80/79/05/1030807905.db2.gz RAYICCUTZMGKKD-LJQANCHMSA-N 0 3 340.379 3.607 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000247146927 1030916398 /nfs/dbraw/zinc/91/63/98/1030916398.db2.gz YFBZPXXNOAJOIW-GJZGRUSLSA-N 0 3 347.459 3.530 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@H](Cc2nccs2)C1 ZINC000898071954 1033324210 /nfs/dbraw/zinc/32/42/10/1033324210.db2.gz VNRSXUGSAJGJDY-PKXJPQMGSA-N 0 3 329.425 3.629 20 5 EHBDHN Cc1nn(CN(C)C[C@H](C)c2ccccc2)c2cc([N+](=O)[O-])ccc12 ZINC000761291543 1033539672 /nfs/dbraw/zinc/53/96/72/1033539672.db2.gz UTPPTUHRNUMZQV-AWEZNQCLSA-N 0 3 338.411 3.946 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@H]2C[C@H](O)C2)ccc1Oc1ccccc1Cl ZINC000594998955 1033626284 /nfs/dbraw/zinc/62/62/84/1033626284.db2.gz MNJBPMKMGDJLNX-JOCQHMNTSA-N 0 3 348.786 3.653 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CO[C@H](C3CC3)C2)o1 ZINC000599006857 1033643462 /nfs/dbraw/zinc/64/34/62/1033643462.db2.gz LNXHIIRFKQMHOX-UGSOOPFHSA-N 0 3 328.368 3.512 20 5 EHBDHN Cc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000593013607 1033806886 /nfs/dbraw/zinc/80/68/86/1033806886.db2.gz KDSGNDBVCPNCHH-NEPJUHHUSA-N 0 3 346.305 3.589 20 5 EHBDHN CC(C)(C)c1cccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000595483528 1033808260 /nfs/dbraw/zinc/80/82/60/1033808260.db2.gz WAPAYBQJEWZLCW-UHFFFAOYSA-N 0 3 342.443 3.926 20 5 EHBDHN Cc1noc(CN2CCC[C@]2(C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000595552527 1033859567 /nfs/dbraw/zinc/85/95/67/1033859567.db2.gz MKHKUVMUYIXOSW-QGZVFWFLSA-N 0 3 333.363 3.628 20 5 EHBDHN Cc1nccc([C@@H]2CCCN([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834322 1033960492 /nfs/dbraw/zinc/96/04/92/1033960492.db2.gz QNUWPUOEJHIVET-XJKSGUPXSA-N 0 3 326.400 3.634 20 5 EHBDHN Cc1cc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000593118294 1033967241 /nfs/dbraw/zinc/96/72/41/1033967241.db2.gz POFDSYBOCUCIPG-VXGBXAGGSA-N 0 3 346.305 3.589 20 5 EHBDHN CC(C)c1cc(CN[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)on1 ZINC000169212574 1034150648 /nfs/dbraw/zinc/15/06/48/1034150648.db2.gz UREIRAXHOQAOSX-QGZVFWFLSA-N 0 3 329.400 3.817 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](N[C@@H]2C[C@@H]3OCCC[C@H]23)c2ccccc2)c1 ZINC000251436079 1034646857 /nfs/dbraw/zinc/64/68/57/1034646857.db2.gz AVFBLVKAOMQSFP-YSTOQKLRSA-N 0 3 338.407 3.841 20 5 EHBDHN CC(C)c1ccc(CN2CCC([C@@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000612402091 1034893558 /nfs/dbraw/zinc/89/35/58/1034893558.db2.gz HQIRUXLSTNPBFL-QGZVFWFLSA-N 0 3 332.444 3.967 20 5 EHBDHN CC[C@]1(CNCc2ccccc2[N+](=O)[O-])OCCc2ccccc21 ZINC000584498734 1035207057 /nfs/dbraw/zinc/20/70/57/1035207057.db2.gz CTXWLLOZSAYRQE-LJQANCHMSA-N 0 3 326.396 3.563 20 5 EHBDHN CC(C)[C@H]1CCCC[C@@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000460347100 1035923535 /nfs/dbraw/zinc/92/35/35/1035923535.db2.gz IKFXEFGSWKAAAK-CVEARBPZSA-N 0 3 344.415 3.949 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@H]2/C=C\c2ccccc2)c1 ZINC000780396959 1035995636 /nfs/dbraw/zinc/99/56/36/1035995636.db2.gz GRGGMFHENBNMTN-YZMSFBEDSA-N 0 3 338.407 3.806 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000056201444 1036139383 /nfs/dbraw/zinc/13/93/83/1036139383.db2.gz YIDIYSPAUDJCND-CABCVRRESA-N 0 3 341.411 3.889 20 5 EHBDHN CCN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCO1 ZINC000511505770 1036272979 /nfs/dbraw/zinc/27/29/79/1036272979.db2.gz FZRMAPSMYZQSHX-MRXNPFEDSA-N 0 3 330.384 3.856 20 5 EHBDHN CCOc1ccc(NC(=O)CN(C(CC)CC)C2CC2)c([N+](=O)[O-])c1 ZINC000165332616 1036414614 /nfs/dbraw/zinc/41/46/14/1036414614.db2.gz JMWAFORUFSWPJL-UHFFFAOYSA-N 0 3 349.431 3.585 20 5 EHBDHN Cc1ccccc1NC(=O)CCN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180399653 1036775550 /nfs/dbraw/zinc/77/55/50/1036775550.db2.gz LPJCEUUHWPFWAF-AWEZNQCLSA-N 0 3 327.384 3.583 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H]2CCCC(F)(F)C2)c1 ZINC000539526595 1036868154 /nfs/dbraw/zinc/86/81/54/1036868154.db2.gz ZNKLLXJIYOBBOL-SNVBAGLBSA-N 0 3 336.285 3.864 20 5 EHBDHN Cc1ccccc1CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237742971 1036901367 /nfs/dbraw/zinc/90/13/67/1036901367.db2.gz JXMDPZOFCGOYCN-UHFFFAOYSA-N 0 3 336.395 3.594 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NC[C@H]2CCC[C@H](O)C2)c2ccccc2)c1 ZINC000180621693 1037017514 /nfs/dbraw/zinc/01/75/14/1037017514.db2.gz LMXDYXDCLQPVJV-RYGJVYDSSA-N 0 3 340.423 3.825 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3C[C@H]4CC[C@@H]3O4)o2)c(Cl)c1 ZINC000152863025 1037034244 /nfs/dbraw/zinc/03/42/44/1037034244.db2.gz DNAPBPBYPQCDOM-JGFGOQIWSA-N 0 3 348.786 3.918 20 5 EHBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@@H](CCO)c1ccccc1 ZINC000539826869 1037253404 /nfs/dbraw/zinc/25/34/04/1037253404.db2.gz CTVPUZGPAFOGBW-VTSXBNNFSA-N 0 3 326.396 3.664 20 5 EHBDHN Cc1ccc([C@H](C)NCc2cccc3nsnc32)cc1[N+](=O)[O-] ZINC000271782319 1037287576 /nfs/dbraw/zinc/28/75/76/1037287576.db2.gz LBZOHPZCQKLURF-NSHDSACASA-N 0 3 328.397 3.759 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](C)Oc1cccc(F)c1 ZINC000462733817 1037333089 /nfs/dbraw/zinc/33/30/89/1037333089.db2.gz KSHFJFHQKUYORD-ZDUSSCGKSA-N 0 3 348.374 3.690 20 5 EHBDHN C[C@H]1C[C@H](NC(=O)c2cc3ccccc3c3cccnc23)CN1C1CC1 ZINC000177185132 1037409565 /nfs/dbraw/zinc/40/95/65/1037409565.db2.gz CRTWYUFDTRZXTO-HOCLYGCPSA-N 0 3 345.446 3.743 20 5 EHBDHN CC[C@H](C)[C@H](C)N(Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000104967828 1038769349 /nfs/dbraw/zinc/76/93/49/1038769349.db2.gz FHEJZPQPHJFNCB-STQMWFEESA-N 0 3 334.416 3.860 20 5 EHBDHN C[C@@H](C[C@H](O)c1cccs1)NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893268734 1038910014 /nfs/dbraw/zinc/91/00/14/1038910014.db2.gz YMZXDHSOBBCZGY-HZMBPMFUSA-N 0 3 340.832 3.912 20 5 EHBDHN CCCCN(CCOC)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549845176 1040032081 /nfs/dbraw/zinc/03/20/81/1040032081.db2.gz HAABAWMOYNTDSL-UHFFFAOYSA-N 0 3 334.338 3.862 20 5 EHBDHN CN(C)[C@H]1CCOc2c(Nc3ncc([N+](=O)[O-])cc3Cl)cccc21 ZINC000432945412 1040227701 /nfs/dbraw/zinc/22/77/01/1040227701.db2.gz RCMBTDWUZOOKIF-AWEZNQCLSA-N 0 3 348.790 3.772 20 5 EHBDHN COc1ccc(OCCN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000490831557 1040768691 /nfs/dbraw/zinc/76/86/91/1040768691.db2.gz YRFISSWZBCEUHO-UHFFFAOYSA-N 0 3 342.395 3.647 20 5 EHBDHN CCn1nccc1C1CCN([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000278837759 1041573634 /nfs/dbraw/zinc/57/36/34/1041573634.db2.gz IZAYSLZUGVSQPH-AWEZNQCLSA-N 0 3 328.416 3.752 20 5 EHBDHN COc1cc(C[NH2+]C2CC(C)(c3ccccc3)C2)c([N+](=O)[O-])cc1[O-] ZINC000344221975 1043468770 /nfs/dbraw/zinc/46/87/70/1043468770.db2.gz QTMYTKZTIHYWET-UHFFFAOYSA-N 0 3 342.395 3.519 20 5 EHBDHN C[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000765848106 1128559968 /nfs/dbraw/zinc/55/99/68/1128559968.db2.gz FOXNBIITMGOLLW-BLLLJJGKSA-N 0 3 326.352 3.725 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@H]2c2ccncc2)cc1 ZINC000153854217 1128776284 /nfs/dbraw/zinc/77/62/84/1128776284.db2.gz PKBPIBWZFMSCIR-SFHVURJKSA-N 0 3 327.384 3.596 20 5 EHBDHN CCCC[C@@H](COC)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494508913 1120583602 /nfs/dbraw/zinc/58/36/02/1120583602.db2.gz CKKGKPHEIQMHTL-ZDUSSCGKSA-N 0 3 334.338 3.908 20 5 EHBDHN O=[N+]([O-])c1cccc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)c1 ZINC000079924159 1129307178 /nfs/dbraw/zinc/30/71/78/1129307178.db2.gz SXHPVHUTPYKPBU-IBGZPJMESA-N 0 3 340.379 3.607 20 5 EHBDHN CC(C)(C)[C@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000543247691 1129371160 /nfs/dbraw/zinc/37/11/60/1129371160.db2.gz VPOOKZFNUWFWFB-ZDUSSCGKSA-N 0 3 330.388 3.513 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CN3C[C@H]4CCC[C@@H]4C3)cs2)c1 ZINC000093442936 1129588215 /nfs/dbraw/zinc/58/82/15/1129588215.db2.gz XLQLIOQXVGIDJG-ZIAGYGMSSA-N 0 3 329.425 3.950 20 5 EHBDHN Cc1ccc([C@H](CN[C@@H](C)c2cccc([N+](=O)[O-])c2)N2CCCC2)o1 ZINC000173371050 1130219479 /nfs/dbraw/zinc/21/94/79/1130219479.db2.gz WNANDWZYALZFQX-YJBOKZPZSA-N 0 3 343.427 3.984 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC2(CCCC2)C1 ZINC000173825374 1130319953 /nfs/dbraw/zinc/31/99/53/1130319953.db2.gz OMOHTTBJPXFIHG-ZDUSSCGKSA-N 0 3 342.399 3.972 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(C)[C@@H](c2ccccc2)C1 ZINC001173227933 1132008250 /nfs/dbraw/zinc/00/82/50/1132008250.db2.gz SPMVACWSVHGVDQ-OXQOHEQNSA-N 0 3 339.439 3.515 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NCc1cc(-c2ccccc2)on1 ZINC001173235875 1132010358 /nfs/dbraw/zinc/01/03/58/1132010358.db2.gz VPUDHQHHXQQIGS-AWEZNQCLSA-N 0 3 337.379 3.971 20 5 EHBDHN COc1ccc(C[C@@H](C)N2C[C@H]3CC[C@@H](C2)C3(F)F)c([N+](=O)[O-])c1 ZINC001170335422 1134752171 /nfs/dbraw/zinc/75/21/71/1134752171.db2.gz NJLDVJRMBWOYMQ-BNOWGMLFSA-N 0 3 340.370 3.512 20 5 EHBDHN CCN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCOC1 ZINC000809935404 1135902318 /nfs/dbraw/zinc/90/23/18/1135902318.db2.gz HDSFDUCTZHTNTG-JTQLQIEISA-N 0 3 333.215 3.760 20 5 EHBDHN Cc1nc(-c2cccc(Cl)c2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813100767 1136287766 /nfs/dbraw/zinc/28/77/66/1136287766.db2.gz WTPMFOIPQSRIQX-QMMMGPOBSA-N 0 3 340.788 3.594 20 5 EHBDHN CC(COC(=O)c1ccc(Oc2ccc(F)cc2F)cc1)[N+](=O)[O-] ZINC000813106182 1136293847 /nfs/dbraw/zinc/29/38/47/1136293847.db2.gz ZZFQOMZRFQUCEQ-JTQLQIEISA-N 0 3 337.278 3.579 20 5 EHBDHN CCc1nc(C)c([C@H](C)N(C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585599 1136448542 /nfs/dbraw/zinc/44/85/42/1136448542.db2.gz XLQDYMPCSRELSD-WFASDCNBSA-N 0 3 349.456 3.649 20 5 EHBDHN C[C@@H]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccco2)C1 ZINC000776589717 1136452863 /nfs/dbraw/zinc/45/28/63/1136452863.db2.gz VUPNDISZUILLIL-XYPHTWIQSA-N 0 3 330.384 3.694 20 5 EHBDHN CN(C)[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)c1ccccc1 ZINC000111195312 1136520534 /nfs/dbraw/zinc/52/05/34/1136520534.db2.gz XIQZUXGNAUJIBI-OAHLLOKOSA-N 0 3 342.424 3.919 20 5 EHBDHN C[C@H]1CCC[C@]1(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816660471 1136745684 /nfs/dbraw/zinc/74/56/84/1136745684.db2.gz FURJEYKQAJZKCY-XPTSAGLGSA-N 0 3 333.215 3.542 20 5 EHBDHN CC(=O)N(C)c1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000858496383 1136973588 /nfs/dbraw/zinc/97/35/88/1136973588.db2.gz RUONFMFTNWOMSN-AWEZNQCLSA-N 0 3 341.411 3.737 20 5 EHBDHN CC([C@H](OC(=O)CC1CCSCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845873588 1137316077 /nfs/dbraw/zinc/31/60/77/1137316077.db2.gz DDBPFMGZLVEMCC-ZBEGNZNMSA-N 0 3 341.404 3.609 20 5 EHBDHN CC(C)n1cccc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845873971 1137316088 /nfs/dbraw/zinc/31/60/88/1137316088.db2.gz FPCAKRQJNQYRFR-WBMJQRKESA-N 0 3 334.347 3.771 20 5 EHBDHN CC[C@H](CC(F)F)C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845878644 1137316364 /nfs/dbraw/zinc/31/63/64/1137316364.db2.gz HYBKQJAWRUHAPY-GPCCPHFNSA-N 0 3 333.306 3.757 20 5 EHBDHN CC[C@H](CC(F)F)C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845878646 1137316475 /nfs/dbraw/zinc/31/64/75/1137316475.db2.gz HYBKQJAWRUHAPY-RBZYPMLTSA-N 0 3 333.306 3.757 20 5 EHBDHN Cc1ccc([C@H](C)C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845878873 1137316793 /nfs/dbraw/zinc/31/67/93/1137316793.db2.gz TYNLTHOWGYHTQJ-MQIPJXDCSA-N 0 3 335.331 3.780 20 5 EHBDHN CC(C)c1cccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845879665 1137316848 /nfs/dbraw/zinc/31/68/48/1137316848.db2.gz WBSZVSSFSBVCJZ-YVEFUNNKSA-N 0 3 346.358 3.907 20 5 EHBDHN CC([C@H](OC(=O)[C@H]1C[C@@H]1c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882195 1137317141 /nfs/dbraw/zinc/31/71/41/1137317141.db2.gz NWJZSXCVXTXKJA-AWOKKLPBSA-N 0 3 343.354 3.879 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@]34CCC[C@H]3OCC4)o2)cc1 ZINC000865859776 1137317312 /nfs/dbraw/zinc/31/73/12/1137317312.db2.gz QCFJXSVDPGAYET-MSOLQXFVSA-N 0 3 328.368 3.656 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](O)c1ccccc1Cl ZINC000773011002 1137459145 /nfs/dbraw/zinc/45/91/45/1137459145.db2.gz QQJVHGFYNSZALU-PXAZEXFGSA-N 0 3 334.803 3.941 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN1CCc2ccccc2[C@H](C)C1 ZINC001171740831 1137511110 /nfs/dbraw/zinc/51/11/10/1137511110.db2.gz IIMQJDBWPTYHSA-CQSZACIVSA-N 0 3 326.396 3.765 20 5 EHBDHN C[C@@H](NCCc1cn(C)c2ncccc12)c1c(F)cccc1[N+](=O)[O-] ZINC000872090805 1137570810 /nfs/dbraw/zinc/57/08/10/1137570810.db2.gz DMXBJKOBDBNACL-GFCCVEGCSA-N 0 3 342.374 3.514 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000873097793 1137590223 /nfs/dbraw/zinc/59/02/23/1137590223.db2.gz FZHGVGQKFVNBHC-SHACYNPGSA-N 0 3 346.452 3.800 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(CN2CCC[C@@H]2C2CC2)o1 ZINC000878050629 1137700868 /nfs/dbraw/zinc/70/08/68/1137700868.db2.gz ZLZALHDQRGKBCE-CYBMUJFWSA-N 0 3 348.790 3.673 20 5 EHBDHN C[C@@H]1C[C@H](C)[C@@H](C)N(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497111 1137717975 /nfs/dbraw/zinc/71/79/75/1137717975.db2.gz QTVGNSHLRMFMIN-FRRDWIJNSA-N 0 3 330.388 3.511 20 5 EHBDHN CC(C)N(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCC1 ZINC000072824101 1138108257 /nfs/dbraw/zinc/10/82/57/1138108257.db2.gz GFLGZUNMFMZABY-UHFFFAOYSA-N 0 3 330.388 3.798 20 5 EHBDHN Cc1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c(CN(C)C)c1 ZINC000087363416 1138190661 /nfs/dbraw/zinc/19/06/61/1138190661.db2.gz YSNJKSAKGDVOEZ-UHFFFAOYSA-N 0 3 341.411 3.536 20 5 EHBDHN CC[C@@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000302092479 1138711355 /nfs/dbraw/zinc/71/13/55/1138711355.db2.gz FEKLVSBBTSXTAX-JSGCOSHPSA-N 0 3 337.420 3.549 20 5 EHBDHN COCc1cc([N+](=O)[O-])ccc1NC[C@H](c1ccsc1)N(C)C ZINC000266973710 1140745493 /nfs/dbraw/zinc/74/54/93/1140745493.db2.gz MUDFIWMOCZYOAH-MRXNPFEDSA-N 0 3 335.429 3.518 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC[C@@H]2C[C@H](O)c2cccs2)cc1 ZINC000267463484 1140793989 /nfs/dbraw/zinc/79/39/89/1140793989.db2.gz TVBWOBSWKPVSCE-CVEARBPZSA-N 0 3 332.425 3.744 20 5 EHBDHN C[C@@H]1C[C@H](CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000271258084 1141335382 /nfs/dbraw/zinc/33/53/82/1141335382.db2.gz ACNPFXXMGUQUQT-CHWSQXEVSA-N 0 3 347.440 3.623 20 5 EHBDHN COc1ccc([C@@H]2CCN(Cc3ccc([N+](=O)[O-])cc3OC)C2)cc1 ZINC000430228996 1015127502 /nfs/dbraw/zinc/12/75/02/1015127502.db2.gz SOCLOLZJZBCBLB-OAHLLOKOSA-N 0 3 342.395 3.602 20 5 EHBDHN CC[C@@H](NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000538160757 1032180561 /nfs/dbraw/zinc/18/05/61/1032180561.db2.gz POQNLLVTQWPWCN-MRXNPFEDSA-N 0 3 341.411 3.891 20 5 EHBDHN CC[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000593063206 1032663685 /nfs/dbraw/zinc/66/36/85/1032663685.db2.gz GLUILJNWCSXNHH-HNNXBMFYSA-N 0 3 345.374 3.803 20 5 EHBDHN CCc1ncc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449495979 1032664398 /nfs/dbraw/zinc/66/43/98/1032664398.db2.gz FRTSOAGWFZMLTM-CQSZACIVSA-N 0 3 331.441 3.993 20 5 EHBDHN CC(C)[C@H](O)C1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000537383793 1032680793 /nfs/dbraw/zinc/68/07/93/1032680793.db2.gz NXQAHEKGGSTRBM-SFHVURJKSA-N 0 3 344.411 3.742 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000177340780 1017624749 /nfs/dbraw/zinc/62/47/49/1017624749.db2.gz IJWTYPOMGWYMES-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN CC(C)[C@@H](O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000236777523 1018115099 /nfs/dbraw/zinc/11/50/99/1018115099.db2.gz CVFCEURSFKNSAT-HNNXBMFYSA-N 0 3 338.791 3.615 20 5 EHBDHN CC[C@H](C[C@@H](C)CO)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610345672 1018359480 /nfs/dbraw/zinc/35/94/80/1018359480.db2.gz YGLVEXOWMUJLCN-TZMCWYRMSA-N 0 3 349.456 3.605 20 5 EHBDHN CC(C)C[C@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000542486255 1018739103 /nfs/dbraw/zinc/73/91/03/1018739103.db2.gz YPVMKENUQWEDPL-ZFWWWQNUSA-N 0 3 326.824 3.932 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCc1ccccc1O ZINC000602525065 1032958757 /nfs/dbraw/zinc/95/87/57/1032958757.db2.gz DTKHXCXHSCBJAK-UHFFFAOYSA-N 0 3 340.301 3.652 20 5 EHBDHN CC1(C)CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1O ZINC000438347717 1021313168 /nfs/dbraw/zinc/31/31/68/1021313168.db2.gz PIYUAIIPERJEMF-QGZVFWFLSA-N 0 3 346.452 3.916 20 5 EHBDHN Cc1cccc2c1CCN(CCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000729479702 1021667809 /nfs/dbraw/zinc/66/78/09/1021667809.db2.gz CBWPXNFWCWSYEX-UHFFFAOYSA-N 0 3 326.396 3.730 20 5 EHBDHN CC(C)(O)C(C)(C)CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602681757 1033082478 /nfs/dbraw/zinc/08/24/78/1033082478.db2.gz LXGWQAQUUIYXFZ-UHFFFAOYSA-N 0 3 334.338 3.500 20 5 EHBDHN Cn1cccc1[C@H]1CCCCN1CCOc1cccc([N+](=O)[O-])c1 ZINC000472328655 1033208232 /nfs/dbraw/zinc/20/82/32/1033208232.db2.gz OJUDZPUOKTVGOI-GOSISDBHSA-N 0 3 329.400 3.539 20 5 EHBDHN CO[C@@H](c1ccccc1F)[C@H](C)NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000538488090 1024398449 /nfs/dbraw/zinc/39/84/49/1024398449.db2.gz OGJSXJXIYMCCTE-SCLBCKFNSA-N 0 3 332.375 3.908 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425371668 1024895600 /nfs/dbraw/zinc/89/56/00/1024895600.db2.gz LOIXXGCCCVUSCF-ORUDLHBZSA-N 0 3 342.439 3.889 20 5 EHBDHN CN(C)[C@@H](CNc1ccc([N+](=O)[O-])c2ncccc12)c1cccs1 ZINC000346695436 1025019339 /nfs/dbraw/zinc/01/93/39/1025019339.db2.gz BPNAAHQFPVMOMR-HNNXBMFYSA-N 0 3 342.424 3.919 20 5 EHBDHN C[C@@H](NCc1ccc(N2CCCC2=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000119920204 1025423015 /nfs/dbraw/zinc/42/30/15/1025423015.db2.gz JXAUIRWWCNOUFT-CQSZACIVSA-N 0 3 339.395 3.572 20 5 EHBDHN C[C@@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CO1 ZINC000516063411 1025948661 /nfs/dbraw/zinc/94/86/61/1025948661.db2.gz SXSUOJOGLYPKTA-GHMZBOCLSA-N 0 3 336.775 3.775 20 5 EHBDHN CCOC(=O)C[C@@](C)(NCc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000479876782 1026869729 /nfs/dbraw/zinc/86/97/29/1026869729.db2.gz VESDMVWWPDPTJI-MRXNPFEDSA-N 0 3 342.823 3.706 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@H](c1ccccc1)C1CCOCC1 ZINC000367723823 1028514094 /nfs/dbraw/zinc/51/40/94/1028514094.db2.gz NBZKSNSABWXOBX-LJQANCHMSA-N 0 3 326.396 3.852 20 5 EHBDHN CCOc1ccc([C@H](C)NCCOC2CCCCC2)cc1[N+](=O)[O-] ZINC000504911088 1029053565 /nfs/dbraw/zinc/05/35/65/1029053565.db2.gz AIQDUIBUTADNOJ-AWEZNQCLSA-N 0 3 336.432 3.993 20 5 EHBDHN Cc1c([C@H](C)NCc2ccccc2-n2ccnc2)cccc1[N+](=O)[O-] ZINC000152241973 1029833751 /nfs/dbraw/zinc/83/37/51/1029833751.db2.gz VFNZTLKEVVUTHF-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN CC(C)(C)OC(=O)C[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000531868873 1029946112 /nfs/dbraw/zinc/94/61/12/1029946112.db2.gz NZYANAJHMQPGEZ-MRXNPFEDSA-N 0 3 348.443 3.581 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC3(CC2)OCCc2ccccc23)cc1 ZINC000453572731 1030361932 /nfs/dbraw/zinc/36/19/32/1030361932.db2.gz HMSDZEONDYYRAH-UHFFFAOYSA-N 0 3 338.407 3.659 20 5 EHBDHN CCOc1ccc([C@H](C)N[C@@H](C)c2cc[nH]c(=O)c2)cc1[N+](=O)[O-] ZINC000340448123 1030504579 /nfs/dbraw/zinc/50/45/79/1030504579.db2.gz GDUPUWUVPYTMNF-RYUDHWBXSA-N 0 3 331.372 3.506 20 5 EHBDHN CN(C)C[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776185 1030703319 /nfs/dbraw/zinc/70/33/19/1030703319.db2.gz TXLRGRAJRBHTFZ-FZMUQLTDSA-N 0 3 343.402 3.640 20 5 EHBDHN COc1ccc(CN2CC[C@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000527243072 1030731423 /nfs/dbraw/zinc/73/14/23/1030731423.db2.gz MTEQUISHTPKSTK-HNNXBMFYSA-N 0 3 330.359 3.732 20 5 EHBDHN Cn1cc(CN[C@H]2CCc3c2cccc3[N+](=O)[O-])c(-c2ccccc2)n1 ZINC000594500561 1033401686 /nfs/dbraw/zinc/40/16/86/1033401686.db2.gz OXXNOEHMTCGJIZ-SFHVURJKSA-N 0 3 348.406 3.772 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](Cc1ccccc1)OC ZINC000595043248 1033662307 /nfs/dbraw/zinc/66/23/07/1033662307.db2.gz VNZOECWUPMQWSG-YOEHRIQHSA-N 0 3 344.411 3.512 20 5 EHBDHN Cc1csc([C@H](C)NCCc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000599041506 1033670723 /nfs/dbraw/zinc/67/07/23/1033670723.db2.gz DRIMYYKAALFYLQ-JTQLQIEISA-N 0 3 325.821 3.906 20 5 EHBDHN COc1ccccc1[C@@H]1CCCN1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609040697 1033991865 /nfs/dbraw/zinc/99/18/65/1033991865.db2.gz KHHBTPGEDQCPMW-SFHVURJKSA-N 0 3 342.395 3.819 20 5 EHBDHN CC(C)(CNCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCCO1 ZINC000612186121 1034431528 /nfs/dbraw/zinc/43/15/28/1034431528.db2.gz QLIUHENGZNCEIT-OAHLLOKOSA-N 0 3 326.824 3.933 20 5 EHBDHN CC(C)CC[C@@H](O)CNCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000572632486 1034820348 /nfs/dbraw/zinc/82/03/48/1034820348.db2.gz HBRCAMYDLGJHNQ-CQSZACIVSA-N 0 3 334.338 3.500 20 5 EHBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)[C@H](C)C1CCCCC1 ZINC000548929603 1034911607 /nfs/dbraw/zinc/91/16/07/1034911607.db2.gz APTDDDVUKPPNNC-CQSZACIVSA-N 0 3 333.432 3.742 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC2(CC1)OCc1ccccc12 ZINC000612578848 1035075031 /nfs/dbraw/zinc/07/50/31/1035075031.db2.gz VRPWTUNBFOGIKU-UHFFFAOYSA-N 0 3 338.407 3.925 20 5 EHBDHN Cc1c(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cccc1[N+](=O)[O-] ZINC000180004615 1035173812 /nfs/dbraw/zinc/17/38/12/1035173812.db2.gz JUKALHRMVIQIBC-ZDUSSCGKSA-N 0 3 339.395 3.639 20 5 EHBDHN C[C@H](c1ccccc1)[C@@H](CO)NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000613389355 1035718914 /nfs/dbraw/zinc/71/89/14/1035718914.db2.gz IQQQROXKKQNDTB-MLGOLLRUSA-N 0 3 334.803 3.502 20 5 EHBDHN CC[C@H](c1ccc(F)cc1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365510512 1036028322 /nfs/dbraw/zinc/02/83/22/1036028322.db2.gz KEGVQTULRLDXJI-MRXNPFEDSA-N 0 3 332.379 3.719 20 5 EHBDHN COc1ccc(-c2ccc(CN3CC(C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000589736794 1036609533 /nfs/dbraw/zinc/60/95/33/1036609533.db2.gz OLJNAHDHDNCXHU-UHFFFAOYSA-N 0 3 328.368 3.705 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2CCN([C@H](C)c3ccccc3)C2)n1 ZINC000541935856 1036860505 /nfs/dbraw/zinc/86/05/05/1036860505.db2.gz NAETWWQEKLWUHA-NVXWUHKLSA-N 0 3 340.427 3.854 20 5 EHBDHN C[C@]1(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCO1 ZINC000180740673 1037135302 /nfs/dbraw/zinc/13/53/02/1037135302.db2.gz CCZXNUSHEVDOAS-RBUKOAKNSA-N 0 3 326.396 3.843 20 5 EHBDHN CC[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC000271769561 1037168318 /nfs/dbraw/zinc/16/83/18/1037168318.db2.gz XBMRNMHBUNKGDR-SJORKVTESA-N 0 3 336.338 3.647 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H](C2CCC2)C1 ZINC000591061789 1037222296 /nfs/dbraw/zinc/22/22/96/1037222296.db2.gz IJRZIFUAFMCBLT-SWLSCSKDSA-N 0 3 342.399 3.828 20 5 EHBDHN Cc1ccc([C@@H](C)NCc2cccc3nsnc32)cc1[N+](=O)[O-] ZINC000271782318 1037271516 /nfs/dbraw/zinc/27/15/16/1037271516.db2.gz LBZOHPZCQKLURF-LLVKDONJSA-N 0 3 328.397 3.759 20 5 EHBDHN CC(C)(NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000508660379 1037273745 /nfs/dbraw/zinc/27/37/45/1037273745.db2.gz ZFDXUBCYOZPWCX-UHFFFAOYSA-N 0 3 347.802 3.712 20 5 EHBDHN C[C@]1(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO[C@H]1C1CC1 ZINC000542316382 1037282442 /nfs/dbraw/zinc/28/24/42/1037282442.db2.gz UHBSMFFDGTYYBX-OALUTQOASA-N 0 3 342.395 3.902 20 5 EHBDHN CC[C@@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341220571 1037784027 /nfs/dbraw/zinc/78/40/27/1037784027.db2.gz NVGNGAFCBIGPCG-SUMWQHHRSA-N 0 3 327.384 3.663 20 5 EHBDHN Cc1cccc([C@@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC000540386801 1037878324 /nfs/dbraw/zinc/87/83/24/1037878324.db2.gz ZWRYDRZNOZLUHN-HUUCEWRRSA-N 0 3 341.411 3.889 20 5 EHBDHN Cc1ccc(-c2n[nH]cc2CNCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000480492420 1039600921 /nfs/dbraw/zinc/60/09/21/1039600921.db2.gz BIWXWBSAOJSIAI-UHFFFAOYSA-N 0 3 336.395 3.892 20 5 EHBDHN COc1ccc([C@@H]2CCN(Cc3ccc([N+](=O)[O-])c(OC)c3)C2)cc1 ZINC000489177921 1039700436 /nfs/dbraw/zinc/70/04/36/1039700436.db2.gz UFNRFKHHGYNPEY-MRXNPFEDSA-N 0 3 342.395 3.602 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CCN(CCCc1ccc3c(c1)CCO3)C2 ZINC000555418513 1040553826 /nfs/dbraw/zinc/55/38/26/1040553826.db2.gz GAVDLQPSMYLVDU-UHFFFAOYSA-N 0 3 338.407 3.521 20 5 EHBDHN CC[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CC1(C)C ZINC000419315165 1041277324 /nfs/dbraw/zinc/27/73/24/1041277324.db2.gz JIDMINXPSNGAFP-KGLIPLIRSA-N 0 3 330.388 3.559 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC(c3ncc4n3CCCC4)CC2)c1 ZINC000278888564 1042841746 /nfs/dbraw/zinc/84/17/46/1042841746.db2.gz NYSHXAPOMYWOCY-UHFFFAOYSA-N 0 3 340.427 3.507 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(C[S@@](C)=O)cc1 ZINC000552317876 1127748996 /nfs/dbraw/zinc/74/89/96/1127748996.db2.gz JWEQKVYLLIKZAQ-JBEBIEQOSA-N 0 3 346.452 3.633 20 5 EHBDHN CN1CCC[C@@H](CNc2ncccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301443889 1127926451 /nfs/dbraw/zinc/92/64/51/1127926451.db2.gz VAJAUWOWVMEJHE-SWLSCSKDSA-N 0 3 332.429 3.546 20 5 EHBDHN C[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000765848108 1128559953 /nfs/dbraw/zinc/55/99/53/1128559953.db2.gz FOXNBIITMGOLLW-LRDDRELGSA-N 0 3 326.352 3.725 20 5 EHBDHN CC(C)C[C@@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000542486175 1120609341 /nfs/dbraw/zinc/60/93/41/1120609341.db2.gz YPVMKENUQWEDPL-DZGCQCFKSA-N 0 3 326.824 3.932 20 5 EHBDHN CC1(C)CC[C@@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)O1 ZINC000495167819 1120976298 /nfs/dbraw/zinc/97/62/98/1120976298.db2.gz NTSGOUBOIUAGIW-INIZCTEOSA-N 0 3 330.384 3.902 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CC[C@H]3SCCS[C@@H]23)c1 ZINC000762613013 1121382315 /nfs/dbraw/zinc/38/23/15/1121382315.db2.gz GPJVEMOVJVUEEB-MCIONIFRSA-N 0 3 344.889 3.717 20 5 EHBDHN C[C@@H](C[C@H]1CCCO1)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113333107 1129002704 /nfs/dbraw/zinc/00/27/04/1129002704.db2.gz WGRUHMROZABVMO-BLLLJJGKSA-N 0 3 347.440 3.766 20 5 EHBDHN Cc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(CN(C)C)c1 ZINC000072840312 1123166917 /nfs/dbraw/zinc/16/69/17/1123166917.db2.gz CEIGICFEIDUEAA-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN O=[N+]([O-])c1sccc1NCC1(N2CCSCC2)CCCCC1 ZINC000609564173 1123609592 /nfs/dbraw/zinc/60/95/92/1123609592.db2.gz POSJNKCKDPBXMN-UHFFFAOYSA-N 0 3 341.502 3.820 20 5 EHBDHN Cc1ccc([C@H](CNc2nccc(C)c2[N+](=O)[O-])N2CCCC2)cc1 ZINC000609669844 1123639464 /nfs/dbraw/zinc/63/94/64/1123639464.db2.gz TUEWPXUQBRRYEM-KRWDZBQOSA-N 0 3 340.427 3.856 20 5 EHBDHN Cc1ccc([C@@H](CNc2nccc(C)c2[N+](=O)[O-])N2CCCC2)cc1 ZINC000609669845 1123639608 /nfs/dbraw/zinc/63/96/08/1123639608.db2.gz TUEWPXUQBRRYEM-QGZVFWFLSA-N 0 3 340.427 3.856 20 5 EHBDHN COc1cc(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c([N+](=O)[O-])cc1[O-] ZINC000466385711 1129415329 /nfs/dbraw/zinc/41/53/29/1129415329.db2.gz JAABATAVAHXACG-CTYIDZIISA-N 0 3 342.395 3.653 20 5 EHBDHN CCOc1ccc([C@H](C)NCCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000154108465 1129532965 /nfs/dbraw/zinc/53/29/65/1129532965.db2.gz UWYIQTSPHZSTGJ-HNNXBMFYSA-N 0 3 344.411 3.861 20 5 EHBDHN CCc1nc(CN[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cs1 ZINC000156405063 1129714899 /nfs/dbraw/zinc/71/48/99/1129714899.db2.gz NNQZUFALMJJXNO-HNNXBMFYSA-N 0 3 331.441 3.725 20 5 EHBDHN CC(C)(CCO)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000305846710 1129928464 /nfs/dbraw/zinc/92/84/64/1129928464.db2.gz SUMXIMBWKWYLKE-GOSISDBHSA-N 0 3 328.412 3.682 20 5 EHBDHN C[C@H](NCc1cccc(Cn2cccn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173340981 1130211238 /nfs/dbraw/zinc/21/12/38/1130211238.db2.gz NFJFQLXKXROLEO-HNNXBMFYSA-N 0 3 336.395 3.690 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H](C)[C@@H](C)C1 ZINC000246055884 1130339183 /nfs/dbraw/zinc/33/91/83/1130339183.db2.gz XWJJRVJVCAPJGK-FRRDWIJNSA-N 0 3 330.388 3.684 20 5 EHBDHN C[C@@H]1C[C@@H]2CCCC[C@H]2N1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000246107245 1130345576 /nfs/dbraw/zinc/34/55/76/1130345576.db2.gz DOGKNZKQZLWAKG-DVOMOZLQSA-N 0 3 342.399 3.798 20 5 EHBDHN CCOC(=O)CC[C@H]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246532341 1130390906 /nfs/dbraw/zinc/39/09/06/1130390906.db2.gz CNUYOTNLQMSFMT-HUUCEWRRSA-N 0 3 334.416 3.711 20 5 EHBDHN CC(C)[C@H]1CCCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000738237609 1131465685 /nfs/dbraw/zinc/46/56/85/1131465685.db2.gz ANAAIQWZGNLNFJ-HNNXBMFYSA-N 0 3 343.431 3.569 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC3(CCCC3)C2)c1F ZINC001173188471 1131993809 /nfs/dbraw/zinc/99/38/09/1131993809.db2.gz FOUJUQWVBKJNIS-CYBMUJFWSA-N 0 3 336.407 3.940 20 5 EHBDHN COc1c(F)cc(F)cc1CN[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173216550 1132002067 /nfs/dbraw/zinc/00/20/67/1132002067.db2.gz LWMQYOAHBIACSY-NSHDSACASA-N 0 3 336.338 3.602 20 5 EHBDHN CCCN1CCc2c(N)sc(Nc3ccc([N+](=O)[O-])cc3)c2C1 ZINC001174477287 1132381021 /nfs/dbraw/zinc/38/10/21/1132381021.db2.gz JBRJZBSBEOKXSL-UHFFFAOYSA-N 0 3 332.429 3.750 20 5 EHBDHN CCCCC[C@@H]1CCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767765743 1133050226 /nfs/dbraw/zinc/05/02/26/1133050226.db2.gz RWZYZTWFGXRRHN-MRXNPFEDSA-N 0 3 343.431 3.856 20 5 EHBDHN C[C@H]1C[C@@H](Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])CN1C1CC1 ZINC001185775485 1134131569 /nfs/dbraw/zinc/13/15/69/1134131569.db2.gz QERDDIRMVBMERO-GXSJLCMTSA-N 0 3 329.322 3.651 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC(F)(c3ccccc3)CC2)cc1 ZINC000789311716 1134252394 /nfs/dbraw/zinc/25/23/94/1134252394.db2.gz UAJQAIRKZVAPKX-SFHVURJKSA-N 0 3 344.386 3.589 20 5 EHBDHN CC(C)OCCN1CCC(Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000791413457 1134547511 /nfs/dbraw/zinc/54/75/11/1134547511.db2.gz OICYBUUYPSWQOR-UHFFFAOYSA-N 0 3 341.839 3.550 20 5 EHBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000792877048 1134810603 /nfs/dbraw/zinc/81/06/03/1134810603.db2.gz PSUFYWYTFZYHGQ-ZDUSSCGKSA-N 0 3 343.383 3.959 20 5 EHBDHN CC[C@H](C)N[C@@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccco1 ZINC000804784282 1135199414 /nfs/dbraw/zinc/19/94/14/1135199414.db2.gz ZMCVOHGOQVPRDR-FZMZJTMJSA-N 0 3 348.359 3.637 20 5 EHBDHN CCC1(CC)[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1OC ZINC001194091439 1135231395 /nfs/dbraw/zinc/23/13/95/1135231395.db2.gz MOPADTJBXWQUQK-CABCVRRESA-N 0 3 326.824 3.932 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H](CO)C1CCCC1 ZINC000810116151 1135927988 /nfs/dbraw/zinc/92/79/88/1135927988.db2.gz VCHGTXTXCHKCEB-ZDUSSCGKSA-N 0 3 333.215 3.542 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3COC4(CCC4)C3)o2)cc1 ZINC000850367552 1136242527 /nfs/dbraw/zinc/24/25/27/1136242527.db2.gz MSKUGQXXJPZVOM-CQSZACIVSA-N 0 3 328.368 3.656 20 5 EHBDHN CC(C)[C@@H](O)[C@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000850553739 1136284318 /nfs/dbraw/zinc/28/43/18/1136284318.db2.gz CACWDPNOHAMSAL-MJXNMMHHSA-N 0 3 343.427 3.586 20 5 EHBDHN CC(COC(=O)c1ccc(-c2nc3ccccc3s2)s1)[N+](=O)[O-] ZINC000813109302 1136293973 /nfs/dbraw/zinc/29/39/73/1136293973.db2.gz RNKJNJHRDWQHJK-SECBINFHSA-N 0 3 348.405 3.847 20 5 EHBDHN CCCN(Cc1ccccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580682 1136444929 /nfs/dbraw/zinc/44/49/29/1136444929.db2.gz YXEQQHWIAUNLAR-SFHVURJKSA-N 0 3 332.375 3.680 20 5 EHBDHN CC(=O)N(C)c1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000858496384 1136973682 /nfs/dbraw/zinc/97/36/82/1136973682.db2.gz RUONFMFTNWOMSN-CQSZACIVSA-N 0 3 341.411 3.737 20 5 EHBDHN CO[C@@H](CNCc1cc(Cl)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000824589486 1137144198 /nfs/dbraw/zinc/14/41/98/1137144198.db2.gz FIFMVMVVUPZMBU-MRXNPFEDSA-N 0 3 334.803 3.596 20 5 EHBDHN CC(C)(O)C(C)(C)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000825202817 1137168909 /nfs/dbraw/zinc/16/89/09/1137168909.db2.gz WAWFTUOMVRAMEO-UHFFFAOYSA-N 0 3 335.231 3.788 20 5 EHBDHN CC(C)(CNCc1cc([N+](=O)[O-])ccc1Cl)C1(O)CCCC1 ZINC000825232027 1137170154 /nfs/dbraw/zinc/17/01/54/1137170154.db2.gz KRSAZIAGMPPQRD-UHFFFAOYSA-N 0 3 326.824 3.669 20 5 EHBDHN Cc1ccc(CCC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845873394 1137316150 /nfs/dbraw/zinc/31/61/50/1137316150.db2.gz CXMUUOIHUXHXRM-YVEFUNNKSA-N 0 3 335.331 3.609 20 5 EHBDHN CC([C@@H](OC(=O)C[C@@H](C)c1ccncc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881161 1137316740 /nfs/dbraw/zinc/31/67/40/1137316740.db2.gz YPPPTEJNMJUCAX-FHSNZYRGSA-N 0 3 346.358 3.664 20 5 EHBDHN C[C@H](N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872057569 1137568637 /nfs/dbraw/zinc/56/86/37/1137568637.db2.gz GBQFDZKXLMIHHJ-NQERCMRGSA-N 0 3 334.391 3.732 20 5 EHBDHN O=[N+]([O-])c1cnn(C2CC(NCc3cccc(Cl)c3Cl)C2)c1 ZINC000876987977 1137666931 /nfs/dbraw/zinc/66/69/31/1137666931.db2.gz PDDYPOXWAAIGOJ-UHFFFAOYSA-N 0 3 341.198 3.591 20 5 EHBDHN CC(C)(O)C1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000877754226 1137688033 /nfs/dbraw/zinc/68/80/33/1137688033.db2.gz XYNNMCYIWQHUAD-UHFFFAOYSA-N 0 3 344.411 3.838 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCC1 ZINC000878348054 1137711824 /nfs/dbraw/zinc/71/18/24/1137711824.db2.gz CLPABRHPCWBNFA-LBPRGKRZSA-N 0 3 330.388 3.703 20 5 EHBDHN CC(C)(C)[C@@H]1CCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878406064 1137714532 /nfs/dbraw/zinc/71/45/32/1137714532.db2.gz YFSPLCRPBKMDNU-GFCCVEGCSA-N 0 3 330.388 3.513 20 5 EHBDHN Cc1nc(C2C[C@H]3CC[C@@H](C2)N3[C@@H](C)c2ccccc2[N+](=O)[O-])no1 ZINC000879681207 1137754985 /nfs/dbraw/zinc/75/49/85/1137754985.db2.gz MLLAQDDASMJZCY-PRTUASRFSA-N 0 3 342.399 3.758 20 5 EHBDHN C[C@@H](NC1(C2CC2)CCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000887147358 1138222869 /nfs/dbraw/zinc/22/28/69/1138222869.db2.gz JIBLCAMKWADOMT-LLVKDONJSA-N 0 3 328.372 3.628 20 5 EHBDHN Cc1ccc(CNCc2ccc([N+](=O)[O-])cc2)c(-c2ccnn2C)c1 ZINC000338422273 1138907562 /nfs/dbraw/zinc/90/75/62/1138907562.db2.gz GPUGLARSZRRRMR-UHFFFAOYSA-N 0 3 336.395 3.594 20 5 EHBDHN CC[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000179627632 1139769223 /nfs/dbraw/zinc/76/92/23/1139769223.db2.gz QCOJKNZTCZWMNS-IAGOWNOFSA-N 0 3 336.338 3.647 20 5 EHBDHN CC[C@H](NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccc2c(c1)CCO2 ZINC000268867215 1141011849 /nfs/dbraw/zinc/01/18/49/1141011849.db2.gz WWAFSPCDWPYGAU-INIZCTEOSA-N 0 3 342.395 3.779 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000269684237 1141135137 /nfs/dbraw/zinc/13/51/37/1141135137.db2.gz SHZCKIMIUIZJOO-MSOLQXFVSA-N 0 3 330.359 3.604 20 5 EHBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1nc2c(s1)CCCC2 ZINC000271600145 1141404676 /nfs/dbraw/zinc/40/46/76/1141404676.db2.gz VGADSUFTUPDDNO-LBPRGKRZSA-N 0 3 331.441 3.823 20 5 EHBDHN Cc1c(NC(=O)CCN2CC[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000348526349 1141545286 /nfs/dbraw/zinc/54/52/86/1141545286.db2.gz UTVBSTPPPOPEMM-SFHVURJKSA-N 0 3 339.395 3.679 20 5 EHBDHN C[C@H](c1ccco1)N(CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000283371419 1141611434 /nfs/dbraw/zinc/61/14/34/1141611434.db2.gz SJDKNNVGLIHXBB-CYBMUJFWSA-N 0 3 343.383 3.742 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN1CC[C@H](c2ccc(F)cc2)C1 ZINC000430211394 1014992089 /nfs/dbraw/zinc/99/20/89/1014992089.db2.gz IXSFNSREXVINNZ-AWEZNQCLSA-N 0 3 330.359 3.732 20 5 EHBDHN CSc1ccc([C@@H](CNCc2ccccc2[N+](=O)[O-])N(C)C)cc1 ZINC000339591222 1015091107 /nfs/dbraw/zinc/09/11/07/1015091107.db2.gz ZBLLICCHTYDZMI-GOSISDBHSA-N 0 3 345.468 3.709 20 5 EHBDHN C[C@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000246941335 1016160203 /nfs/dbraw/zinc/16/02/03/1016160203.db2.gz ZFYSHGAABDHQLO-STQMWFEESA-N 0 3 330.388 3.513 20 5 EHBDHN CC[C@@H]1OCC[C@H]1NCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000459733735 1032438362 /nfs/dbraw/zinc/43/83/62/1032438362.db2.gz BSGCDXHXTFXZGU-WBVHZDCISA-N 0 3 346.383 3.521 20 5 EHBDHN COc1cccc(COCCN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000090806471 1032596723 /nfs/dbraw/zinc/59/67/23/1032596723.db2.gz BQDHJNHQLPMIRZ-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN C[C@H](O)C[C@H](CNCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000893128117 1018577973 /nfs/dbraw/zinc/57/79/73/1018577973.db2.gz LHZCNMQZPLKIET-XJKSGUPXSA-N 0 3 348.830 3.893 20 5 EHBDHN COc1cccc([N+](=O)[O-])c1NC[C@@H](c1cccs1)N1CCCC1 ZINC000580242723 1018845950 /nfs/dbraw/zinc/84/59/50/1018845950.db2.gz OFDIAYQIXQXMHN-AWEZNQCLSA-N 0 3 347.440 3.914 20 5 EHBDHN COc1ccccc1[C@@H](CNc1ccccc1[N+](=O)[O-])N1CCCC1 ZINC000068836505 1019917914 /nfs/dbraw/zinc/91/79/14/1019917914.db2.gz PMGTTWMIHKBRTG-GOSISDBHSA-N 0 3 341.411 3.852 20 5 EHBDHN CC[C@H](NCc1ccc(NCCOC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000127167950 1020578078 /nfs/dbraw/zinc/57/80/78/1020578078.db2.gz MSGKCFFLDVXECR-IBGZPJMESA-N 0 3 343.427 3.894 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](n2ncc3ccccc32)C1 ZINC000510403171 1020768369 /nfs/dbraw/zinc/76/83/69/1020768369.db2.gz UDIOURXSBPUGRQ-KDOFPFPSSA-N 0 3 336.395 3.953 20 5 EHBDHN C[C@@H](NCc1cccc(Cn2ccnc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000151351590 1021309037 /nfs/dbraw/zinc/30/90/37/1021309037.db2.gz QBEOIBAYLRBPAX-OAHLLOKOSA-N 0 3 336.395 3.690 20 5 EHBDHN O=[N+]([O-])c1cccc(Cl)c1CN1CCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000322943098 1021476603 /nfs/dbraw/zinc/47/66/03/1021476603.db2.gz MUOVGBZQCTTXOG-VMGRFDJRSA-N 0 3 338.835 3.764 20 5 EHBDHN COc1cc(CN2CC[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453584 1021624519 /nfs/dbraw/zinc/62/45/19/1021624519.db2.gz HQKURWMNINJHKO-ZYHUDNBSSA-N 0 3 342.342 3.579 20 5 EHBDHN CN1C[C@H]2C[C@@H](C1)N(C(=O)c1cccc3cc4ccccc4cc31)C2 ZINC001270532020 1021714363 /nfs/dbraw/zinc/71/43/63/1021714363.db2.gz VTKKYBOYPSUNBB-BEFAXECRSA-N 0 3 330.431 3.769 20 5 EHBDHN Cn1ncc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1C1CC1 ZINC000894720598 1022793019 /nfs/dbraw/zinc/79/30/19/1022793019.db2.gz WKFBELZSPMPLEY-INIZCTEOSA-N 0 3 340.427 3.585 20 5 EHBDHN CCc1ccc([C@@H]2CCCCCN2CCn2ccc([N+](=O)[O-])n2)o1 ZINC000176259661 1023944720 /nfs/dbraw/zinc/94/47/20/1023944720.db2.gz WJVMGTDWXNOLEJ-HNNXBMFYSA-N 0 3 332.404 3.564 20 5 EHBDHN C[C@@H]1CC[C@@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000119475682 1024298156 /nfs/dbraw/zinc/29/81/56/1024298156.db2.gz JLWZGJKDJNFVGR-LALPHHSUSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@@H]1CC[C@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000119475423 1024299264 /nfs/dbraw/zinc/29/92/64/1024299264.db2.gz JLWZGJKDJNFVGR-JMSVASOKSA-N 0 3 330.388 3.559 20 5 EHBDHN CCOc1cc(CN2CCC[C@@H](c3cccnc3)C2)ccc1[N+](=O)[O-] ZINC000602857294 1033210942 /nfs/dbraw/zinc/21/09/42/1033210942.db2.gz UGKWJRSKOPWQEH-QGZVFWFLSA-N 0 3 341.411 3.768 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@H](CCO)c1ccc(Cl)cc1 ZINC000342293443 1024740039 /nfs/dbraw/zinc/74/00/39/1024740039.db2.gz GLMLJIDRUSTZEU-NJELEJDNSA-N 0 3 346.814 3.975 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[C@H]([C@@H]2CCCO2)C1 ZINC000895844052 1024891562 /nfs/dbraw/zinc/89/15/62/1024891562.db2.gz LOBOKPPTPOVYLV-WFASDCNBSA-N 0 3 344.333 3.615 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CNC1CC(c2cc(F)cc(F)c2)C1 ZINC000521317820 1025326396 /nfs/dbraw/zinc/32/63/96/1025326396.db2.gz ZCUDQONLKWPPDA-UHFFFAOYSA-N 0 3 348.349 3.917 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](Cc2nccs2)C1 ZINC000934334245 1025505842 /nfs/dbraw/zinc/50/58/42/1025505842.db2.gz UIYFFZSXAPYMGB-UONOGXRCSA-N 0 3 331.441 3.985 20 5 EHBDHN COC[C@@H](Cc1ccccc1)N(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000475141484 1026234685 /nfs/dbraw/zinc/23/46/85/1026234685.db2.gz WCQGTNDXSBZOFG-YRVHBARZSA-N 0 3 340.423 3.798 20 5 EHBDHN COCCC(C)(C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000546054990 1027962047 /nfs/dbraw/zinc/96/20/47/1027962047.db2.gz CFORIZVIKJQVOR-UHFFFAOYSA-N 0 3 335.429 3.623 20 5 EHBDHN Cc1cccc(C)c1[C@@H](C)N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000546225918 1028365235 /nfs/dbraw/zinc/36/52/35/1028365235.db2.gz SBMQXEJLMYSIHE-HUUCEWRRSA-N 0 3 341.411 3.889 20 5 EHBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccc(C(F)F)cc3)C2)nc1 ZINC000183968687 1028589497 /nfs/dbraw/zinc/58/94/97/1028589497.db2.gz ZJHBSVBAMYGEFM-AWEZNQCLSA-N 0 3 348.353 3.614 20 5 EHBDHN COc1ccc(Cl)cc1CN(C)CCc1ccc([N+](=O)[O-])cc1 ZINC000524426353 1029181771 /nfs/dbraw/zinc/18/17/71/1029181771.db2.gz KXWUUMVWUQXZNL-UHFFFAOYSA-N 0 3 334.803 3.931 20 5 EHBDHN CC[C@@H](C)[C@@H](C)N(CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288262 1029582225 /nfs/dbraw/zinc/58/22/25/1029582225.db2.gz WUFPQVPSYZPABD-TZMCWYRMSA-N 0 3 333.432 3.741 20 5 EHBDHN CC[C@@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000192493390 1029709839 /nfs/dbraw/zinc/70/98/39/1029709839.db2.gz UUJJFHVAEPMLFP-GOSISDBHSA-N 0 3 341.411 3.607 20 5 EHBDHN Cc1noc([C@@H]2CCCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000245529479 1030120207 /nfs/dbraw/zinc/12/02/07/1030120207.db2.gz RLFWDKNBSQVDCM-GXTWGEPZSA-N 0 3 330.388 3.535 20 5 EHBDHN COc1ccc(CCN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000441271834 1030212031 /nfs/dbraw/zinc/21/20/31/1030212031.db2.gz YWTDFSYWNXZVGZ-UHFFFAOYSA-N 0 3 326.396 3.811 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)CC1CCCC1 ZINC000064020993 1030394889 /nfs/dbraw/zinc/39/48/89/1030394889.db2.gz FDZYFZNTDBLJDT-GFCCVEGCSA-N 0 3 330.388 3.828 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H](C)N2[C@H](C)CC[C@@H]2C)n1 ZINC000526954271 1030502776 /nfs/dbraw/zinc/50/27/76/1030502776.db2.gz DPUKKFPPBRUGII-XQQFMLRXSA-N 0 3 330.388 3.887 20 5 EHBDHN C[C@@H](NC[C@H](O)C(F)F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000484468946 1031588476 /nfs/dbraw/zinc/58/84/76/1031588476.db2.gz BWONYPJNWXYMHT-SKDRFNHKSA-N 0 3 342.367 3.600 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@H](CN1CCCCC1)c1ccccc1 ZINC000611935372 1033440142 /nfs/dbraw/zinc/44/01/42/1033440142.db2.gz UMHINXNIGJJJFX-LJQANCHMSA-N 0 3 339.439 3.912 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H]1CCC2(CCCC2)O1 ZINC000595046634 1033663338 /nfs/dbraw/zinc/66/33/38/1033663338.db2.gz LWBSDNQSYONQCE-HIFRSBDPSA-N 0 3 334.416 3.746 20 5 EHBDHN COCc1csc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000595075952 1033694434 /nfs/dbraw/zinc/69/44/34/1033694434.db2.gz CGSXPDWEEVFPKA-KRWDZBQOSA-N 0 3 332.425 3.970 20 5 EHBDHN COc1cccc([C@H](CN[C@@H](C)c2cccc([N+](=O)[O-])c2)OC)c1 ZINC000599060974 1033701734 /nfs/dbraw/zinc/70/17/34/1033701734.db2.gz ICONOWLMTAMBHD-UGSOOPFHSA-N 0 3 330.384 3.642 20 5 EHBDHN CC1CCN([C@@H](CNc2cccnc2[N+](=O)[O-])c2cccs2)CC1 ZINC000603839148 1033953657 /nfs/dbraw/zinc/95/36/57/1033953657.db2.gz YALBIQKYPHTVRO-HNNXBMFYSA-N 0 3 346.456 3.936 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595747222 1033980665 /nfs/dbraw/zinc/98/06/65/1033980665.db2.gz IHYFDYCGZWCNKI-ZAAXVRCTSA-N 0 3 340.423 3.754 20 5 EHBDHN CN(CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)c(F)c1 ZINC000604012343 1034137987 /nfs/dbraw/zinc/13/79/87/1034137987.db2.gz YLCUENQSOOYYFV-UHFFFAOYSA-N 0 3 336.338 3.774 20 5 EHBDHN Cc1ccc(NCC2CCN(Cc3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000596441814 1034244188 /nfs/dbraw/zinc/24/41/88/1034244188.db2.gz RAFWSRIPFWBMGL-UHFFFAOYSA-N 0 3 340.427 3.622 20 5 EHBDHN C[C@@H](O)C1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000597233843 1034613035 /nfs/dbraw/zinc/61/30/35/1034613035.db2.gz AWPJQNJHRGUXBV-SNVBAGLBSA-N 0 3 336.775 3.511 20 5 EHBDHN CC[C@H](C)CN(C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000171948229 1034730503 /nfs/dbraw/zinc/73/05/03/1034730503.db2.gz UADYPSSSQNFBNO-QWRGUYRKSA-N 0 3 327.812 3.553 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCCO[C@H](c2ccccc2)C1 ZINC000612577377 1035072370 /nfs/dbraw/zinc/07/23/70/1035072370.db2.gz BZDOYKPCWPCTSW-IBGZPJMESA-N 0 3 326.396 3.867 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccccc1F ZINC000066434477 1035457735 /nfs/dbraw/zinc/45/77/35/1035457735.db2.gz ULCAZPCTBDPLJK-SFHVURJKSA-N 0 3 332.375 3.678 20 5 EHBDHN CC(C)[C@@H]1CCCC[C@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000460347103 1035925894 /nfs/dbraw/zinc/92/58/94/1035925894.db2.gz IKFXEFGSWKAAAK-JKSUJKDBSA-N 0 3 344.415 3.949 20 5 EHBDHN CC(C)[C@@H]1CCCC[C@@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000460361950 1036036455 /nfs/dbraw/zinc/03/64/55/1036036455.db2.gz JCMTYGUMJAHMCV-HOTGVXAUSA-N 0 3 344.415 3.949 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCc2cc(F)cc(F)c2)c(Cl)c1 ZINC000237709261 1036885916 /nfs/dbraw/zinc/88/59/16/1036885916.db2.gz YJDOGRUXNDWSKE-UHFFFAOYSA-N 0 3 326.730 3.859 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCCN2CCC=C(c3cccnc3)C2)cc1 ZINC000590741971 1037041046 /nfs/dbraw/zinc/04/10/46/1037041046.db2.gz QGXYGHUBDLBBPJ-UHFFFAOYSA-N 0 3 339.395 3.548 20 5 EHBDHN CC[C@H](NCc1cccc([N+](=O)[O-])c1C)c1ccc2c(c1)OCCO2 ZINC000180639442 1037041868 /nfs/dbraw/zinc/04/18/68/1037041868.db2.gz WKGOQLKFZLDBFQ-INIZCTEOSA-N 0 3 342.395 3.915 20 5 EHBDHN CC[C@H]1CCCC[C@@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000163395943 1037097499 /nfs/dbraw/zinc/09/74/99/1037097499.db2.gz OIDDBNWMHYVZHX-WFASDCNBSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1ccc([C@H](C)NC[C@@H](O)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000271800017 1037313437 /nfs/dbraw/zinc/31/34/37/1037313437.db2.gz PESJYSWBMYYIKQ-APPDUMDISA-N 0 3 336.338 3.566 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCC2(CCO)CCC2)c2ccccc2)c1 ZINC000494030008 1037787953 /nfs/dbraw/zinc/78/79/53/1037787953.db2.gz SKRICZFRBVMTJG-IBGZPJMESA-N 0 3 340.423 3.827 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ccc3c(c1)OCO3)CCCC2 ZINC000417295753 1039648639 /nfs/dbraw/zinc/64/86/39/1039648639.db2.gz FOGRARFEYWWHPF-QGZVFWFLSA-N 0 3 340.379 3.881 20 5 EHBDHN Cc1c([C@@H](C)N[C@@H](C)c2ccc(NC(N)=O)cc2)cccc1[N+](=O)[O-] ZINC000165434862 1042813859 /nfs/dbraw/zinc/81/38/59/1042813859.db2.gz SEUBGSDNDNVAGX-QWHCGFSZSA-N 0 3 342.399 3.806 20 5 EHBDHN COCCCN(C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000512297833 1044564092 /nfs/dbraw/zinc/56/40/92/1044564092.db2.gz AGGVEMSMDSQIMB-UHFFFAOYSA-N 0 3 348.374 3.995 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(C[S@@](C)=O)cc1 ZINC000552317877 1127749083 /nfs/dbraw/zinc/74/90/83/1127749083.db2.gz JWEQKVYLLIKZAQ-LFPIHBKWSA-N 0 3 346.452 3.633 20 5 EHBDHN COCCC[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000282156306 1127892789 /nfs/dbraw/zinc/89/27/89/1127892789.db2.gz DCXUEZYZURNWSP-SFHVURJKSA-N 0 3 332.375 3.991 20 5 EHBDHN C[C@@H]1CN(CCCCNc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)O1 ZINC000301580725 1128500549 /nfs/dbraw/zinc/50/05/49/1128500549.db2.gz SHSZWXCDCQVXLW-CHWSQXEVSA-N 0 3 341.839 3.550 20 5 EHBDHN CN(C(=O)c1cc2ccccc2c2cccnc12)[C@@H]1CCCN(C)C1 ZINC000172659541 1128775029 /nfs/dbraw/zinc/77/50/29/1128775029.db2.gz YBEUWLSSRCQSOP-MRXNPFEDSA-N 0 3 333.435 3.554 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CCN2Cc2ccccc2)c2ccncc21 ZINC000715711903 1128810342 /nfs/dbraw/zinc/81/03/42/1128810342.db2.gz KYWVJRXURMAUFF-INIZCTEOSA-N 0 3 348.406 3.829 20 5 EHBDHN COc1cccc([C@H](CNc2ccccc2[N+](=O)[O-])N2CCCC2)c1 ZINC000301055711 1121196158 /nfs/dbraw/zinc/19/61/58/1121196158.db2.gz GXQPEDIZPBUENL-IBGZPJMESA-N 0 3 341.411 3.852 20 5 EHBDHN C[C@H](N(C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)(C)C ZINC000920406103 1123364604 /nfs/dbraw/zinc/36/46/04/1123364604.db2.gz JHNZYJSYRPUWBC-JTQLQIEISA-N 0 3 327.812 3.553 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)[C@H]1CCCc2c1cnn2C ZINC000615835118 1123883988 /nfs/dbraw/zinc/88/39/88/1123883988.db2.gz PURRORKVIFRPAP-BLSFAOBESA-N 0 3 340.427 3.741 20 5 EHBDHN CCOc1cc(NC[C@H](c2ccco2)N2CCCC2)ccc1[N+](=O)[O-] ZINC000080763519 1125348584 /nfs/dbraw/zinc/34/85/84/1125348584.db2.gz RRBTVEZCENVBEU-MRXNPFEDSA-N 0 3 345.399 3.836 20 5 EHBDHN CCN(CC)C(=O)C1CCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000330734601 1129644350 /nfs/dbraw/zinc/64/43/50/1129644350.db2.gz VBUYTQSTMMEWEY-OAHLLOKOSA-N 0 3 347.459 3.545 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N[C@@H](C)c2cc(C)ccn2)c1F ZINC001173179266 1131992877 /nfs/dbraw/zinc/99/28/77/1131992877.db2.gz OPKKVJXXZSMCEE-OLZOCXBDSA-N 0 3 347.390 3.728 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N[C@H](C)c2ccc(C)cn2)c1F ZINC001173187403 1131993287 /nfs/dbraw/zinc/99/32/87/1131993287.db2.gz FFDZESAXMUPUPD-CHWSQXEVSA-N 0 3 347.390 3.728 20 5 EHBDHN O=[N+]([O-])c1cc2c(cc1NCCOc1cccc3ccccc31)CNC2 ZINC001169012632 1132631771 /nfs/dbraw/zinc/63/17/71/1132631771.db2.gz CPULVHHBLGPSCH-UHFFFAOYSA-N 0 3 349.390 3.842 20 5 EHBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCc3cccc(C(F)(F)F)c3C2)C1 ZINC001169039023 1132638530 /nfs/dbraw/zinc/63/85/30/1132638530.db2.gz MPANHCCZJQYBLO-DGCLKSJQSA-N 0 3 328.334 3.509 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CNC[C@H](O)C3CCCCC3)o2)c1 ZINC001177625206 1133088284 /nfs/dbraw/zinc/08/82/84/1133088284.db2.gz YLKQEOTWCQJJND-SFHVURJKSA-N 0 3 344.411 3.886 20 5 EHBDHN C[C@H]1COC[C@H]1NCc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001179644934 1133265761 /nfs/dbraw/zinc/26/57/61/1133265761.db2.gz AQHBBWLNBTUIFF-IINYFYTJSA-N 0 3 336.775 3.633 20 5 EHBDHN Cc1nn(CN2CC[C@@H](C)C3(CCC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000770670937 1133457730 /nfs/dbraw/zinc/45/77/30/1133457730.db2.gz UUMJLEBWSMXHCG-CYBMUJFWSA-N 0 3 328.416 3.723 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(C[C@@H](O)c2ccc(Cl)cc2)C2CC2)cc1 ZINC000774764041 1133966635 /nfs/dbraw/zinc/96/66/35/1133966635.db2.gz QRRHGUPQDGZRFM-GOSISDBHSA-N 0 3 346.814 3.946 20 5 EHBDHN C[C@H]1C[C@@H](c2ccccc2)CN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886614 1134100518 /nfs/dbraw/zinc/10/05/18/1134100518.db2.gz WGAZCGAXJHFDSH-XJKSGUPXSA-N 0 3 341.367 3.881 20 5 EHBDHN CN(Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000788481274 1134130385 /nfs/dbraw/zinc/13/03/85/1134130385.db2.gz HFPCAGTVIXUVBJ-QGZVFWFLSA-N 0 3 343.402 3.835 20 5 EHBDHN CC(C)c1cccc2c1CCN(C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC000789549159 1134295591 /nfs/dbraw/zinc/29/55/91/1134295591.db2.gz PRMUAJJNYVRIFI-HXUWFJFHSA-N 0 3 340.423 3.810 20 5 EHBDHN COc1ccc(C[C@H](C)N(Cc2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC001170352870 1134754307 /nfs/dbraw/zinc/75/43/07/1134754307.db2.gz SIFBYIAYZFONLV-ZDUSSCGKSA-N 0 3 330.384 3.792 20 5 EHBDHN COc1ccc(C[C@H](C)N2CC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350550 1134760492 /nfs/dbraw/zinc/76/04/92/1134760492.db2.gz BCKOBKZPJAPXAH-KBXCAEBGSA-N 0 3 326.396 3.981 20 5 EHBDHN CC(C)O[C@@H]1C[C@@H](NCc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001170386075 1134762271 /nfs/dbraw/zinc/76/22/71/1134762271.db2.gz MJQXZTJMKUYTKS-HUUCEWRRSA-N 0 3 326.824 3.930 20 5 EHBDHN CN(C)[C@H](CNc1ccc(N)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000804532136 1135109370 /nfs/dbraw/zinc/10/93/70/1135109370.db2.gz WWBRNOWNVLXNKD-MRXNPFEDSA-N 0 3 334.807 3.545 20 5 EHBDHN CCOc1cc(N2CCN(CCCC(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC001193987339 1135210875 /nfs/dbraw/zinc/21/08/75/1135210875.db2.gz CFJZSWQQIZZUMY-UHFFFAOYSA-N 0 3 349.475 3.942 20 5 EHBDHN CCN1CCN(c2ccc(Nc3sccc3[N+](=O)[O-])cc2)CC1 ZINC000775665776 1135443490 /nfs/dbraw/zinc/44/34/90/1135443490.db2.gz YTVZIWLSMIMELZ-UHFFFAOYSA-N 0 3 332.429 3.542 20 5 EHBDHN CCC[C@H](N[C@H]1COc2ccccc2[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000808728425 1135723102 /nfs/dbraw/zinc/72/31/02/1135723102.db2.gz DUCARYJTAXLGNT-JENIJYKNSA-N 0 3 342.395 3.520 20 5 EHBDHN O=[N+]([O-])c1cc(CN2CCCC[C@H]([C@@H]3CCOC3)C2)ccc1Cl ZINC001198563869 1135831020 /nfs/dbraw/zinc/83/10/20/1135831020.db2.gz TXPOPYPMTOLTCL-LSDHHAIUSA-N 0 3 338.835 3.887 20 5 EHBDHN CCOC(=O)C[C@@](C)(NCc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC000775894919 1135860687 /nfs/dbraw/zinc/86/06/87/1135860687.db2.gz KOFMWXPOINDFDJ-MRXNPFEDSA-N 0 3 342.823 3.706 20 5 EHBDHN C[C@@]1(CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCCC[C@H]1O ZINC000811483106 1136091234 /nfs/dbraw/zinc/09/12/34/1136091234.db2.gz BWNCBPXZKNGYLH-HIFRSBDPSA-N 0 3 347.242 3.932 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC1(CCO)CCCC1 ZINC000811482459 1136091600 /nfs/dbraw/zinc/09/16/00/1136091600.db2.gz KLXSGIYRFGAJRA-UHFFFAOYSA-N 0 3 347.242 3.934 20 5 EHBDHN Cc1c([N+](=O)[O-])cc(F)cc1-n1c(-c2ccccc2)cnc1[C@H](C)N ZINC001170681644 1136226444 /nfs/dbraw/zinc/22/64/44/1136226444.db2.gz SGLLADOSEIKQMY-LBPRGKRZSA-N 0 3 340.358 3.915 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN(Cc2ccc(Cl)cc2)C2CC2)cc1 ZINC000776578048 1136443543 /nfs/dbraw/zinc/44/35/43/1136443543.db2.gz CSAZXMUZXYTHMR-GOSISDBHSA-N 0 3 346.814 3.946 20 5 EHBDHN CCOc1ccccc1[C@H](CC)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776605471 1136473804 /nfs/dbraw/zinc/47/38/04/1136473804.db2.gz KXPJUJBOXLGKSM-ZWKOTPCHSA-N 0 3 344.411 3.768 20 5 EHBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)c1cc2ccccc2o1 ZINC000815111407 1136550254 /nfs/dbraw/zinc/55/02/54/1136550254.db2.gz CKEYTUBOAPZKIT-QGZVFWFLSA-N 0 3 340.379 3.549 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](CO)C2CCCCC2)c1 ZINC000815151295 1136557574 /nfs/dbraw/zinc/55/75/74/1136557574.db2.gz WQVVNSLHOYKRIF-AWEZNQCLSA-N 0 3 326.824 3.527 20 5 EHBDHN CC([C@@H](OC(=O)C1CCC(F)(F)CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878965 1137316695 /nfs/dbraw/zinc/31/66/95/1137316695.db2.gz UJNSSYPWVOSMLD-IINYFYTJSA-N 0 3 345.317 3.901 20 5 EHBDHN CCCc1nc(C)c(CN[C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])o1 ZINC000866364871 1137349742 /nfs/dbraw/zinc/34/97/42/1137349742.db2.gz QLIZIXNZVWQIDK-NSHDSACASA-N 0 3 335.379 3.704 20 5 EHBDHN CC(=O)Nc1ccc(CCN[C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872032622 1137566522 /nfs/dbraw/zinc/56/65/22/1137566522.db2.gz WVIIYHBZUDGNJG-GFCCVEGCSA-N 0 3 345.374 3.586 20 5 EHBDHN C[C@H](O)C[C@@H](CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872043218 1137567429 /nfs/dbraw/zinc/56/74/29/1137567429.db2.gz HPAYUNWATDAJJP-DZKIICNBSA-N 0 3 346.402 3.939 20 5 EHBDHN Cc1ccccc1NC(=O)C[C@@H](C)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129776 1137573146 /nfs/dbraw/zinc/57/31/46/1137573146.db2.gz RXBVVVFJLLTSGN-HUUCEWRRSA-N 0 3 341.411 3.971 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCc1cccc2c1CCOC2 ZINC000873151713 1137591442 /nfs/dbraw/zinc/59/14/42/1137591442.db2.gz YZOQCCYPEZNOAH-UHFFFAOYSA-N 0 3 326.396 3.574 20 5 EHBDHN C[C@H](c1ccncc1)N1CCC(Nc2ccccc2[N+](=O)[O-])CC1 ZINC000119296364 1137940165 /nfs/dbraw/zinc/94/01/65/1137940165.db2.gz IDWYZVITYRZBIK-CQSZACIVSA-N 0 3 326.400 3.627 20 5 EHBDHN Cc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000079324886 1138155036 /nfs/dbraw/zinc/15/50/36/1138155036.db2.gz MBNRSNNKAQZDDM-KBPBESRZSA-N 0 3 327.384 3.581 20 5 EHBDHN Cc1nn(C(C)(C)C)cc1[C@H](C)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000089580876 1138201710 /nfs/dbraw/zinc/20/17/10/1138201710.db2.gz DDPXDURRZJZSDJ-ZDUSSCGKSA-N 0 3 346.431 3.584 20 5 EHBDHN COCC1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000093103604 1138234312 /nfs/dbraw/zinc/23/43/12/1138234312.db2.gz YKZMPYRLNMSTKU-UHFFFAOYSA-N 0 3 330.384 3.713 20 5 EHBDHN CC[C@@H](NC[C@H](O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000124765741 1138294302 /nfs/dbraw/zinc/29/43/02/1138294302.db2.gz MJVFNPVQPBLENV-SJORKVTESA-N 0 3 336.338 3.647 20 5 EHBDHN CSC(C)(C)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174437967 1139420394 /nfs/dbraw/zinc/42/03/94/1139420394.db2.gz BJPJBDASYRQCNE-UHFFFAOYSA-N 0 3 337.470 3.950 20 5 EHBDHN CCc1ccc(C(=O)Nc2cc(CN(C)C)ccc2C)cc1[N+](=O)[O-] ZINC000177306964 1139612245 /nfs/dbraw/zinc/61/22/45/1139612245.db2.gz BUJLIKFIYUMSMZ-UHFFFAOYSA-N 0 3 341.411 3.780 20 5 EHBDHN C[C@H](NC[C@@H](O)c1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000266781868 1140724137 /nfs/dbraw/zinc/72/41/37/1140724137.db2.gz NEASNZXHJZMKDP-ZUZCIYMTSA-N 0 3 338.766 3.772 20 5 EHBDHN C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C ZINC000266899162 1140735671 /nfs/dbraw/zinc/73/56/71/1140735671.db2.gz TUAYBGRJDUQEGE-CHWSQXEVSA-N 0 3 339.395 3.526 20 5 EHBDHN CC(C)n1cnnc1[C@H]1CCCN([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000266924391 1140738164 /nfs/dbraw/zinc/73/81/64/1140738164.db2.gz MUKRJPMPPQTOKN-GJZGRUSLSA-N 0 3 343.431 3.708 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC[C@H]2C[C@@H](O)c2cccs2)cc1 ZINC000267463495 1140794363 /nfs/dbraw/zinc/79/43/63/1140794363.db2.gz TVBWOBSWKPVSCE-JKSUJKDBSA-N 0 3 332.425 3.744 20 5 EHBDHN CC(C)(C)[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000270667645 1141253059 /nfs/dbraw/zinc/25/30/59/1141253059.db2.gz PUWIRWCJPKVYCF-SWLSCSKDSA-N 0 3 326.824 3.932 20 5 EHBDHN C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cc[nH]c(=O)c1 ZINC000339453256 1014512199 /nfs/dbraw/zinc/51/21/99/1014512199.db2.gz FQSIINXQYQJVII-LBPRGKRZSA-N 0 3 339.351 3.806 20 5 EHBDHN CC(C)[C@@H]1CCCCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000117346963 1015073424 /nfs/dbraw/zinc/07/34/24/1015073424.db2.gz NTOQKCUDNVCIKN-HNNXBMFYSA-N 0 3 330.388 3.655 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN[C@H](C)[C@H]1Oc2ccccc2[C@H]1C ZINC000430219832 1015086760 /nfs/dbraw/zinc/08/67/60/1015086760.db2.gz NWZFVASZVGGNBO-VPZZIHKRSA-N 0 3 342.395 3.646 20 5 EHBDHN COc1ccc(COCCN[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000091741141 1015639713 /nfs/dbraw/zinc/63/97/13/1015639713.db2.gz PMWSCCHKGHYZRJ-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN CC(C)c1ccc(CN2CCC[C@H](c3ncc[nH]3)C2)cc1[N+](=O)[O-] ZINC000092072746 1032763601 /nfs/dbraw/zinc/76/36/01/1032763601.db2.gz KEAMYLBHTGPGTP-HNNXBMFYSA-N 0 3 328.416 3.821 20 5 EHBDHN Cc1nccc([C@H]2CCCN([C@@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368004 1018536350 /nfs/dbraw/zinc/53/63/50/1018536350.db2.gz AQKGNPWQJAHLQC-ZFWWWQNUSA-N 0 3 326.400 3.634 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCc2ccccc2OC(F)F)c(F)c1 ZINC000471527331 1018539853 /nfs/dbraw/zinc/53/98/53/1018539853.db2.gz QKFGXLDLPSZJNR-UHFFFAOYSA-N 0 3 340.301 3.668 20 5 EHBDHN CN(c1ccsc1[N+](=O)[O-])[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000610431090 1019084410 /nfs/dbraw/zinc/08/44/10/1019084410.db2.gz QAYHKZROZCFXQP-OAHLLOKOSA-N 0 3 331.441 3.757 20 5 EHBDHN C[C@H]1CCC[C@H](C)C1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000182951609 1019867893 /nfs/dbraw/zinc/86/78/93/1019867893.db2.gz AVWQANPUKKMQHY-RYUDHWBXSA-N 0 3 330.388 3.559 20 5 EHBDHN Cc1ccc(NC(=O)[C@H]2CCCCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000433117778 1019884433 /nfs/dbraw/zinc/88/44/33/1019884433.db2.gz VHERSKVWRWYSJO-MRXNPFEDSA-N 0 3 331.416 3.639 20 5 EHBDHN Cc1csc(CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000602510102 1032945041 /nfs/dbraw/zinc/94/50/41/1032945041.db2.gz JWBXBZHZPILOJC-UHFFFAOYSA-N 0 3 345.346 3.711 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c(Cl)c1 ZINC000519673849 1021603005 /nfs/dbraw/zinc/60/30/05/1021603005.db2.gz WWWYECZGVHFEKA-NUEKZKHPSA-N 0 3 336.819 3.686 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)C1CCC(C)(C)CC1 ZINC000438482656 1022702755 /nfs/dbraw/zinc/70/27/55/1022702755.db2.gz BJSRUNWNDSRHNT-UHFFFAOYSA-N 0 3 333.432 3.742 20 5 EHBDHN CC(C)[C@H]1CCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498571 1022727653 /nfs/dbraw/zinc/72/76/53/1022727653.db2.gz YFWBLTLOKRLXGT-JSGCOSHPSA-N 0 3 330.388 3.684 20 5 EHBDHN Cc1c(CN(CCO)[C@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510697644 1022902670 /nfs/dbraw/zinc/90/26/70/1022902670.db2.gz IEQQEGLSNQLCNF-FQEVSTJZSA-N 0 3 340.423 3.775 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(Cc2ccc(F)cc2)C2CCOCC2)c1 ZINC000277069289 1023735184 /nfs/dbraw/zinc/73/51/84/1023735184.db2.gz RCAVQLIFWTXFEQ-UHFFFAOYSA-N 0 3 344.386 3.915 20 5 EHBDHN CCOc1cc(CN2CCC[C@H](c3cccnc3)C2)ccc1[N+](=O)[O-] ZINC000602857292 1033211298 /nfs/dbraw/zinc/21/12/98/1033211298.db2.gz UGKWJRSKOPWQEH-KRWDZBQOSA-N 0 3 341.411 3.768 20 5 EHBDHN CCOC(=O)C[C@H](C)N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000346319061 1024618717 /nfs/dbraw/zinc/61/87/17/1024618717.db2.gz DGJNAZASLOLAEC-ZDUSSCGKSA-N 0 3 346.383 3.628 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@@H](CCO)c1ccc(Cl)cc1 ZINC000342293444 1024740278 /nfs/dbraw/zinc/74/02/78/1024740278.db2.gz GLMLJIDRUSTZEU-RCFWFJCLSA-N 0 3 346.814 3.975 20 5 EHBDHN CC[C@H]1CN(Cc2cc(=O)oc3ccc4ccccc4c23)CCCO1 ZINC000281308151 1024873924 /nfs/dbraw/zinc/87/39/24/1024873924.db2.gz HUSLGUPQFZAQQS-KRWDZBQOSA-N 0 3 337.419 3.947 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425371669 1024895724 /nfs/dbraw/zinc/89/57/24/1024895724.db2.gz LOIXXGCCCVUSCF-WSGSOLELSA-N 0 3 342.439 3.889 20 5 EHBDHN COC(=O)C(C)(C)[C@@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000611322286 1025087546 /nfs/dbraw/zinc/08/75/46/1025087546.db2.gz IQTARADSKNIRTJ-DZGCQCFKSA-N 0 3 334.416 3.567 20 5 EHBDHN COc1ccc(CN2CCC[C@@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000515510213 1025304519 /nfs/dbraw/zinc/30/45/19/1025304519.db2.gz HLSZEEKUGVNTGR-QGZVFWFLSA-N 0 3 344.386 3.950 20 5 EHBDHN O=[N+]([O-])c1cccc(F)c1CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000438996703 1025381946 /nfs/dbraw/zinc/38/19/46/1025381946.db2.gz PPOLSGIVJKGAMM-FDQGKXFDSA-N 0 3 336.407 3.640 20 5 EHBDHN CC1(C)CCCC[C@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000119927207 1025435312 /nfs/dbraw/zinc/43/53/12/1025435312.db2.gz PAUMYXIDGBLDIK-CQSZACIVSA-N 0 3 330.388 3.703 20 5 EHBDHN CCN(CC)[C@@H](CNc1c2c(ccc1[N+](=O)[O-])NCC2)c1ccco1 ZINC000436312020 1025574331 /nfs/dbraw/zinc/57/43/31/1025574331.db2.gz LTJSGTPKAABLIG-INIZCTEOSA-N 0 3 344.415 3.651 20 5 EHBDHN CSc1ccc([C@H](CNc2ncc(C)cc2[N+](=O)[O-])N(C)C)cc1 ZINC000338832538 1026213940 /nfs/dbraw/zinc/21/39/40/1026213940.db2.gz MZTLJMAYPDFKDG-INIZCTEOSA-N 0 3 346.456 3.735 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1-c1nc(-c2ccc(CN(C)C)cc2)no1 ZINC000530871833 1026371832 /nfs/dbraw/zinc/37/18/32/1026371832.db2.gz DRSFSUVCOSJCEC-UHFFFAOYSA-N 0 3 338.367 3.682 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC[C@H]2Cn2cnc3ccccc32)cc1 ZINC000339905525 1026726211 /nfs/dbraw/zinc/72/62/11/1026726211.db2.gz MGMABUBANYZJQR-KRWDZBQOSA-N 0 3 336.395 3.609 20 5 EHBDHN CC(C)c1ccc(C(=O)NC[C@H]2N(C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC001271542699 1026841507 /nfs/dbraw/zinc/84/15/07/1026841507.db2.gz IDABGWASBRMWFE-QGZVFWFLSA-N 0 3 347.459 3.568 20 5 EHBDHN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(C)c2F)c(CN(C)C)c1 ZINC000277854553 1027361733 /nfs/dbraw/zinc/36/17/33/1027361733.db2.gz YYZUKSYYGLMMPR-UHFFFAOYSA-N 0 3 345.374 3.665 20 5 EHBDHN CN(C)[C@@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccsc1 ZINC000783598656 1027718400 /nfs/dbraw/zinc/71/84/00/1027718400.db2.gz VLCOCTWTNXKHMZ-HNNXBMFYSA-N 0 3 339.848 3.702 20 5 EHBDHN CCN(CC)C(=O)C1(NCc2cccc([N+](=O)[O-])c2C)CCCCC1 ZINC000533383143 1027750250 /nfs/dbraw/zinc/75/02/50/1027750250.db2.gz BTHCBEWCICLAMG-UHFFFAOYSA-N 0 3 347.459 3.564 20 5 EHBDHN O=[N+]([O-])c1cccc(N2CCN(C[C@@H]3CCCC(F)(F)C3)CC2)c1 ZINC000513973418 1027967774 /nfs/dbraw/zinc/96/77/74/1027967774.db2.gz WBEBOXIBZAOXLY-CQSZACIVSA-N 0 3 339.386 3.542 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3CCCO3)o2)c(Cl)c1 ZINC000237816296 1028066897 /nfs/dbraw/zinc/06/68/97/1028066897.db2.gz GNWYAQUDWJKXAO-GFCCVEGCSA-N 0 3 336.775 3.777 20 5 EHBDHN CC(C)N(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1CCC1 ZINC000444774559 1028263309 /nfs/dbraw/zinc/26/33/09/1028263309.db2.gz JOTANCZXHJUJEX-UHFFFAOYSA-N 0 3 339.823 3.697 20 5 EHBDHN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c(CN(C)C)c1 ZINC000421463054 1028438813 /nfs/dbraw/zinc/43/88/13/1028438813.db2.gz DIINHRKFCWFNLD-UHFFFAOYSA-N 0 3 341.411 3.834 20 5 EHBDHN CCOc1ccc([C@H](C)NCCOc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000504899703 1029042701 /nfs/dbraw/zinc/04/27/01/1029042701.db2.gz KREMBSNONXPZEH-ZDUSSCGKSA-N 0 3 348.374 3.862 20 5 EHBDHN CC[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(OC)c(OC)c1 ZINC000269027662 1029070158 /nfs/dbraw/zinc/07/01/58/1029070158.db2.gz QXRYASWIBPZQOF-MRXNPFEDSA-N 0 3 330.384 3.853 20 5 EHBDHN O=[N+]([O-])c1cnc(NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)s1 ZINC000192453159 1029667029 /nfs/dbraw/zinc/66/70/29/1029667029.db2.gz KPBKPPYFHVCSFN-GOOCMWNKSA-N 0 3 344.440 3.659 20 5 EHBDHN CCc1oc2ccccc2c1CN(C)CCn1c(C)ncc1[N+](=O)[O-] ZINC000611766586 1029729687 /nfs/dbraw/zinc/72/96/87/1029729687.db2.gz JGJVAOFIXMLOBB-UHFFFAOYSA-N 0 3 342.399 3.540 20 5 EHBDHN CC[C@@H](C)N[C@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000343272911 1030038246 /nfs/dbraw/zinc/03/82/46/1030038246.db2.gz VXJHWFBFDQRZTJ-ZWNOBZJWSA-N 0 3 338.795 3.778 20 5 EHBDHN C[C@@H](CC(C)(C)O)N[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453325780 1030109307 /nfs/dbraw/zinc/10/93/07/1030109307.db2.gz RQJFXFMWAADXJG-KBXCAEBGSA-N 0 3 328.412 3.823 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@H](Cc2nccs2)C1 ZINC000898071952 1033325190 /nfs/dbraw/zinc/32/51/90/1033325190.db2.gz VNRSXUGSAJGJDY-LYKUJDHUSA-N 0 3 329.425 3.629 20 5 EHBDHN C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2[nH]c(=O)[nH]c2c1 ZINC000594494519 1033396202 /nfs/dbraw/zinc/39/62/02/1033396202.db2.gz CAMYCALXMKLKBS-HZMBPMFUSA-N 0 3 338.367 3.515 20 5 EHBDHN Cc1nn(CN(C)C[C@@H](C)c2ccccc2)c2cc([N+](=O)[O-])ccc12 ZINC000761291553 1033549634 /nfs/dbraw/zinc/54/96/34/1033549634.db2.gz UTPPTUHRNUMZQV-CQSZACIVSA-N 0 3 338.411 3.946 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]23)c(F)c1 ZINC000598986701 1033611971 /nfs/dbraw/zinc/61/19/71/1033611971.db2.gz LGUGKOLKKOXONM-USXIJHARSA-N 0 3 332.762 3.815 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](c1ccccc1)N(C)C ZINC000595003160 1033628599 /nfs/dbraw/zinc/62/85/99/1033628599.db2.gz FKWJXWFHEUCCAW-KBXCAEBGSA-N 0 3 343.427 3.557 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CO[C@H](C3CC3)C2)o1 ZINC000599006854 1033642454 /nfs/dbraw/zinc/64/24/54/1033642454.db2.gz LNXHIIRFKQMHOX-ACJLOTCBSA-N 0 3 328.368 3.512 20 5 EHBDHN C[C@@H](N[C@@H](C)COc1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000595072775 1033646125 /nfs/dbraw/zinc/64/61/25/1033646125.db2.gz QOPVEJWVYZVXLI-NWDGAFQWSA-N 0 3 336.338 3.991 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1[C@@H]2CC[C@H]1CC(C)C2 ZINC000595856398 1034010160 /nfs/dbraw/zinc/01/01/60/1034010160.db2.gz BWGNLJJOSXVNAC-AHBJDQSVSA-N 0 3 342.399 3.969 20 5 EHBDHN C[C@H](NC(=O)[C@@H]1CCCCN1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413040 1034298619 /nfs/dbraw/zinc/29/86/19/1034298619.db2.gz SKMDWINSCADWGZ-KSSFIOAISA-N 0 3 345.443 3.569 20 5 EHBDHN CCOc1cc(CN2CCC[C@@H](c3ccncc3)C2)ccc1[N+](=O)[O-] ZINC000451007156 1035024764 /nfs/dbraw/zinc/02/47/64/1035024764.db2.gz SQDBNSHQAHRVLN-QGZVFWFLSA-N 0 3 341.411 3.768 20 5 EHBDHN Cn1cc(CN2CC(C)(C)[C@@H]2C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000580655304 1035446501 /nfs/dbraw/zinc/44/65/01/1035446501.db2.gz FFNWWEVGUCISAO-SFHVURJKSA-N 0 3 340.427 3.616 20 5 EHBDHN CC(C)[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000045471145 1036448331 /nfs/dbraw/zinc/44/83/31/1036448331.db2.gz VFKTYRODIHMAEF-GOSISDBHSA-N 0 3 345.374 3.659 20 5 EHBDHN CC(C)[C@H](O)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000493050285 1036580150 /nfs/dbraw/zinc/58/01/50/1036580150.db2.gz BKIQFWBDZJERCU-MOPGFXCFSA-N 0 3 328.412 3.681 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc(-n2cncn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000152782579 1036723225 /nfs/dbraw/zinc/72/32/25/1036723225.db2.gz GLRDWIAFUSYIBO-UONOGXRCSA-N 0 3 337.383 3.587 20 5 EHBDHN Cc1c(CN[C@@H](C)c2cccc(-n3ccnc3)c2)cccc1[N+](=O)[O-] ZINC000180645838 1037036038 /nfs/dbraw/zinc/03/60/38/1037036038.db2.gz HHVWGSZXOVECPZ-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCc1nc(C)c(C)s1 ZINC000595021078 1037153707 /nfs/dbraw/zinc/15/37/07/1037153707.db2.gz OYIZFEOHHHSZIC-NSHDSACASA-N 0 3 335.429 3.570 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1CCC2(CCCC2)O1 ZINC000595046633 1037215826 /nfs/dbraw/zinc/21/58/26/1037215826.db2.gz LWBSDNQSYONQCE-DZGCQCFKSA-N 0 3 334.416 3.746 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@H](C2CCC2)C1 ZINC000591061790 1037223708 /nfs/dbraw/zinc/22/37/08/1037223708.db2.gz IJRZIFUAFMCBLT-WFASDCNBSA-N 0 3 342.399 3.828 20 5 EHBDHN CC1(C)C[C@@H](NCc2ccc(CO)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000592392986 1037934953 /nfs/dbraw/zinc/93/49/53/1037934953.db2.gz NVUALNBZLNFSMQ-GOSISDBHSA-N 0 3 326.396 3.599 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CN[C@@H]3CC[C@@H]4C[C@@H]4C3)cs2)c1 ZINC000592378781 1037948378 /nfs/dbraw/zinc/94/83/78/1037948378.db2.gz CVHLWTFQYWLXRQ-MRVWCRGKSA-N 0 3 329.425 3.997 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)Cc1ccc2c(c1)OCO2 ZINC000470171217 1038408914 /nfs/dbraw/zinc/40/89/14/1038408914.db2.gz GXTDTUNWXKRLPH-ZSOIEALJSA-N 0 3 340.379 3.859 20 5 EHBDHN COc1ccc([C@H]2C[C@H](NCc3csc([N+](=O)[O-])c3)C2)cc1F ZINC000500514750 1038902489 /nfs/dbraw/zinc/90/24/89/1038902489.db2.gz QCPLXFSOZHPWAT-JOCQHMNTSA-N 0 3 336.388 3.840 20 5 EHBDHN CCN(CC)[C@@H](CNc1ccc([N+](=O)[O-])cc1COC)c1ccco1 ZINC000175059899 1039150410 /nfs/dbraw/zinc/15/04/10/1039150410.db2.gz LAPLKDMOGFFIFM-KRWDZBQOSA-N 0 3 347.415 3.829 20 5 EHBDHN COc1cc(CN(C)CCCOc2ccccc2)ccc1[N+](=O)[O-] ZINC000485819673 1039599008 /nfs/dbraw/zinc/59/90/08/1039599008.db2.gz VLQFTRDWXCWGJG-UHFFFAOYSA-N 0 3 330.384 3.504 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ccc3c(c1)OCO3)CCCC2 ZINC000417295750 1039648663 /nfs/dbraw/zinc/64/86/63/1039648663.db2.gz FOGRARFEYWWHPF-KRWDZBQOSA-N 0 3 340.379 3.881 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CCC(c2ccsc2)CC1 ZINC000485912033 1039685087 /nfs/dbraw/zinc/68/50/87/1039685087.db2.gz GMKSXRVFEKLEAY-UHFFFAOYSA-N 0 3 332.425 3.915 20 5 EHBDHN COC(=O)C(C)(C)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000512541594 1039689645 /nfs/dbraw/zinc/68/96/45/1039689645.db2.gz GHVYPYCGYZKUAL-UHFFFAOYSA-N 0 3 346.383 3.534 20 5 EHBDHN CCC[C@@H](C)[C@@H]1CCCN1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787131 1040444222 /nfs/dbraw/zinc/44/42/22/1040444222.db2.gz HEDIZDDHMCMDDG-PBHICJAKSA-N 0 3 333.432 3.742 20 5 EHBDHN CCC[C@H](C)[C@H]1CCCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804450 1040472474 /nfs/dbraw/zinc/47/24/74/1040472474.db2.gz YQTBZWDQIKKDOP-SUMWQHHRSA-N 0 3 333.432 3.742 20 5 EHBDHN Cn1cc(CN2CCCC3(CC3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000600216440 1040860345 /nfs/dbraw/zinc/86/03/45/1040860345.db2.gz ZVZNQGYPISRPSF-UHFFFAOYSA-N 0 3 340.427 3.761 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](N[C@H]2CCN(C3CC3)C2)c2ccccc2)c1 ZINC000491022886 1040868364 /nfs/dbraw/zinc/86/83/64/1040868364.db2.gz QDAMCVZUECETNM-FXAWDEMLSA-N 0 3 337.423 3.511 20 5 EHBDHN C[C@@H](CN(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000066854518 1041236407 /nfs/dbraw/zinc/23/64/07/1041236407.db2.gz QCVNWMDOXGJSKO-AWEZNQCLSA-N 0 3 342.395 3.697 20 5 EHBDHN CC(C)c1ccc(CN2CC[C@@H](Cc3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000093870289 1042567373 /nfs/dbraw/zinc/56/73/73/1042567373.db2.gz MSMMPSGWHNIFKM-INIZCTEOSA-N 0 3 342.443 3.516 20 5 EHBDHN CC(C)(C)[C@@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000344212991 1043438433 /nfs/dbraw/zinc/43/84/33/1043438433.db2.gz NZXDTOSLAFSCEE-CYBMUJFWSA-N 0 3 330.388 3.513 20 5 EHBDHN C[C@H]1CCC[C@H](N(C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898519 1043598039 /nfs/dbraw/zinc/59/80/39/1043598039.db2.gz YMKUBPLKMLTKQD-KSSFIOAISA-N 0 3 328.416 3.926 20 5 EHBDHN CC[C@H](CSC)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000182134407 1044100559 /nfs/dbraw/zinc/10/05/59/1044100559.db2.gz FWVKBRDBECUJPB-GFCCVEGCSA-N 0 3 337.470 3.950 20 5 EHBDHN C[C@@H](NC[C@H](O)c1cc(F)cc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000279542803 1044207458 /nfs/dbraw/zinc/20/74/58/1044207458.db2.gz QGJDBLKZLRGOQZ-HWPZZCPQSA-N 0 3 338.766 3.772 20 5 EHBDHN Cc1cccc([C@@H](C)NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000183725327 1125746838 /nfs/dbraw/zinc/74/68/38/1125746838.db2.gz TUPXOORHSIBRGD-OAHLLOKOSA-N 0 3 341.411 3.525 20 5 EHBDHN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(CN(C)C)c1 ZINC000072839881 1126901425 /nfs/dbraw/zinc/90/14/25/1126901425.db2.gz KBPDQOMASJWPHB-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000090879384 1127082086 /nfs/dbraw/zinc/08/20/86/1127082086.db2.gz MQYGOFPBLUKSJB-UONOGXRCSA-N 0 3 337.383 3.587 20 5 EHBDHN CCS[C@@H]1CCCCN(Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765009862 1127564775 /nfs/dbraw/zinc/56/47/75/1127564775.db2.gz FCWOHAVZQLIJAZ-OAHLLOKOSA-N 0 3 348.472 3.818 20 5 EHBDHN Cc1cc(C2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n[nH]1 ZINC000273031456 1128433692 /nfs/dbraw/zinc/43/36/92/1128433692.db2.gz ULUQQYMTPBQBEA-AWEZNQCLSA-N 0 3 328.416 3.875 20 5 EHBDHN COc1cc(NC[C@H](c2cccs2)N(C)C)c([N+](=O)[O-])cc1F ZINC000301623143 1128764046 /nfs/dbraw/zinc/76/40/46/1128764046.db2.gz OMXJVYJYVSEULO-CYBMUJFWSA-N 0 3 339.392 3.519 20 5 EHBDHN O=[N+]([O-])c1ccc(N[C@@H](CN2CCCC2)c2ccccc2)c(F)c1 ZINC000301081369 1121474245 /nfs/dbraw/zinc/47/42/45/1121474245.db2.gz KOLIMSBQRCMSIH-SFHVURJKSA-N 0 3 329.375 3.983 20 5 EHBDHN CSC1(CNCc2cc([N+](=O)[O-])ccc2OC(F)F)CCC1 ZINC000193652502 1121533026 /nfs/dbraw/zinc/53/30/26/1121533026.db2.gz XTPCLLLKEMUTIT-UHFFFAOYSA-N 0 3 332.372 3.572 20 5 EHBDHN COC1(C)CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000272379043 1121597767 /nfs/dbraw/zinc/59/77/67/1121597767.db2.gz QYXVMFIBXBZXEJ-UHFFFAOYSA-N 0 3 330.384 3.856 20 5 EHBDHN COc1ccc(-c2ccc(CN(C)[C@H]3CCSC3)o2)c([N+](=O)[O-])c1 ZINC000130566356 1122777645 /nfs/dbraw/zinc/77/76/45/1122777645.db2.gz FAARRBCIBVTZCQ-LBPRGKRZSA-N 0 3 348.424 3.801 20 5 EHBDHN COc1nc(C)cc(C)c1CNC/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000615720660 1123863646 /nfs/dbraw/zinc/86/36/46/1123863646.db2.gz HTPPVWNAEIPWBT-JYRVWZFOSA-N 0 3 341.411 3.808 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCc2ccc(F)c(F)c2F)c(Cl)c1 ZINC000543412328 1129470445 /nfs/dbraw/zinc/47/04/45/1129470445.db2.gz JTCZTBKBUTXAGQ-UHFFFAOYSA-N 0 3 344.720 3.998 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CN3C[C@@H]4CCC[C@@H]4C3)cs2)c1 ZINC000093442935 1129588464 /nfs/dbraw/zinc/58/84/64/1129588464.db2.gz XLQLIOQXVGIDJG-OKILXGFUSA-N 0 3 329.425 3.950 20 5 EHBDHN Cc1cc(NC[C@H](C)CC2(C)OCCO2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302211972 1129773405 /nfs/dbraw/zinc/77/34/05/1129773405.db2.gz YWXVHLAKKUOTPN-GFCCVEGCSA-N 0 3 345.399 3.653 20 5 EHBDHN Cc1n[nH]cc1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000171384363 1130049988 /nfs/dbraw/zinc/04/99/88/1130049988.db2.gz POOCJVMUHVYXKF-UHFFFAOYSA-N 0 3 328.397 3.645 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000245515291 1130228561 /nfs/dbraw/zinc/22/85/61/1130228561.db2.gz DJQBSAGIKSFGQZ-VKJFTORMSA-N 0 3 328.416 3.744 20 5 EHBDHN CCN(CC)[C@H](CNc1ccc([N+](=O)[O-])c(OC)c1)c1ccco1 ZINC000174704872 1130378479 /nfs/dbraw/zinc/37/84/79/1130378479.db2.gz ZOPRYEDBJLFYGY-OAHLLOKOSA-N 0 3 333.388 3.691 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H](CO)CC2CCCC2)o1 ZINC000509447825 1130649597 /nfs/dbraw/zinc/64/95/97/1130649597.db2.gz LGZREPFBIWEQNQ-HNNXBMFYSA-N 0 3 344.411 3.886 20 5 EHBDHN NCc1c(F)cccc1N[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172897912 1131881817 /nfs/dbraw/zinc/88/18/17/1131881817.db2.gz DFYZSIBZAYIZAD-CQSZACIVSA-N 0 3 329.375 3.552 20 5 EHBDHN CCC[C@H]1[C@H](C)CCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743380842 1131907263 /nfs/dbraw/zinc/90/72/63/1131907263.db2.gz SZYDYGVHTNKFKH-PBHICJAKSA-N 0 3 343.431 3.711 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1C[C@@H](CF)[C@H](C(F)(F)F)C1 ZINC001173223966 1132005988 /nfs/dbraw/zinc/00/59/88/1132005988.db2.gz CKWYELAXGZOPQT-MPKXVKKWSA-N 0 3 334.313 3.606 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NC(C)(C)C(=O)c1ccccc1 ZINC001173212345 1132013607 /nfs/dbraw/zinc/01/36/07/1132013607.db2.gz ZVDVDSVLUFCATB-AWEZNQCLSA-N 0 3 326.396 3.777 20 5 EHBDHN Cc1ccn2cc(CN(C)[C@@H](C)Cc3ccc([N+](=O)[O-])cc3)nc2c1 ZINC001173237750 1132026460 /nfs/dbraw/zinc/02/64/60/1132026460.db2.gz LYSXLJIXSRAALN-HNNXBMFYSA-N 0 3 338.411 3.614 20 5 EHBDHN COc1ccccc1OCCN(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000509394499 1132486922 /nfs/dbraw/zinc/48/69/22/1132486922.db2.gz XZWVTWRHAXYBKN-VQHVLOKHSA-N 0 3 342.395 3.627 20 5 EHBDHN C[C@@H](c1ccccc1)[C@@H](CO)NCc1ccc([N+](=O)[O-])cc1Cl ZINC001168991824 1132626263 /nfs/dbraw/zinc/62/62/63/1132626263.db2.gz CERNDIOBGIMJKF-YVEFUNNKSA-N 0 3 334.803 3.502 20 5 EHBDHN CCc1ccccc1-c1nc(CN[C@@H]2CC[C@H](C[N+](=O)[O-])C2)cs1 ZINC001169006392 1132630257 /nfs/dbraw/zinc/63/02/57/1132630257.db2.gz HPBKZQHOBZSZBO-DZGCQCFKSA-N 0 3 345.468 3.908 20 5 EHBDHN C[C@H]1[C@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907259 1134116263 /nfs/dbraw/zinc/11/62/63/1134116263.db2.gz GHVBJHIXGZQUFS-SUMWQHHRSA-N 0 3 341.367 3.881 20 5 EHBDHN CC[C@@H]1CN(CC)CCN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001194325121 1135257331 /nfs/dbraw/zinc/25/73/31/1135257331.db2.gz QCTLGZVJTYAVNA-CYBMUJFWSA-N 0 3 345.365 3.530 20 5 EHBDHN CC[C@H](c1ccccc1OC)N(C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834343 1135333037 /nfs/dbraw/zinc/33/30/37/1135333037.db2.gz FWOAMEDKWYVDSD-QZTJIDSGSA-N 0 3 344.411 3.720 20 5 EHBDHN Cc1ccc(CN(Cc2ccccc2)CC(C)(C)O)cc1[N+](=O)[O-] ZINC000775766389 1135669204 /nfs/dbraw/zinc/66/92/04/1135669204.db2.gz XKJRSMYNTVVOIR-UHFFFAOYSA-N 0 3 328.412 3.676 20 5 EHBDHN C[C@H](c1ccc(F)c(F)c1)N(C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274365 1136130207 /nfs/dbraw/zinc/13/02/07/1136130207.db2.gz HFTLOTDYQPDFFQ-DIFFPNOSSA-N 0 3 336.338 3.599 20 5 EHBDHN CC(C)(NC[C@H]1CCC[C@@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC001170650853 1136162087 /nfs/dbraw/zinc/16/20/87/1136162087.db2.gz QGPDLTATISZBJF-RISCZKNCSA-N 0 3 346.349 3.920 20 5 EHBDHN C[C@H](NCc1ccc(O[C@@H]2CCOC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000850312276 1136234112 /nfs/dbraw/zinc/23/41/12/1136234112.db2.gz GTRFHDNWSGEFDH-IFXJQAMLSA-N 0 3 342.395 3.613 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](Cn1ccnc1)C(C)(C)C ZINC000850424808 1136256546 /nfs/dbraw/zinc/25/65/46/1136256546.db2.gz HMQWRFRQCMUZLW-SUMWQHHRSA-N 0 3 346.431 3.565 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](O)c1cc(C)cc(C)c1 ZINC000850467732 1136265088 /nfs/dbraw/zinc/26/50/88/1136265088.db2.gz SDVRDHLYEJMZIW-KSSFIOAISA-N 0 3 344.411 3.604 20 5 EHBDHN CC(COC(=O)[C@@H](Sc1ccccc1F)c1ccccc1)[N+](=O)[O-] ZINC000813103250 1136288180 /nfs/dbraw/zinc/28/81/80/1136288180.db2.gz ZIGHQLPDWRCTBJ-LRDDRELGSA-N 0 3 349.383 3.868 20 5 EHBDHN CC(COC(=O)c1ccc(-c2nc3ccccc3s2)s1)[N+](=O)[O-] ZINC000813109382 1136294229 /nfs/dbraw/zinc/29/42/29/1136294229.db2.gz RNKJNJHRDWQHJK-VIFPVBQESA-N 0 3 348.405 3.847 20 5 EHBDHN O=[N+]([O-])c1ccc2c(cnn2CN2CCC[C@H](c3ccccc3)C2)c1 ZINC000814226410 1136425292 /nfs/dbraw/zinc/42/52/92/1136425292.db2.gz WNGPKDSMEKMOQO-INIZCTEOSA-N 0 3 336.395 3.782 20 5 EHBDHN C[C@@H](N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc2c(c1)CCCO2 ZINC000853240417 1136521554 /nfs/dbraw/zinc/52/15/54/1136521554.db2.gz GZWASNNHGHUPCA-CHWSQXEVSA-N 0 3 341.411 3.914 20 5 EHBDHN Cc1nc2c(s1)[C@@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815614993 1136618860 /nfs/dbraw/zinc/61/88/60/1136618860.db2.gz FZLIGKXWBWCEJI-ZANVPECISA-N 0 3 332.429 3.670 20 5 EHBDHN CC(C)C[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000776948692 1136883692 /nfs/dbraw/zinc/88/36/92/1136883692.db2.gz GMRINRDAIPFDSG-ZFWWWQNUSA-N 0 3 326.824 3.932 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CNC2(c3ccccc3Cl)CCC2)c1 ZINC000844351886 1137214409 /nfs/dbraw/zinc/21/44/09/1137214409.db2.gz SPYWBAUOKPDGPD-QGZVFWFLSA-N 0 3 346.814 3.951 20 5 EHBDHN Cc1ccccc1CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845872619 1137315985 /nfs/dbraw/zinc/31/59/85/1137315985.db2.gz KLLVTXJLGLUCCA-UGSOOPFHSA-N 0 3 331.343 3.626 20 5 EHBDHN CCO[C@H](CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-])C(C)C ZINC000845876763 1137316465 /nfs/dbraw/zinc/31/64/65/1137316465.db2.gz OMFDNKPORGDDRH-XGWLTEMNSA-N 0 3 341.379 3.526 20 5 EHBDHN C[C@H](N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872057564 1137568618 /nfs/dbraw/zinc/56/86/18/1137568618.db2.gz GBQFDZKXLMIHHJ-IYVPYFHTSA-N 0 3 334.391 3.732 20 5 EHBDHN C[C@H](CC(=O)Nc1ccccc1)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872130752 1137573096 /nfs/dbraw/zinc/57/30/96/1137573096.db2.gz QLOMZECIFYVOHZ-ZIAGYGMSSA-N 0 3 327.384 3.663 20 5 EHBDHN C[C@@H](N[C@@H](C)CC(=O)Nc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000872131255 1137573299 /nfs/dbraw/zinc/57/32/99/1137573299.db2.gz YXPGREOAGBOLEB-QWHCGFSZSA-N 0 3 345.374 3.802 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNCCC[C@@H]3CC3(Cl)Cl)nc2c1 ZINC000877614834 1137683040 /nfs/dbraw/zinc/68/30/40/1137683040.db2.gz NHAHAGDUTMPTDD-SECBINFHSA-N 0 3 344.198 3.800 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCC2(CCOCC2)O1 ZINC000877993107 1137698840 /nfs/dbraw/zinc/69/88/40/1137698840.db2.gz XHLRZJCXRLBHBI-GOSISDBHSA-N 0 3 348.443 3.533 20 5 EHBDHN C[C@@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCC1 ZINC000878348053 1137711932 /nfs/dbraw/zinc/71/19/32/1137711932.db2.gz CLPABRHPCWBNFA-GFCCVEGCSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1sc(C(=O)Nc2ccc(C)cc2CN(C)C)cc1[N+](=O)[O-] ZINC000113912080 1137915413 /nfs/dbraw/zinc/91/54/13/1137915413.db2.gz ZUASKIQBASQWQK-UHFFFAOYSA-N 0 3 333.413 3.587 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@H](c2ncccn2)C1 ZINC000886685947 1138115134 /nfs/dbraw/zinc/11/51/34/1138115134.db2.gz HGJWUBWRTKQUAU-CABCVRRESA-N 0 3 326.400 3.634 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CNC1(c2cccc(F)c2)CCOCC1 ZINC000183493490 1140042686 /nfs/dbraw/zinc/04/26/86/1140042686.db2.gz XNPGVJJPZVQKRE-UHFFFAOYSA-N 0 3 344.386 3.838 20 5 EHBDHN Cc1c(CN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000192120628 1140504342 /nfs/dbraw/zinc/50/43/42/1140504342.db2.gz GCZYCLLWXAZZHM-SJLPKXTDSA-N 0 3 348.349 3.801 20 5 EHBDHN COc1ccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000192592562 1140539608 /nfs/dbraw/zinc/53/96/08/1140539608.db2.gz KMJXAOROBILUAP-QGZVFWFLSA-N 0 3 342.395 3.779 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000267441947 1140791820 /nfs/dbraw/zinc/79/18/20/1140791820.db2.gz IDZVVRPXWQOADD-ZBFHGGJFSA-N 0 3 332.425 3.744 20 5 EHBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CCCc2c[nH]nc21 ZINC000271558782 1141397649 /nfs/dbraw/zinc/39/76/49/1141397649.db2.gz WIBDAPHEKCVWEI-UONOGXRCSA-N 0 3 346.456 3.856 20 5 EHBDHN O=C(NCCN1CCCCC1)c1cc2ccccc2c2cccnc12 ZINC000044530078 1014159890 /nfs/dbraw/zinc/15/98/90/1014159890.db2.gz BEECVUGQABUQED-UHFFFAOYSA-N 0 3 333.435 3.604 20 5 EHBDHN CCOC(=O)C(C)(C)C1CCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000510077042 1014724232 /nfs/dbraw/zinc/72/42/32/1014724232.db2.gz AHTPXUJEWZKSAK-CQSZACIVSA-N 0 3 348.443 3.957 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H](CC2CC2)C1 ZINC000339670821 1015491900 /nfs/dbraw/zinc/49/19/00/1015491900.db2.gz FUFRMWBBMHGYDF-OCCSQVGLSA-N 0 3 342.399 3.828 20 5 EHBDHN C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cn[nH]c1 ZINC000339791005 1015675721 /nfs/dbraw/zinc/67/57/21/1015675721.db2.gz FXBMHRQAXRQKDB-LLVKDONJSA-N 0 3 328.397 3.897 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@H]2Cn2cnc3ccccc32)c1 ZINC000339908754 1015881667 /nfs/dbraw/zinc/88/16/67/1015881667.db2.gz FLVVAGQVUXXFCJ-KRWDZBQOSA-N 0 3 336.395 3.609 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2noc([C@@H]3CCCN3C3CCCC3)n2)c1 ZINC000275420252 1016733315 /nfs/dbraw/zinc/73/33/15/1016733315.db2.gz HHCPFBBMBUCEME-HNNXBMFYSA-N 0 3 328.372 3.724 20 5 EHBDHN CC(C)[C@H]1N(C/C=C/c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414527942 1016953433 /nfs/dbraw/zinc/95/34/33/1016953433.db2.gz NJYBVTZHILJHEM-SUQGKYDKSA-N 0 3 330.428 3.745 20 5 EHBDHN C[C@@H](CCCc1cccnc1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000459633759 1032351816 /nfs/dbraw/zinc/35/18/16/1032351816.db2.gz FBGRFDCVXCGNRY-ZDUSSCGKSA-N 0 3 340.383 3.632 20 5 EHBDHN C[C@@H](CC(=O)Nc1ccc(F)cc1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449347813 1032464352 /nfs/dbraw/zinc/46/43/52/1032464352.db2.gz JEMLJERUFPXPMY-STQMWFEESA-N 0 3 345.374 3.802 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@@H]3CCOC3(C)C)o2)c([N+](=O)[O-])c1 ZINC000449416769 1032521153 /nfs/dbraw/zinc/52/11/53/1032521153.db2.gz VFOZAFLMBRHECE-QGZVFWFLSA-N 0 3 346.383 3.521 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@H]3CCOC3(C)C)o2)c([N+](=O)[O-])c1 ZINC000449416768 1032520330 /nfs/dbraw/zinc/52/03/30/1032520330.db2.gz VFOZAFLMBRHECE-KRWDZBQOSA-N 0 3 346.383 3.521 20 5 EHBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1cccc(C(F)(F)F)n1 ZINC000449402006 1032525558 /nfs/dbraw/zinc/52/55/58/1032525558.db2.gz OZVJWNKRITYFAH-NSHDSACASA-N 0 3 339.317 3.729 20 5 EHBDHN C[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2n1 ZINC000089580713 1017246640 /nfs/dbraw/zinc/24/66/40/1017246640.db2.gz LNIAFKACTCRCLK-CQSZACIVSA-N 0 3 337.379 3.873 20 5 EHBDHN Cc1ccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000136138247 1017264717 /nfs/dbraw/zinc/26/47/17/1017264717.db2.gz QIXMDUJCPJFPTE-MRXNPFEDSA-N 0 3 338.766 3.519 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548010020 1018198271 /nfs/dbraw/zinc/19/82/71/1018198271.db2.gz BSXIIFICMOXOGP-PBHICJAKSA-N 0 3 340.427 3.678 20 5 EHBDHN CC(C)c1ccc(CN2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000449551000 1032772707 /nfs/dbraw/zinc/77/27/07/1032772707.db2.gz FEIPREZFTDINMT-ZACQAIPSSA-N 0 3 332.444 3.701 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1ccccc1Cn1cccn1 ZINC000581141734 1020471824 /nfs/dbraw/zinc/47/18/24/1020471824.db2.gz BBPPKVXKXWXBFH-LJQANCHMSA-N 0 3 348.406 3.617 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](n2ncc3ccccc32)C1 ZINC000510436044 1021147884 /nfs/dbraw/zinc/14/78/84/1021147884.db2.gz YAQLVGKIUURGKP-HOCLYGCPSA-N 0 3 336.395 3.953 20 5 EHBDHN O=[N+]([O-])c1cccc(Cl)c1CN1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000322943095 1021475791 /nfs/dbraw/zinc/47/57/91/1021475791.db2.gz MUOVGBZQCTTXOG-MJEQTWJJSA-N 0 3 338.835 3.764 20 5 EHBDHN COc1ccc2c(c1)[C@@H](NC/C=C/c1ccccc1[N+](=O)[O-])CCO2 ZINC000341562069 1022344154 /nfs/dbraw/zinc/34/41/54/1022344154.db2.gz SEEODPMZTORROK-YXMMZVCTSA-N 0 3 340.379 3.730 20 5 EHBDHN C[C@@H]1C[C@H](C)CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000127388249 1023147813 /nfs/dbraw/zinc/14/78/13/1023147813.db2.gz ZFYSHGAABDHQLO-CHWSQXEVSA-N 0 3 330.388 3.513 20 5 EHBDHN CCO[C@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000610930479 1023877398 /nfs/dbraw/zinc/87/73/98/1023877398.db2.gz ROADPMCUZVXJHZ-AWEZNQCLSA-N 0 3 330.384 3.856 20 5 EHBDHN CCC(CC)CN(CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000514124544 1024154657 /nfs/dbraw/zinc/15/46/57/1024154657.db2.gz JYNLZRGXGCOEEC-UHFFFAOYSA-N 0 3 341.839 3.945 20 5 EHBDHN C[C@@H]1CCC[C@@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]1C ZINC000248544655 1024298460 /nfs/dbraw/zinc/29/84/60/1024298460.db2.gz DSWMIKYBYNOFEG-TYNCELHUSA-N 0 3 330.388 3.559 20 5 EHBDHN CC1CCN([C@H](CNc2ccc([N+](=O)[O-])cn2)c2cccs2)CC1 ZINC000025371284 1024733611 /nfs/dbraw/zinc/73/36/11/1024733611.db2.gz ZIQIOGHQRZKYGZ-OAHLLOKOSA-N 0 3 346.456 3.936 20 5 EHBDHN Cc1cnc(CCN(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)s1 ZINC000157524976 1024940460 /nfs/dbraw/zinc/94/04/60/1024940460.db2.gz POYKHBJNJZSODL-UHFFFAOYSA-N 0 3 325.821 3.688 20 5 EHBDHN CC[C@H](O)CN(Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1C ZINC000544612149 1025830477 /nfs/dbraw/zinc/83/04/77/1025830477.db2.gz SOUZJQWYMFHWTP-IBGZPJMESA-N 0 3 328.412 3.676 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451412183 1025946222 /nfs/dbraw/zinc/94/62/22/1025946222.db2.gz FWFSNZZCDLBFFL-KSZLIROESA-N 0 3 348.443 3.507 20 5 EHBDHN Cc1cnc([C@H](C)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553129 1026103674 /nfs/dbraw/zinc/10/36/74/1026103674.db2.gz XKWYEGNAIJXXGW-HOCLYGCPSA-N 0 3 326.400 3.634 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(CCCOCC(F)(F)F)C2CC2)cc1 ZINC000130043644 1026141878 /nfs/dbraw/zinc/14/18/78/1026141878.db2.gz WIFCCBIBZWKFRP-UHFFFAOYSA-N 0 3 332.322 3.528 20 5 EHBDHN Cc1ccn(-c2ccccc2CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000127667734 1026278675 /nfs/dbraw/zinc/27/86/75/1026278675.db2.gz NQIPIHDFIPLOFR-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN CO[C@@]1(C)CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000475274985 1026425818 /nfs/dbraw/zinc/42/58/18/1026425818.db2.gz KPRFQBBYSYBIIB-SFHVURJKSA-N 0 3 330.384 3.856 20 5 EHBDHN CC(C)C[C@]1(CO)CCCN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000475375799 1026541983 /nfs/dbraw/zinc/54/19/83/1026541983.db2.gz UYKRTHWMFDLMEE-INIZCTEOSA-N 0 3 326.824 3.621 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000531148226 1026633991 /nfs/dbraw/zinc/63/39/91/1026633991.db2.gz RYOIZHQJSOMKOP-INIZCTEOSA-N 0 3 347.440 3.914 20 5 EHBDHN CCS[C@@H]1CCCC[C@@H]1NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444685662 1028131029 /nfs/dbraw/zinc/13/10/29/1028131029.db2.gz PAIQAFHEMYBTQK-DZGCQCFKSA-N 0 3 334.445 3.625 20 5 EHBDHN COc1cc(CN(C)CC2(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000444683477 1028154867 /nfs/dbraw/zinc/15/48/67/1028154867.db2.gz HFIIYAUYXKWSSO-UHFFFAOYSA-N 0 3 326.396 3.767 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@H]3CC[C@H](C)O3)o2)c([N+](=O)[O-])c1 ZINC000453631582 1030433205 /nfs/dbraw/zinc/43/32/05/1030433205.db2.gz OAMWBRBKAKUCFQ-GXTWGEPZSA-N 0 3 346.383 3.521 20 5 EHBDHN Cn1cc(CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])c(-c2ccccc2)n1 ZINC000594500560 1033402204 /nfs/dbraw/zinc/40/22/04/1033402204.db2.gz OXXNOEHMTCGJIZ-GOSISDBHSA-N 0 3 348.406 3.772 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CN3CCC(C4(O)CC4)CC3)o2)c1 ZINC000593647634 1033609359 /nfs/dbraw/zinc/60/93/59/1033609359.db2.gz FEQFSRORDJNZSM-UHFFFAOYSA-N 0 3 342.395 3.592 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H](Cc1ccccc1)OC ZINC000595043246 1033663773 /nfs/dbraw/zinc/66/37/73/1033663773.db2.gz VNZOECWUPMQWSG-RHSMWYFYSA-N 0 3 344.411 3.512 20 5 EHBDHN COc1cccc([C@@H](CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)OC)c1 ZINC000599061968 1033701545 /nfs/dbraw/zinc/70/15/45/1033701545.db2.gz MXIKLEZSXSQVJS-AUUYWEPGSA-N 0 3 344.411 3.950 20 5 EHBDHN COc1ccc([C@@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000599093025 1033730477 /nfs/dbraw/zinc/73/04/77/1033730477.db2.gz MEDBTRPCEIIGQC-SGTLLEGYSA-N 0 3 327.384 3.800 20 5 EHBDHN CCOc1cc(CN2CCC[C@H]([C@@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787963 1033999903 /nfs/dbraw/zinc/99/99/03/1033999903.db2.gz LAZXWPQISLFDEP-WMZOPIPTSA-N 0 3 348.443 3.775 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2noc(CN(CCC3CC3)CC3CC3)n2)c1 ZINC000595871037 1034031255 /nfs/dbraw/zinc/03/12/55/1034031255.db2.gz KBRPBSBSOZJFIX-UHFFFAOYSA-N 0 3 342.399 3.657 20 5 EHBDHN Cc1noc(CS[C@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596020526 1034058638 /nfs/dbraw/zinc/05/86/38/1034058638.db2.gz LFBZDOVVEUTLMM-HNNXBMFYSA-N 0 3 347.440 3.789 20 5 EHBDHN CCOc1ccccc1[C@H](CC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000179742867 1034599268 /nfs/dbraw/zinc/59/92/68/1034599268.db2.gz GZICGVKRLXCMSS-ZWKOTPCHSA-N 0 3 344.411 3.768 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC(c2ccon2)CC1 ZINC000597227950 1034608949 /nfs/dbraw/zinc/60/89/49/1034608949.db2.gz JIQWHHZGVMZKTG-SDNWHVSQSA-N 0 3 327.384 3.866 20 5 EHBDHN CCC[C@](C)(O)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492223241 1035510784 /nfs/dbraw/zinc/51/07/84/1035510784.db2.gz KJPKBMVZVVPMOW-OALUTQOASA-N 0 3 328.412 3.825 20 5 EHBDHN Cc1c([C@@H](C)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000164535518 1035655150 /nfs/dbraw/zinc/65/51/50/1035655150.db2.gz IDXIPSDFYFZKEP-ZIAGYGMSSA-N 0 3 349.431 3.563 20 5 EHBDHN COc1ccc(OCCN(C)[C@@H](C)c2cccs2)c([N+](=O)[O-])c1 ZINC000173539066 1035669524 /nfs/dbraw/zinc/66/95/24/1035669524.db2.gz UYEOZADGXIKQGN-LBPRGKRZSA-N 0 3 336.413 3.737 20 5 EHBDHN O=[N+]([O-])c1cccc(CNC2(C3CCC3)CC2)c1Br ZINC000697384626 1036046435 /nfs/dbraw/zinc/04/64/35/1036046435.db2.gz JGRNSTCRQJJQBD-UHFFFAOYSA-N 0 3 325.206 3.780 20 5 EHBDHN C[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000174987167 1036160151 /nfs/dbraw/zinc/16/01/51/1036160151.db2.gz ILYCMPHIXDWONU-LIRRHRJNSA-N 0 3 339.395 3.616 20 5 EHBDHN CCCc1csc(CNCCc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000588933651 1036187728 /nfs/dbraw/zinc/18/77/28/1036187728.db2.gz RHBZKXMSOOFAGJ-UHFFFAOYSA-N 0 3 344.440 3.817 20 5 EHBDHN CC[C@]1(CNCc2ccc([N+](=O)[O-])cc2F)OCCc2ccccc21 ZINC000589319283 1036358866 /nfs/dbraw/zinc/35/88/66/1036358866.db2.gz FOCYWCYYDGVRNS-LJQANCHMSA-N 0 3 344.386 3.702 20 5 EHBDHN COc1cc(CN[C@H]2CCc3c2cccc3[N+](=O)[O-])c2ccccc2n1 ZINC000572735046 1036475755 /nfs/dbraw/zinc/47/57/55/1036475755.db2.gz OOFJLSJGYOKPDU-KRWDZBQOSA-N 0 3 349.390 3.929 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nc(CN3C[C@@H]4CCCC[C@@H]4C3)co2)cc1 ZINC000089908693 1036936249 /nfs/dbraw/zinc/93/62/49/1036936249.db2.gz TUXGHSBGBSZVLJ-GASCZTMLSA-N 0 3 327.384 3.872 20 5 EHBDHN C[C@@H]1C[C@H](NC(=O)c2cc3ccccc3c3cccnc23)CN1C1CC1 ZINC000177185115 1037410560 /nfs/dbraw/zinc/41/05/60/1037410560.db2.gz CRTWYUFDTRZXTO-ZBFHGGJFSA-N 0 3 345.446 3.743 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@H]2CCCOc3ccc(F)cc32)cc1 ZINC000540170168 1037640204 /nfs/dbraw/zinc/64/02/04/1037640204.db2.gz ZHAWBIZKYDYEAE-KRWDZBQOSA-N 0 3 346.358 3.616 20 5 EHBDHN COc1ccc([C@@H](C)CN2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000540481618 1037993228 /nfs/dbraw/zinc/99/32/28/1037993228.db2.gz YEAPNJKMRJKBPT-AWEZNQCLSA-N 0 3 326.396 3.765 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@H](C)C[C@H](C)C1 ZINC000015377597 1039302246 /nfs/dbraw/zinc/30/22/46/1039302246.db2.gz WIKUAGQISFWWMG-XQQFMLRXSA-N 0 3 330.388 3.684 20 5 EHBDHN CN(C)[C@H]1CCOc2c(Nc3ccc([N+](=O)[O-])cc3F)cccc21 ZINC000432925142 1040191054 /nfs/dbraw/zinc/19/10/54/1040191054.db2.gz BAQPPHJKHLTHGN-INIZCTEOSA-N 0 3 331.347 3.863 20 5 EHBDHN Cc1nc(C)c([C@@H](C)N(C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000106875321 1041788922 /nfs/dbraw/zinc/78/89/22/1041788922.db2.gz NLRAZLQZLISFTF-GFCCVEGCSA-N 0 3 335.429 3.740 20 5 EHBDHN Cc1cc(C)cc([C@@H](C)N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000107072386 1041814799 /nfs/dbraw/zinc/81/47/99/1041814799.db2.gz BZGFPRFSLOUBKH-CABCVRRESA-N 0 3 341.411 3.889 20 5 EHBDHN Cc1nc2c(s1)[C@H](N(C)CCOc1cccc([N+](=O)[O-])c1)CCC2 ZINC000111310834 1042260283 /nfs/dbraw/zinc/26/02/83/1042260283.db2.gz ABUTZKAZXIPZSN-MRXNPFEDSA-N 0 3 347.440 3.748 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000112700804 1042419997 /nfs/dbraw/zinc/41/99/97/1042419997.db2.gz YFBZPXXNOAJOIW-LSDHHAIUSA-N 0 3 347.459 3.530 20 5 EHBDHN Cc1cc(C2CCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n[nH]1 ZINC000273031458 1128434291 /nfs/dbraw/zinc/43/42/91/1128434291.db2.gz ULUQQYMTPBQBEA-CQSZACIVSA-N 0 3 328.416 3.875 20 5 EHBDHN O=C(CCCCNCc1csc([N+](=O)[O-])c1)OCc1ccccc1 ZINC000273046989 1128436769 /nfs/dbraw/zinc/43/67/69/1128436769.db2.gz AXZPSQJFDIHYBX-UHFFFAOYSA-N 0 3 348.424 3.660 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000765844703 1128547347 /nfs/dbraw/zinc/54/73/47/1128547347.db2.gz HXFKTPKBPJGEMF-HZPDHXFCSA-N 0 3 348.399 3.594 20 5 EHBDHN C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000089513254 1121276909 /nfs/dbraw/zinc/27/69/09/1121276909.db2.gz KTLBDBCFRUGLAA-GFCCVEGCSA-N 0 3 339.395 3.675 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CC[C@@H]3SCCS[C@@H]23)c1 ZINC000762613017 1121382973 /nfs/dbraw/zinc/38/29/73/1121382973.db2.gz GPJVEMOVJVUEEB-RDBSUJKOSA-N 0 3 344.889 3.717 20 5 EHBDHN CN(C)[C@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1cccs1 ZINC000301807419 1129104733 /nfs/dbraw/zinc/10/47/33/1129104733.db2.gz WLPAMTSKAMWAMW-GFCCVEGCSA-N 0 3 327.356 3.649 20 5 EHBDHN CCN(CC)[C@@H](CNc1ncc([N+](=O)[O-])s1)c1ccsc1 ZINC000195508674 1123494465 /nfs/dbraw/zinc/49/44/65/1123494465.db2.gz MNOLYUWELUCEJI-NSHDSACASA-N 0 3 326.447 3.608 20 5 EHBDHN CC[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000610008003 1123713002 /nfs/dbraw/zinc/71/30/02/1123713002.db2.gz BRZZPFSCLQTDRO-QGZVFWFLSA-N 0 3 336.338 3.993 20 5 EHBDHN CC[C@H](NCc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000078635509 1129174906 /nfs/dbraw/zinc/17/49/06/1129174906.db2.gz JIQYWUVQQMMZRH-INIZCTEOSA-N 0 3 328.368 3.607 20 5 EHBDHN CCOc1cc(NC[C@@H](c2ccco2)N2CCCC2)ccc1[N+](=O)[O-] ZINC000080763515 1125347993 /nfs/dbraw/zinc/34/79/93/1125347993.db2.gz RRBTVEZCENVBEU-INIZCTEOSA-N 0 3 345.399 3.836 20 5 EHBDHN Cc1c(CN(Cc2ccccc2)[C@H](C)CCO)cccc1[N+](=O)[O-] ZINC000093303986 1129583733 /nfs/dbraw/zinc/58/37/33/1129583733.db2.gz QOCXCOAJOWXQBT-OAHLLOKOSA-N 0 3 328.412 3.676 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@H](C2CCOCC2)C1 ZINC000330447104 1129637721 /nfs/dbraw/zinc/63/77/21/1129637721.db2.gz HTDXEZHURAWAKY-INIZCTEOSA-N 0 3 348.443 3.631 20 5 EHBDHN COC[C@@H](N[C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000156533751 1129723034 /nfs/dbraw/zinc/72/30/34/1129723034.db2.gz YBPJBHAWOHZKHF-XJKSGUPXSA-N 0 3 332.400 3.795 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCc1cc(C)ccc1OC ZINC000303085811 1129814839 /nfs/dbraw/zinc/81/48/39/1129814839.db2.gz BDQRIUDYOJUTLH-UHFFFAOYSA-N 0 3 344.411 3.643 20 5 EHBDHN CO[C@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000509148175 1129853961 /nfs/dbraw/zinc/85/39/61/1129853961.db2.gz AQAATKKWPNKYRV-ZDUSSCGKSA-N 0 3 332.425 3.934 20 5 EHBDHN CCC[C@H](N[C@H]1CCCc2nn(C)cc21)c1cccc([N+](=O)[O-])c1 ZINC000282509056 1129974402 /nfs/dbraw/zinc/97/44/02/1129974402.db2.gz SQGZRWBBRNFERJ-IRXDYDNUSA-N 0 3 328.416 3.837 20 5 EHBDHN Cc1c([C@H](C)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000164535714 1129980492 /nfs/dbraw/zinc/98/04/92/1129980492.db2.gz IDXIPSDFYFZKEP-KBPBESRZSA-N 0 3 349.431 3.563 20 5 EHBDHN COc1ccc(OCCNC(C)(C)c2ccccc2F)c([N+](=O)[O-])c1 ZINC000429233467 1130127716 /nfs/dbraw/zinc/12/77/16/1130127716.db2.gz DHOXBCDNBXBZRX-UHFFFAOYSA-N 0 3 348.374 3.646 20 5 EHBDHN Cc1ccccc1NC(=O)CCNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429252953 1130389062 /nfs/dbraw/zinc/38/90/62/1130389062.db2.gz NDMRUOBZNTUKGB-UHFFFAOYSA-N 0 3 341.411 3.757 20 5 EHBDHN C[C@@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H](C)C1 ZINC000246802478 1130413779 /nfs/dbraw/zinc/41/37/79/1130413779.db2.gz SUSAXAMKTUKPHK-OLZOCXBDSA-N 0 3 330.388 3.513 20 5 EHBDHN C[C@@H](N[C@H](C)c1cccc(-n2ccnn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000348082835 1131149753 /nfs/dbraw/zinc/14/97/53/1131149753.db2.gz TZTHCZVPPGSGMK-ZIAGYGMSSA-N 0 3 337.383 3.587 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2ccccc2F)c1F ZINC001173175009 1131990699 /nfs/dbraw/zinc/99/06/99/1131990699.db2.gz INHPEFRTOQAWPW-LLVKDONJSA-N 0 3 336.338 3.602 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NC(C)(C)c2ccccn2)c1F ZINC001173182113 1131993550 /nfs/dbraw/zinc/99/35/50/1131993550.db2.gz HLLMXMLFMBLCRK-GFCCVEGCSA-N 0 3 347.390 3.593 20 5 EHBDHN CCN(Cc1cccnc1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173187616 1131993600 /nfs/dbraw/zinc/99/36/00/1131993600.db2.gz AVXXDVUQUZQZDR-ZDUSSCGKSA-N 0 3 347.390 3.591 20 5 EHBDHN COc1cccc(OC)c1[C@H](C)N[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173216592 1132002311 /nfs/dbraw/zinc/00/23/11/1132002311.db2.gz DHFXXHQZBMWDEE-KGLIPLIRSA-N 0 3 344.411 3.894 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCOC[C@H]1C1CCCCC1 ZINC001173231060 1132009521 /nfs/dbraw/zinc/00/95/21/1132009521.db2.gz JGKGABKPWVFJSP-BEFAXECRSA-N 0 3 332.444 3.807 20 5 EHBDHN CC(C)CC[C@H]1CCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767758655 1133048584 /nfs/dbraw/zinc/04/85/84/1133048584.db2.gz DUXWZSMKXMYGAK-MRXNPFEDSA-N 0 3 343.431 3.711 20 5 EHBDHN COCC[C@H]1CCCCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000767941487 1133073215 /nfs/dbraw/zinc/07/32/15/1133073215.db2.gz RWUSEZAKLCKDED-CYBMUJFWSA-N 0 3 326.824 3.887 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179348063 1133242899 /nfs/dbraw/zinc/24/28/99/1133242899.db2.gz NFFKLIRTWXZGTI-SJBDTSRBSA-N 0 3 330.384 3.756 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@H]2CCc3ccccc3OC2)c1 ZINC000786866495 1133913777 /nfs/dbraw/zinc/91/37/77/1133913777.db2.gz YLQHWFTXUXXCKA-AWEZNQCLSA-N 0 3 332.787 3.732 20 5 EHBDHN CCCOc1ccc(CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788543611 1134140439 /nfs/dbraw/zinc/14/04/39/1134140439.db2.gz XYHORRJSLUKCAF-CYBMUJFWSA-N 0 3 329.400 3.817 20 5 EHBDHN CCCCN(CCn1c(C)ncc1[N+](=O)[O-])[C@H](C)c1ccc(C)o1 ZINC001190588769 1134723239 /nfs/dbraw/zinc/72/32/39/1134723239.db2.gz DUWGOTYWFCQKFE-CQSZACIVSA-N 0 3 334.420 3.864 20 5 EHBDHN CO[C@@H]1[C@H](C)[C@H](NCc2cc([N+](=O)[O-])ccc2OC(C)C)C1(C)C ZINC001170397973 1134764258 /nfs/dbraw/zinc/76/42/58/1134764258.db2.gz BWVPFEYDSAIGLM-OAUYIBNBSA-N 0 3 336.432 3.531 20 5 EHBDHN COCCN(Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CC[C@@H](C)C1 ZINC001193974788 1135208376 /nfs/dbraw/zinc/20/83/76/1135208376.db2.gz CKHAOLVFLRTEFN-DOMZBBRYSA-N 0 3 326.824 3.885 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CC[C@@H](c3ccccc3F)C2)c1 ZINC001170535866 1135577119 /nfs/dbraw/zinc/57/71/19/1135577119.db2.gz IRTNWEXBWNMDTO-CQSZACIVSA-N 0 3 330.359 3.602 20 5 EHBDHN CCC[C@H](N[C@H]1COc2ccccc2[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000808728426 1135723477 /nfs/dbraw/zinc/72/34/77/1135723477.db2.gz DUCARYJTAXLGNT-LNLFQRSKSA-N 0 3 342.395 3.520 20 5 EHBDHN Cc1c(CN2CCC[C@@H](Cc3nccs3)C2)cccc1[N+](=O)[O-] ZINC001197921396 1135751031 /nfs/dbraw/zinc/75/10/31/1135751031.db2.gz SGZUWGYNFUVWLU-AWEZNQCLSA-N 0 3 331.441 3.814 20 5 EHBDHN Cc1ccc([C@H](O)[C@@H](C)NCc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809701712 1135874125 /nfs/dbraw/zinc/87/41/25/1135874125.db2.gz JCOUALUGGMOFFB-SJKOYZFVSA-N 0 3 334.803 3.768 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1C[C@@H](OC(C)C)C1(C)C ZINC001201887871 1136070123 /nfs/dbraw/zinc/07/01/23/1136070123.db2.gz DGUPGSHSGKUGAR-IAGOWNOFSA-N 0 3 336.432 3.675 20 5 EHBDHN CC(COC(=O)c1csc(-c2cccc3ccccc32)n1)[N+](=O)[O-] ZINC000813100242 1136287658 /nfs/dbraw/zinc/28/76/58/1136287658.db2.gz PSFKENRQKBPOCF-NSHDSACASA-N 0 3 342.376 3.785 20 5 EHBDHN CC(COC(=O)c1ccc(Oc2ccccc2Cl)cc1)[N+](=O)[O-] ZINC000813102768 1136288171 /nfs/dbraw/zinc/28/81/71/1136288171.db2.gz VBJMPSFUKBXDJC-LLVKDONJSA-N 0 3 335.743 3.954 20 5 EHBDHN CC(COC(=O)c1cc(-c2ccccc2)nc2ccccc21)[N+](=O)[O-] ZINC000813104333 1136288284 /nfs/dbraw/zinc/28/82/84/1136288284.db2.gz MUVBFVBMWJMRPO-CYBMUJFWSA-N 0 3 336.347 3.724 20 5 EHBDHN CC(COC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)[N+](=O)[O-] ZINC000813111049 1136294169 /nfs/dbraw/zinc/29/41/69/1136294169.db2.gz BAJZACJUCKVFMQ-ZTHSNPKKSA-N 0 3 337.681 3.580 20 5 EHBDHN CC(COC(=O)c1cn(Cc2ccccc2)c2ccccc12)[N+](=O)[O-] ZINC000813110837 1136294204 /nfs/dbraw/zinc/29/42/04/1136294204.db2.gz KKOSHDQVNZLBMI-AWEZNQCLSA-N 0 3 338.363 3.512 20 5 EHBDHN CC([C@H](OC(=O)[C@H](C)Cc1ccco1)c1ccccc1F)[N+](=O)[O-] ZINC000851109242 1136338494 /nfs/dbraw/zinc/33/84/94/1136338494.db2.gz WCJZKJIPLBSKPN-HSMVNMDESA-N 0 3 335.331 3.547 20 5 EHBDHN O=[N+]([O-])c1ccc2c(cnn2CN2CCC[C@@H](c3ccccc3)C2)c1 ZINC000814226411 1136425520 /nfs/dbraw/zinc/42/55/20/1136425520.db2.gz WNGPKDSMEKMOQO-MRXNPFEDSA-N 0 3 336.395 3.782 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CC[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666336 1136491992 /nfs/dbraw/zinc/49/19/92/1136491992.db2.gz GMGJIIKVNURMBM-MAUKXSAKSA-N 0 3 346.814 3.771 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H](C)c1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000845876602 1137316419 /nfs/dbraw/zinc/31/64/19/1137316419.db2.gz NCRPQBMIQBVBQM-ZIBATOQPSA-N 0 3 337.372 3.940 20 5 EHBDHN CC(C)[C@H](CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccnn1C ZINC000872064423 1137569179 /nfs/dbraw/zinc/56/91/79/1137569179.db2.gz GNWYGNZHBOYHNH-STQMWFEESA-N 0 3 334.395 3.558 20 5 EHBDHN C[C@H](N[C@H]1CCO[C@H](c2ccncc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872075568 1137569959 /nfs/dbraw/zinc/56/99/59/1137569959.db2.gz DUPCUFBTPUFACD-JDFRZJQESA-N 0 3 345.374 3.700 20 5 EHBDHN Cc1c(CNC[C@@H](O)c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000873060600 1137589247 /nfs/dbraw/zinc/58/92/47/1137589247.db2.gz JVYSJSABODVPNM-OAHLLOKOSA-N 0 3 338.766 3.519 20 5 EHBDHN C[C@@H](NC1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1Cl ZINC000877054920 1137668844 /nfs/dbraw/zinc/66/88/44/1137668844.db2.gz LMVIWKZUKVUTNB-OIKLOGQESA-N 0 3 338.770 3.638 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC[C@H](C)C1 ZINC000878691187 1137725340 /nfs/dbraw/zinc/72/53/40/1137725340.db2.gz LCACKYPKEMQJTG-IHRRRGAJSA-N 0 3 344.415 3.949 20 5 EHBDHN C[C@@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCC(F)CC1 ZINC000878989310 1137734457 /nfs/dbraw/zinc/73/44/57/1137734457.db2.gz ITTCYPOFGMFCBZ-PNESKVBLSA-N 0 3 348.378 3.651 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H](c2ccc(F)cc2)C2CCOCC2)cc1 ZINC000883200685 1137848254 /nfs/dbraw/zinc/84/82/54/1137848254.db2.gz OSHNMPPEZOFPTB-IBGZPJMESA-N 0 3 344.386 3.991 20 5 EHBDHN C[C@@H](NC(C)(C)c1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000348312989 1137938072 /nfs/dbraw/zinc/93/80/72/1137938072.db2.gz FJZPRGCJDKJXFU-LLVKDONJSA-N 0 3 333.413 3.508 20 5 EHBDHN Cc1nc(C2CCN(Cc3ccc(C)c([N+](=O)[O-])c3)CC2)[nH]c1C ZINC000886659183 1138109709 /nfs/dbraw/zinc/10/97/09/1138109709.db2.gz FSOCWHRFYNMXNF-UHFFFAOYSA-N 0 3 328.416 3.623 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CC[C@H](COCc3ccccc3)C2)c1 ZINC000075864319 1138129134 /nfs/dbraw/zinc/12/91/34/1138129134.db2.gz IGBQYBOENWCBDO-SFHVURJKSA-N 0 3 326.396 3.634 20 5 EHBDHN C[C@@H](NCCN(C(=O)OC(C)(C)C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000301489399 1138566446 /nfs/dbraw/zinc/56/64/46/1138566446.db2.gz RKFAIELMNNVEKE-CYBMUJFWSA-N 0 3 349.431 3.645 20 5 EHBDHN Cc1c(CN[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000192120632 1140504077 /nfs/dbraw/zinc/50/40/77/1140504077.db2.gz GCZYCLLWXAZZHM-FUHWJXTLSA-N 0 3 348.349 3.801 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@H](O)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271025738 1141296638 /nfs/dbraw/zinc/29/66/38/1141296638.db2.gz BBXDJHABSSFHEL-SJCJKPOMSA-N 0 3 348.374 3.517 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC1CCN(Cc2ccccc2)CC1 ZINC000097262014 219006359 /nfs/dbraw/zinc/00/63/59/219006359.db2.gz PDAAKFVJABXONH-UHFFFAOYSA-N 0 3 325.412 3.980 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN(C)[C@@H](C)Cc1ccc(O)cc1 ZINC000536673376 1032106450 /nfs/dbraw/zinc/10/64/50/1032106450.db2.gz PWXPNCUEQLHYEE-AWEZNQCLSA-N 0 3 344.411 3.762 20 5 EHBDHN CCOc1cc(NC[C@@H](c2ccc(F)cc2)N(C)C)ccc1[N+](=O)[O-] ZINC000471252406 1016130296 /nfs/dbraw/zinc/13/02/96/1016130296.db2.gz YGVQEQWFLDLHFB-KRWDZBQOSA-N 0 3 347.390 3.847 20 5 EHBDHN CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](C)C(C)C ZINC000118833157 1017586346 /nfs/dbraw/zinc/58/63/46/1017586346.db2.gz PODNLXLQYKZLNB-NSHDSACASA-N 0 3 327.812 3.553 20 5 EHBDHN COc1c([O-])ccc(C[NH2+][C@@H](C)[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000893099340 1018470311 /nfs/dbraw/zinc/47/03/11/1018470311.db2.gz LPSCNUHECWEEGT-STQMWFEESA-N 0 3 330.384 3.591 20 5 EHBDHN CC(C)c1ccc(CN2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cc1[N+](=O)[O-] ZINC000449550998 1032774072 /nfs/dbraw/zinc/77/40/72/1032774072.db2.gz FEIPREZFTDINMT-IKGGRYGDSA-N 0 3 332.444 3.701 20 5 EHBDHN CCCN(Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000610476499 1020415408 /nfs/dbraw/zinc/41/54/08/1020415408.db2.gz WIKVCDAYICLDAS-DJIMGWMZSA-N 0 3 336.407 3.759 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510403170 1020767629 /nfs/dbraw/zinc/76/76/29/1020767629.db2.gz UDIOURXSBPUGRQ-KBXCAEBGSA-N 0 3 336.395 3.953 20 5 EHBDHN C[C@H](CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nccs1 ZINC000602614530 1033008118 /nfs/dbraw/zinc/00/81/18/1033008118.db2.gz SNNBLVHNYAAQCL-SECBINFHSA-N 0 3 345.346 3.963 20 5 EHBDHN CN(C)[C@@H](CNCc1cc([N+](=O)[O-])ccc1Cl)c1cccs1 ZINC000237160559 1022424259 /nfs/dbraw/zinc/42/42/59/1022424259.db2.gz AFLQVYQMXXCUOT-AWEZNQCLSA-N 0 3 339.848 3.702 20 5 EHBDHN CC(C)Oc1cccc([C@H](O)CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266813201 1022696262 /nfs/dbraw/zinc/69/62/62/1022696262.db2.gz WTCNAEHHAMCVKG-AUUYWEPGSA-N 0 3 344.411 3.766 20 5 EHBDHN C[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCCC[C@H]21 ZINC000248417904 1023260797 /nfs/dbraw/zinc/26/07/97/1023260797.db2.gz JXUAFBHIIUQWAD-UHOFOFEASA-N 0 3 342.399 3.655 20 5 EHBDHN CC1=NO[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000895311296 1024269564 /nfs/dbraw/zinc/26/95/64/1024269564.db2.gz ONSLNTSNSVIMHX-GFCCVEGCSA-N 0 3 331.397 3.578 20 5 EHBDHN CCOC(=O)C[C@H](C)N(C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000346336821 1024659760 /nfs/dbraw/zinc/65/97/60/1024659760.db2.gz PQOGFGFSHPKIHY-ZDUSSCGKSA-N 0 3 346.383 3.628 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[C@@H]([C@H]2CCCO2)C1 ZINC000895844050 1024890731 /nfs/dbraw/zinc/89/07/31/1024890731.db2.gz LOBOKPPTPOVYLV-IUODEOHRSA-N 0 3 344.333 3.615 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)c1 ZINC000281881090 1025632477 /nfs/dbraw/zinc/63/24/77/1025632477.db2.gz AJDVYKRUQGYTBW-MRXNPFEDSA-N 0 3 340.427 3.507 20 5 EHBDHN C[C@@H]1C[C@H](C)CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000127629343 1026195913 /nfs/dbraw/zinc/19/59/13/1026195913.db2.gz GHVULNVRYMBPBZ-CHWSQXEVSA-N 0 3 330.388 3.513 20 5 EHBDHN Cc1ccn(-c2ccccc2CN[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000127638073 1026201851 /nfs/dbraw/zinc/20/18/51/1026201851.db2.gz YNJAHFARLFFVIC-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN CSc1cccc(C(=O)Nc2cccc(CN(C)C)c2)c1[N+](=O)[O-] ZINC000186133248 1026256213 /nfs/dbraw/zinc/25/62/13/1026256213.db2.gz WVJGIOBXZSTFFQ-UHFFFAOYSA-N 0 3 345.424 3.631 20 5 EHBDHN COc1ccc(CNCc2c(C)c3ccccc3n2C)cc1[N+](=O)[O-] ZINC000475199806 1026379553 /nfs/dbraw/zinc/37/95/53/1026379553.db2.gz XKYLHNIIOWSHLR-UHFFFAOYSA-N 0 3 339.395 3.693 20 5 EHBDHN Cc1cccc([C@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000452096757 1026475093 /nfs/dbraw/zinc/47/50/93/1026475093.db2.gz XMIYLXIBGQRBKS-KBPBESRZSA-N 0 3 327.384 3.581 20 5 EHBDHN CC(C)C[C@@H]1OCCC[C@H]1NCc1ccc([N+](=O)[O-])cc1Cl ZINC000479581126 1026709927 /nfs/dbraw/zinc/70/99/27/1026709927.db2.gz RGBALOZMLPGJPE-CVEARBPZSA-N 0 3 326.824 3.932 20 5 EHBDHN C[C@@H](NCc1cccc(Cn2cccn2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178648519 1027265409 /nfs/dbraw/zinc/26/54/09/1027265409.db2.gz KNNCBDXSRFOFFQ-OAHLLOKOSA-N 0 3 336.395 3.690 20 5 EHBDHN CCN(Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])CC1CCC1 ZINC000355608526 1028087658 /nfs/dbraw/zinc/08/76/58/1028087658.db2.gz QAMAXSMPKDQQOU-UHFFFAOYSA-N 0 3 344.358 3.827 20 5 EHBDHN CCOc1ccc([C@H](C)NCc2cc(C)cc(N)c2)cc1[N+](=O)[O-] ZINC000423481282 1028464124 /nfs/dbraw/zinc/46/41/24/1028464124.db2.gz QCUJPLJDORDYOA-ZDUSSCGKSA-N 0 3 329.400 3.735 20 5 EHBDHN C[C@H](NCc1ccc(-n2ccnc2)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000153673267 1028556004 /nfs/dbraw/zinc/55/60/04/1028556004.db2.gz KOEJXIZSDLLPNI-ZDUSSCGKSA-N 0 3 340.358 3.770 20 5 EHBDHN CN(CCc1cccc([N+](=O)[O-])c1)Cc1ccccc1OC(F)F ZINC000583215961 1029285365 /nfs/dbraw/zinc/28/53/65/1029285365.db2.gz GTSWSCBPHCVLTM-UHFFFAOYSA-N 0 3 336.338 3.871 20 5 EHBDHN C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@H]1CCCc2occc21 ZINC000152250715 1029868003 /nfs/dbraw/zinc/86/80/03/1029868003.db2.gz NKGFMOUZDSTNGN-WBMJQRKESA-N 0 3 343.383 3.572 20 5 EHBDHN CC(C)(C)OC(=O)C[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000531868871 1029945301 /nfs/dbraw/zinc/94/53/01/1029945301.db2.gz NZYANAJHMQPGEZ-INIZCTEOSA-N 0 3 348.443 3.581 20 5 EHBDHN Cc1nc(C[C@@H]2CCCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000245514439 1030110495 /nfs/dbraw/zinc/11/04/95/1030110495.db2.gz BWLNLPPWYBNUAD-HIFRSBDPSA-N 0 3 344.415 3.610 20 5 EHBDHN CC[C@@H]1CCCC[C@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000163239919 1030220740 /nfs/dbraw/zinc/22/07/40/1030220740.db2.gz GKSFSNBNEKGUKY-IUODEOHRSA-N 0 3 330.388 3.703 20 5 EHBDHN COc1cccc(NC[C@H](c2cccs2)N2CCCC2)c1[N+](=O)[O-] ZINC000548117152 1030482615 /nfs/dbraw/zinc/48/26/15/1030482615.db2.gz MJBSJNHHGBENLR-CQSZACIVSA-N 0 3 347.440 3.914 20 5 EHBDHN C[C@H]1CCCC[C@H]1N(C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607422 1030750046 /nfs/dbraw/zinc/75/00/46/1030750046.db2.gz OSCIMSKGPUCKGO-SWLSCSKDSA-N 0 3 330.388 3.655 20 5 EHBDHN Cc1nccnc1CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000550895076 1030777394 /nfs/dbraw/zinc/77/73/94/1030777394.db2.gz LLQLKZWMSDBBNK-HXUWFJFHSA-N 0 3 348.406 3.615 20 5 EHBDHN CC(C)(CNCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCCO1 ZINC000612186116 1034430498 /nfs/dbraw/zinc/43/04/98/1034430498.db2.gz QLIUHENGZNCEIT-HNNXBMFYSA-N 0 3 326.824 3.933 20 5 EHBDHN O=[N+]([O-])c1cccc(Cl)c1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000450855934 1034899121 /nfs/dbraw/zinc/89/91/21/1034899121.db2.gz HRVJMHHUWWDRGR-XZJROXQQSA-N 0 3 336.819 3.686 20 5 EHBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCC3(CCC3)CC2)c1 ZINC000589188215 1036296861 /nfs/dbraw/zinc/29/68/61/1036296861.db2.gz MUYBPCZULUODJF-UHFFFAOYSA-N 0 3 326.343 3.962 20 5 EHBDHN O=[N+]([O-])c1ccc2cnn(CN3CCC[C@H]3Cc3ccccc3)c2c1 ZINC000026235877 1036844066 /nfs/dbraw/zinc/84/40/66/1036844066.db2.gz OBRXLFOKULTMLD-KRWDZBQOSA-N 0 3 336.395 3.609 20 5 EHBDHN CC[C@H](C)[C@H](O)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180531530 1036921006 /nfs/dbraw/zinc/92/10/06/1036921006.db2.gz OSXQVIVIVROWSG-KYNGSXCRSA-N 0 3 328.412 3.681 20 5 EHBDHN C[C@H](COc1cccc(F)c1)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761521369 1037099330 /nfs/dbraw/zinc/09/93/30/1037099330.db2.gz GGNIOCIQLJYXOY-LLVKDONJSA-N 0 3 338.766 3.944 20 5 EHBDHN COc1ccc(CN2CC[C@@H](c3cccc(C)c3)C2)cc1[N+](=O)[O-] ZINC000542318609 1037283944 /nfs/dbraw/zinc/28/39/44/1037283944.db2.gz VGVLMWBJMVZROP-QGZVFWFLSA-N 0 3 326.396 3.901 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000532470206 1037414070 /nfs/dbraw/zinc/41/40/70/1037414070.db2.gz CFUNJGIUYAJXOM-QANKJYHBSA-N 0 3 345.443 3.742 20 5 EHBDHN CCC[C@H](C)NC(=O)[C@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000051053809 1037531591 /nfs/dbraw/zinc/53/15/91/1037531591.db2.gz FQUKDQQPUXBILH-ZOBUZTSGSA-N 0 3 347.459 3.673 20 5 EHBDHN O=[N+]([O-])c1ncccc1S[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000591827504 1037639435 /nfs/dbraw/zinc/63/94/35/1037639435.db2.gz QHVBNVTWFAGDFM-OAHLLOKOSA-N 0 3 329.425 3.747 20 5 EHBDHN COc1cc(CN2CC[C@@H](Cc3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000485574441 1039264100 /nfs/dbraw/zinc/26/41/00/1039264100.db2.gz YGFBWZCWWISFPM-INIZCTEOSA-N 0 3 344.386 3.807 20 5 EHBDHN COc1cc(CN2CCC(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000485769693 1039524235 /nfs/dbraw/zinc/52/42/35/1039524235.db2.gz HROQZMKUANEEAG-UHFFFAOYSA-N 0 3 326.396 3.983 20 5 EHBDHN COc1cc(CN2CC[C@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000489100651 1039623691 /nfs/dbraw/zinc/62/36/91/1039623691.db2.gz GISJMASOARRXLT-HNNXBMFYSA-N 0 3 330.359 3.732 20 5 EHBDHN CN(C)[C@@H]1CCOc2c(Nc3ccc(F)cc3[N+](=O)[O-])cccc21 ZINC000432928686 1040201663 /nfs/dbraw/zinc/20/16/63/1040201663.db2.gz NWVHGAFAOWIHPY-OAHLLOKOSA-N 0 3 331.347 3.863 20 5 EHBDHN C[C@@]1(O)C[C@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000418108042 1040582826 /nfs/dbraw/zinc/58/28/26/1040582826.db2.gz FLCAVEVBUBTSHX-UJKQEGAGSA-N 0 3 346.358 3.529 20 5 EHBDHN C[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000181640779 1041162797 /nfs/dbraw/zinc/16/27/97/1041162797.db2.gz YSZIYQCISRUMFY-NSHDSACASA-N 0 3 349.337 3.552 20 5 EHBDHN CC[C@@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CC1(C)C ZINC000419315167 1041275181 /nfs/dbraw/zinc/27/51/81/1041275181.db2.gz JIDMINXPSNGAFP-ZIAGYGMSSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@@H](NC(=O)Nc1cccc(CN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000047505613 1041681819 /nfs/dbraw/zinc/68/18/19/1041681819.db2.gz SZXQKYQCQQGDLZ-CYBMUJFWSA-N 0 3 342.399 3.539 20 5 EHBDHN Cc1nc(C)c([C@@H](C)N(C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000106874913 1041788107 /nfs/dbraw/zinc/78/81/07/1041788107.db2.gz MKILCEHEACYJLG-GFCCVEGCSA-N 0 3 335.429 3.740 20 5 EHBDHN CCCN(Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])CC1CC1 ZINC000045003984 1042022219 /nfs/dbraw/zinc/02/22/19/1042022219.db2.gz CTQFQNWCHZPCPN-UHFFFAOYSA-N 0 3 344.358 3.827 20 5 EHBDHN COc1ccc(CNC/C=C/c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000512087392 1043174282 /nfs/dbraw/zinc/17/42/82/1043174282.db2.gz JJTRDOYWJXQJNI-NSCUHMNNSA-N 0 3 334.322 3.685 20 5 EHBDHN Cc1cc(N2CCC[C@@H](c3ncc[nH]3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272892023 1127097451 /nfs/dbraw/zinc/09/74/51/1127097451.db2.gz YCHGULUEOSRMMW-CYBMUJFWSA-N 0 3 337.383 3.559 20 5 EHBDHN Cc1nn(CN(C)C[C@@H](C)c2ccccc2)c2ccc([N+](=O)[O-])cc12 ZINC000764965543 1127559899 /nfs/dbraw/zinc/55/98/99/1127559899.db2.gz YBPJLEBKLLPBNC-CQSZACIVSA-N 0 3 338.411 3.946 20 5 EHBDHN COc1cc(F)c([N+](=O)[O-])c(NC[C@@H](c2cccs2)N(C)C)c1 ZINC000301325881 1127737978 /nfs/dbraw/zinc/73/79/78/1127737978.db2.gz ARYJCNHEAHWYQJ-ZDUSSCGKSA-N 0 3 339.392 3.519 20 5 EHBDHN CCOc1ccc(CN(C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000065208568 1128186349 /nfs/dbraw/zinc/18/63/49/1128186349.db2.gz GQPYBDRGGXIQSZ-UHFFFAOYSA-N 0 3 330.384 3.504 20 5 EHBDHN Cc1ccnc(NC[C@H](c2ccc(Cl)cc2)N(C)C)c1[N+](=O)[O-] ZINC000301484130 1128473383 /nfs/dbraw/zinc/47/33/83/1128473383.db2.gz VCFOXFYUTYBQLT-CQSZACIVSA-N 0 3 334.807 3.666 20 5 EHBDHN C[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CN1C1CC1 ZINC000301554964 1128496510 /nfs/dbraw/zinc/49/65/10/1128496510.db2.gz ICXPBAWNVXSAHO-KOLCDFICSA-N 0 3 329.322 3.651 20 5 EHBDHN Cc1cc(CNCc2ccc([N+](=O)[O-])cc2)ccc1Br ZINC000091469567 1128670194 /nfs/dbraw/zinc/67/01/94/1128670194.db2.gz JTOQFIGAAKETDX-UHFFFAOYSA-N 0 3 335.201 3.956 20 5 EHBDHN COc1cccc([C@H](CNc2c(C)cccc2[N+](=O)[O-])N(C)C)c1 ZINC000301192785 1122449700 /nfs/dbraw/zinc/44/97/00/1122449700.db2.gz SLZQNXJYIPQTIU-KRWDZBQOSA-N 0 3 329.400 3.627 20 5 EHBDHN COc1ccc(CN(C)CCCOc2ccc([N+](=O)[O-])cc2)cc1F ZINC000917830525 1122694419 /nfs/dbraw/zinc/69/44/19/1122694419.db2.gz HYAQYKGJLWEELP-UHFFFAOYSA-N 0 3 348.374 3.643 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@H]2CCCOC2)ccc1Oc1ccc(F)cc1 ZINC000237883970 1123902689 /nfs/dbraw/zinc/90/26/89/1123902689.db2.gz DNFFNNFTTIZALQ-HNNXBMFYSA-N 0 3 346.358 3.795 20 5 EHBDHN CC(C)(NCc1ccc(-n2cccn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000080347117 1129347983 /nfs/dbraw/zinc/34/79/83/1129347983.db2.gz ZJMRKWZRZKKMHU-UHFFFAOYSA-N 0 3 336.395 3.805 20 5 EHBDHN Cc1c(NC(=O)CCN(C)[C@@H](C)c2ccco2)cccc1[N+](=O)[O-] ZINC000069070392 1129420740 /nfs/dbraw/zinc/42/07/40/1129420740.db2.gz YJQWGTIAHPTTAD-ZDUSSCGKSA-N 0 3 331.372 3.518 20 5 EHBDHN O=[N+]([O-])c1cccc(F)c1NC1CCN(Cc2ccccc2)CC1 ZINC000305251261 1129915315 /nfs/dbraw/zinc/91/53/15/1129915315.db2.gz PQWWFIPNKKQNPW-UHFFFAOYSA-N 0 3 329.375 3.810 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CNCc2ccc(-c3ccccc3)o2)cc1 ZINC000731678486 1130830886 /nfs/dbraw/zinc/83/08/86/1130830886.db2.gz NGXNJWZLULUTFD-GOSISDBHSA-N 0 3 338.363 3.678 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N(C)Cc2ccsc2)c1F ZINC001173195171 1131995361 /nfs/dbraw/zinc/99/53/61/1131995361.db2.gz CSZNIQRMHFHAIG-NSHDSACASA-N 0 3 338.404 3.867 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)C1CCCCCCC1 ZINC000744392952 1132083230 /nfs/dbraw/zinc/08/32/30/1132083230.db2.gz GZYUPXBDHBCUPN-UHFFFAOYSA-N 0 3 333.432 3.886 20 5 EHBDHN CCCN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC(C)C ZINC000746145348 1132384560 /nfs/dbraw/zinc/38/45/60/1132384560.db2.gz KNSRGDPULINYFK-UHFFFAOYSA-N 0 3 327.812 3.555 20 5 EHBDHN CN(C)[C@@H]1CCOc2c(Nc3cc([N+](=O)[O-])ccc3F)cccc21 ZINC001175737411 1132749281 /nfs/dbraw/zinc/74/92/81/1132749281.db2.gz SFNROOFLRQHVOF-MRXNPFEDSA-N 0 3 331.347 3.863 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1ccccc1[N+](=O)[O-] ZINC000786811116 1133909102 /nfs/dbraw/zinc/90/91/02/1133909102.db2.gz IVWCLOOLGHFLLF-UKTHLTGXSA-N 0 3 327.340 3.696 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CCc3ccccc3OC2)c1 ZINC000786866496 1133914090 /nfs/dbraw/zinc/91/40/90/1133914090.db2.gz YLQHWFTXUXXCKA-CQSZACIVSA-N 0 3 332.787 3.732 20 5 EHBDHN CC(C)C[C@@H]1OCCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000775371660 1134675205 /nfs/dbraw/zinc/67/52/05/1134675205.db2.gz OUNKCLWCLPPAAA-HOTGVXAUSA-N 0 3 326.824 3.932 20 5 EHBDHN COc1ccc(C[C@@H](C)NCc2cc(F)ccc2F)c([N+](=O)[O-])c1 ZINC001170298092 1134738023 /nfs/dbraw/zinc/73/80/23/1134738023.db2.gz ZXPSZIMHVBTIPF-LLVKDONJSA-N 0 3 336.338 3.602 20 5 EHBDHN COc1ccc(C[C@H](C)N(C)Cc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170347886 1134759382 /nfs/dbraw/zinc/75/93/82/1134759382.db2.gz SUJBEQDEYXABRP-ZDUSSCGKSA-N 0 3 332.375 3.806 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(CNC[C@H]2CCCO2)o1 ZINC000078968765 1135141819 /nfs/dbraw/zinc/14/18/19/1135141819.db2.gz OFYCTSJKFFWJHS-GFCCVEGCSA-N 0 3 336.775 3.777 20 5 EHBDHN COCCN(Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CC[C@H](C)C1 ZINC001193974790 1135208744 /nfs/dbraw/zinc/20/87/44/1135208744.db2.gz CKHAOLVFLRTEFN-SWLSCSKDSA-N 0 3 326.824 3.885 20 5 EHBDHN CC[C@H](c1ccccc1OC)N(C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834342 1135332853 /nfs/dbraw/zinc/33/28/53/1135332853.db2.gz FWOAMEDKWYVDSD-MSOLQXFVSA-N 0 3 344.411 3.720 20 5 EHBDHN Cc1c(CN2C[C@H](C)C[C@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195250332 1135398981 /nfs/dbraw/zinc/39/89/81/1135398981.db2.gz MBUCTEKVNBDKTA-CJNGLKHVSA-N 0 3 348.443 3.703 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1C[C@H](OC(C)C)C1(C)C ZINC001201887876 1136070254 /nfs/dbraw/zinc/07/02/54/1136070254.db2.gz DGUPGSHSGKUGAR-SJORKVTESA-N 0 3 336.432 3.675 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776279702 1136134782 /nfs/dbraw/zinc/13/47/82/1136134782.db2.gz XENNFJNEXIYUNE-ROUUACIJSA-N 0 3 330.359 3.604 20 5 EHBDHN C[C@@H](c1ccccc1)[C@@H](O)CNCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000850411564 1136252990 /nfs/dbraw/zinc/25/29/90/1136252990.db2.gz FPXNOEVYJQMOJB-SJCJKPOMSA-N 0 3 334.803 3.502 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C)[C@@H](O)c1ccc(C)cc1 ZINC000850468337 1136265149 /nfs/dbraw/zinc/26/51/49/1136265149.db2.gz BOMPPMDNXVNXJC-CKFHNAJUSA-N 0 3 344.411 3.685 20 5 EHBDHN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813105338 1136287638 /nfs/dbraw/zinc/28/76/38/1136287638.db2.gz LYHIJBOLSXLOHY-ZCFIWIBFSA-N 0 3 346.817 3.655 20 5 EHBDHN CC(COC(=O)c1sc(-c2ccccc2)nc1C(F)F)[N+](=O)[O-] ZINC000813100570 1136287644 /nfs/dbraw/zinc/28/76/44/1136287644.db2.gz UOLHGQRJFPNKOK-QMMMGPOBSA-N 0 3 342.323 3.570 20 5 EHBDHN CC(COC(=O)C[C@@H](Cc1ccccc1)c1ccccc1)[N+](=O)[O-] ZINC000813106929 1136293866 /nfs/dbraw/zinc/29/38/66/1136293866.db2.gz ICWWVSUIAKLHDR-CRAIPNDOSA-N 0 3 327.380 3.611 20 5 EHBDHN Cc1cc(C)c2nc(C3CC3)cc(C(=O)OCC(C)[N+](=O)[O-])c2c1 ZINC000813110959 1136294193 /nfs/dbraw/zinc/29/41/93/1136294193.db2.gz MVWWQJFQZFWDAL-LBPRGKRZSA-N 0 3 328.368 3.551 20 5 EHBDHN CC(C)N(Cc1ccccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580024 1136444953 /nfs/dbraw/zinc/44/49/53/1136444953.db2.gz QPEQVZPXECSFCO-GOSISDBHSA-N 0 3 332.375 3.678 20 5 EHBDHN C[C@H](NCc1ccc(-c2cnn(C)c2)s1)c1cccc([N+](=O)[O-])c1 ZINC000509476910 1136625501 /nfs/dbraw/zinc/62/55/01/1136625501.db2.gz QKSSWMJEPNPKMX-LBPRGKRZSA-N 0 3 342.424 3.908 20 5 EHBDHN CC(C)[C@@H](NCc1c(F)cc([N+](=O)[O-])cc1F)C1(CO)CCCC1 ZINC001170929857 1136950354 /nfs/dbraw/zinc/95/03/54/1136950354.db2.gz NWIZSMIMPQJLQW-MRXNPFEDSA-N 0 3 342.386 3.540 20 5 EHBDHN Cc1ccc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cc1 ZINC000845872736 1137315963 /nfs/dbraw/zinc/31/59/63/1137315963.db2.gz MXYZEVSIUZDJHY-SCLBCKFNSA-N 0 3 331.343 3.626 20 5 EHBDHN CC([C@@H](OC(=O)c1ccnc(C2CC2)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845874753 1137316198 /nfs/dbraw/zinc/31/61/98/1137316198.db2.gz IMMFXFQWSDUGPW-PIGZYNQJSA-N 0 3 344.342 3.661 20 5 EHBDHN CC(C)c1cccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845879660 1137316937 /nfs/dbraw/zinc/31/69/37/1137316937.db2.gz WBSZVSSFSBVCJZ-SJKOYZFVSA-N 0 3 346.358 3.907 20 5 EHBDHN CC([C@@H](OC(=O)[C@H]1C[C@@H]1c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882203 1137317205 /nfs/dbraw/zinc/31/72/05/1137317205.db2.gz NWJZSXCVXTXKJA-OBZJAWTPSA-N 0 3 343.354 3.879 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCCc2cn[nH]c21 ZINC000872047684 1137567721 /nfs/dbraw/zinc/56/77/21/1137567721.db2.gz COJRLOYNOCUDQC-QMTHXVAHSA-N 0 3 332.429 3.768 20 5 EHBDHN C[C@H](NCCCCC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872053408 1137568251 /nfs/dbraw/zinc/56/82/51/1137568251.db2.gz JXIDURYROWBJOG-LBPRGKRZSA-N 0 3 340.395 3.897 20 5 EHBDHN CC[C@@H]1CCC[C@H](C)N1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878995707 1137734727 /nfs/dbraw/zinc/73/47/27/1137734727.db2.gz UXGCDPWXOYHXDY-QWHCGFSZSA-N 0 3 330.388 3.798 20 5 EHBDHN CN(C)C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000282865592 1137889779 /nfs/dbraw/zinc/88/97/79/1137889779.db2.gz QQTBWHXXMDYZOK-QGZVFWFLSA-N 0 3 333.819 3.641 20 5 EHBDHN CC(C)[C@@H]1CCCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000117432287 1137930163 /nfs/dbraw/zinc/93/01/63/1137930163.db2.gz GGIQPPGTYDMNQX-HNNXBMFYSA-N 0 3 330.388 3.655 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c1 ZINC000134802706 1137960889 /nfs/dbraw/zinc/96/08/89/1137960889.db2.gz CWZZOVNBHGBCGR-HKUYNNGSSA-N 0 3 344.386 3.822 20 5 EHBDHN CC[C@@H]1c2ccsc2CCN1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136930116 1138044308 /nfs/dbraw/zinc/04/43/08/1138044308.db2.gz RYHYJPWCHHMWNE-CVEARBPZSA-N 0 3 332.425 3.699 20 5 EHBDHN CC1(C)CCCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000127084623 1138346438 /nfs/dbraw/zinc/34/64/38/1138346438.db2.gz WDFKKSYNUJXCKQ-UHFFFAOYSA-N 0 3 330.388 3.657 20 5 EHBDHN CC(C)(C)[C@@H]1CCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000264300682 1138467949 /nfs/dbraw/zinc/46/79/49/1138467949.db2.gz VLPWEPZQMFZOPV-AWEZNQCLSA-N 0 3 330.388 3.655 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000153256506 1139128940 /nfs/dbraw/zinc/12/89/40/1139128940.db2.gz FOXYEKUQOTVUPI-SJCJKPOMSA-N 0 3 348.374 3.517 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000153256599 1139129013 /nfs/dbraw/zinc/12/90/13/1139129013.db2.gz FOXYEKUQOTVUPI-SJKOYZFVSA-N 0 3 348.374 3.517 20 5 EHBDHN Cc1ccc(NC(=O)c2c(C)c(C)ccc2[N+](=O)[O-])c(CN(C)C)c1 ZINC000888984755 1139153936 /nfs/dbraw/zinc/15/39/36/1139153936.db2.gz YEVNMHXIVDPSMA-UHFFFAOYSA-N 0 3 341.411 3.834 20 5 EHBDHN Cc1c([C@H](C)NCc2ccc(C(C)(C)O)cc2)cccc1[N+](=O)[O-] ZINC000186618056 1140213511 /nfs/dbraw/zinc/21/35/11/1140213511.db2.gz ZZZDBRBFGLDSDL-AWEZNQCLSA-N 0 3 328.412 3.981 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ccccc1-n1cccn1)CCC2 ZINC000192776048 1140550551 /nfs/dbraw/zinc/55/05/51/1140550551.db2.gz NHEVFABUKILYRK-IBGZPJMESA-N 0 3 348.406 3.948 20 5 EHBDHN CC(C)(C)[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000270667644 1141253377 /nfs/dbraw/zinc/25/33/77/1141253377.db2.gz PUWIRWCJPKVYCF-IUODEOHRSA-N 0 3 326.824 3.932 20 5 EHBDHN COc1ccc(CN[C@H](C)[C@H](OC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271548323 1141394996 /nfs/dbraw/zinc/39/49/96/1141394996.db2.gz UEFSGFWVDMEDHW-XIKOKIGWSA-N 0 3 348.374 3.608 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN(C)[C@H](C)Cc1ccc(O)cc1 ZINC000536673377 1032106422 /nfs/dbraw/zinc/10/64/22/1032106422.db2.gz PWXPNCUEQLHYEE-CQSZACIVSA-N 0 3 344.411 3.762 20 5 EHBDHN COc1ccc(COCCN[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000091741139 1015645781 /nfs/dbraw/zinc/64/57/81/1015645781.db2.gz PMWSCCHKGHYZRJ-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](N[C@@H]2CCc3c[nH]nc3C2)c2ccccc2)c1 ZINC000359895407 1015910321 /nfs/dbraw/zinc/91/03/21/1015910321.db2.gz GWIYINRSQQWNND-YLJYHZDGSA-N 0 3 348.406 3.554 20 5 EHBDHN COc1cc(C[NH2+]CC[C@@H]2CCc3ccccc32)c([N+](=O)[O-])cc1[O-] ZINC000449379761 1032505557 /nfs/dbraw/zinc/50/55/57/1032505557.db2.gz UNEWKGUKCXOVRP-AWEZNQCLSA-N 0 3 342.395 3.519 20 5 EHBDHN C[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000118850282 1017992097 /nfs/dbraw/zinc/99/20/97/1017992097.db2.gz DOGKNZKQZLWAKG-WWGRRREGSA-N 0 3 342.399 3.798 20 5 EHBDHN CN(C)c1ccccc1CN(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000574200717 1032738679 /nfs/dbraw/zinc/73/86/79/1032738679.db2.gz DWIHXFTUGXXKOY-FLIBITNWSA-N 0 3 325.412 3.806 20 5 EHBDHN CCC(CC)N(CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000518432820 1021179066 /nfs/dbraw/zinc/17/90/66/1021179066.db2.gz GJSIDGDOXUAXOK-UHFFFAOYSA-N 0 3 327.812 3.697 20 5 EHBDHN CCN(CC)[C@H](CNc1c(OC)cccc1[N+](=O)[O-])c1ccco1 ZINC000519619946 1021577633 /nfs/dbraw/zinc/57/76/33/1021577633.db2.gz XFRJDQVDIRBGQS-CQSZACIVSA-N 0 3 333.388 3.691 20 5 EHBDHN COc1cccc([C@@H]2CCCN2CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000058932539 1033087205 /nfs/dbraw/zinc/08/72/05/1033087205.db2.gz FDHXMDMTPRCGKJ-IBGZPJMESA-N 0 3 342.395 3.819 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](C)N(C)c1ccccc1 ZINC000509573969 1023072538 /nfs/dbraw/zinc/07/25/38/1023072538.db2.gz WNUIIDVDAKTBIK-OAHLLOKOSA-N 0 3 343.427 3.608 20 5 EHBDHN CC[C@H](C)CN(C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000247494864 1023352053 /nfs/dbraw/zinc/35/20/53/1023352053.db2.gz HIZJUVAOCIPLJF-WDEREUQCSA-N 0 3 327.812 3.553 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC2(CCOCC2)CC1 ZINC000341988536 1023742296 /nfs/dbraw/zinc/74/22/96/1023742296.db2.gz IQKQLFZUWDODPW-UHFFFAOYSA-N 0 3 348.443 3.775 20 5 EHBDHN C[C@H](CN1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 ZINC000522664119 1024157380 /nfs/dbraw/zinc/15/73/80/1024157380.db2.gz JHMUDXNISKBJAE-MRXNPFEDSA-N 0 3 325.412 3.521 20 5 EHBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1cc2ccc(F)cc2[nH]1 ZINC000515332110 1025174007 /nfs/dbraw/zinc/17/40/07/1025174007.db2.gz QIJUVEFJMUUOBB-UHFFFAOYSA-N 0 3 327.359 3.890 20 5 EHBDHN C[C@@H]1CCC[C@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467886 1025465984 /nfs/dbraw/zinc/46/59/84/1025465984.db2.gz OHVOOXVKXRUJFQ-NEPJUHHUSA-N 0 3 339.823 3.697 20 5 EHBDHN CC[C@H](N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000121056481 1025613246 /nfs/dbraw/zinc/61/32/46/1025613246.db2.gz BCTYOOSJPPJNRL-HOCLYGCPSA-N 0 3 341.411 3.971 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C ZINC000451480214 1025997562 /nfs/dbraw/zinc/99/75/62/1025997562.db2.gz PQUIVNNTUQBODP-CGTJXYLNSA-N 0 3 348.443 3.675 20 5 EHBDHN O=[N+]([O-])c1ccn(CCN2CC=C(c3cccc4ccccc43)CC2)n1 ZINC000478437790 1026102535 /nfs/dbraw/zinc/10/25/35/1026102535.db2.gz VLSJQJOLNSZNLF-UHFFFAOYSA-N 0 3 348.406 3.734 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@@H]3CCCCO3)o2)c([N+](=O)[O-])c1 ZINC000237429181 1026229068 /nfs/dbraw/zinc/22/90/68/1026229068.db2.gz NBDKVIJRANBXJV-AWEZNQCLSA-N 0 3 346.383 3.522 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC(c3ccccc3F)CC2)cc1 ZINC000523016918 1026450323 /nfs/dbraw/zinc/45/03/23/1026450323.db2.gz LQIZGLDENXNHQL-UHFFFAOYSA-N 0 3 344.386 3.992 20 5 EHBDHN CC(C)(C)C[C@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000452067675 1026460884 /nfs/dbraw/zinc/46/08/84/1026460884.db2.gz ANXGCSRRGIAFLO-CYBMUJFWSA-N 0 3 344.415 3.903 20 5 EHBDHN CN(C)[C@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccsc1 ZINC000783598657 1027717379 /nfs/dbraw/zinc/71/73/79/1027717379.db2.gz VLCOCTWTNXKHMZ-OAHLLOKOSA-N 0 3 339.848 3.702 20 5 EHBDHN CC(=O)c1cc(N[C@@H](C)[C@@H](c2ccccc2)N(C)C)ccc1[N+](=O)[O-] ZINC000572898101 1028366242 /nfs/dbraw/zinc/36/62/42/1028366242.db2.gz LFBMXHPQLLNHKW-DJJJIMSYSA-N 0 3 341.411 3.901 20 5 EHBDHN CCC(CC)N(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000533268646 1029568630 /nfs/dbraw/zinc/56/86/30/1029568630.db2.gz PGMIZDORFIMXJP-UHFFFAOYSA-N 0 3 339.823 3.840 20 5 EHBDHN C[C@H](NC[C@@H]1CCC[C@@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC000926916528 1031274290 /nfs/dbraw/zinc/27/42/90/1031274290.db2.gz QDUBSAUDZWPPOT-MJVIPROJSA-N 0 3 332.322 3.745 20 5 EHBDHN C[C@@H]1C[C@H](C)[C@H](C)N(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000475728739 1031663258 /nfs/dbraw/zinc/66/32/58/1031663258.db2.gz CPDQPXJSTPIIGJ-AGIUHOORSA-N 0 3 330.388 3.511 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](C)c1c(C)noc1C ZINC000595035039 1033655275 /nfs/dbraw/zinc/65/52/75/1033655275.db2.gz GMLKMSHAFHKRJQ-WDEREUQCSA-N 0 3 333.388 3.663 20 5 EHBDHN Cc1noc(CN2C[C@@H](c3ccccc3)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000595545133 1033856150 /nfs/dbraw/zinc/85/61/50/1033856150.db2.gz ONLPOFYETGAMMF-HNNXBMFYSA-N 0 3 327.384 3.661 20 5 EHBDHN O=C(CN1CCC[C@@H]1C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000603896348 1034003171 /nfs/dbraw/zinc/00/31/71/1034003171.db2.gz OOMSGTDZLFPLKM-MRXNPFEDSA-N 0 3 331.416 3.578 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CCC[C@@H]1c1ccc(O)cc1 ZINC000604484500 1034387901 /nfs/dbraw/zinc/38/79/01/1034387901.db2.gz XTIZHPBZDJBEGL-MRXNPFEDSA-N 0 3 328.368 3.516 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC(c2ccon2)CC1 ZINC000597227949 1034608801 /nfs/dbraw/zinc/60/88/01/1034608801.db2.gz JIQWHHZGVMZKTG-KAMYIIQDSA-N 0 3 327.384 3.866 20 5 EHBDHN CCC[C@H](C)NC(=O)[C@@H]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000250425156 1034847559 /nfs/dbraw/zinc/84/75/59/1034847559.db2.gz FQUKDQQPUXBILH-ZMSDIMECSA-N 0 3 347.459 3.673 20 5 EHBDHN CO[C@](C)([C@@H](C)NCc1cc([N+](=O)[O-])ccc1OC(C)C)C1CC1 ZINC000411948122 1035079661 /nfs/dbraw/zinc/07/96/61/1035079661.db2.gz MWOMOEYRNTZWPY-FZKQIMNGSA-N 0 3 336.432 3.675 20 5 EHBDHN CC(C)(C)c1ccc([C@H]2CCCN2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000472452592 1035127843 /nfs/dbraw/zinc/12/78/43/1035127843.db2.gz YMMNZCBSAZQKRF-GOSISDBHSA-N 0 3 342.443 3.926 20 5 EHBDHN CCCCN(CC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000045003889 1035601832 /nfs/dbraw/zinc/60/18/32/1035601832.db2.gz RDAKHUAQZOWKKP-UHFFFAOYSA-N 0 3 332.347 3.827 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(Nc2ccccn2)CC1 ZINC000540911776 1036003930 /nfs/dbraw/zinc/00/39/30/1036003930.db2.gz NLYBIIVDAIHLSH-HNNXBMFYSA-N 0 3 340.427 3.936 20 5 EHBDHN CCCC[C@@H](N)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000442723080 1036212853 /nfs/dbraw/zinc/21/28/53/1036212853.db2.gz YNAFKPHSINLDGQ-QGZVFWFLSA-N 0 3 343.383 3.843 20 5 EHBDHN COc1cc(CN(C)[C@H]2CCc3ccccc3C2)c([N+](=O)[O-])cc1F ZINC000464677556 1036651789 /nfs/dbraw/zinc/65/17/89/1036651789.db2.gz LXLOIXRXELUVMC-INIZCTEOSA-N 0 3 344.386 3.732 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nc(CN3C[C@H]4CCCC[C@@H]4C3)co2)cc1 ZINC000089908694 1036938843 /nfs/dbraw/zinc/93/88/43/1036938843.db2.gz TUXGHSBGBSZVLJ-HUUCEWRRSA-N 0 3 327.384 3.872 20 5 EHBDHN COc1cc(NC[C@@H](c2cccs2)N(C)C)c([N+](=O)[O-])cc1C ZINC000590568257 1036952846 /nfs/dbraw/zinc/95/28/46/1036952846.db2.gz AULRBXOTLANFRE-AWEZNQCLSA-N 0 3 335.429 3.688 20 5 EHBDHN CN(C)Cc1ccccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000031232889 1037195050 /nfs/dbraw/zinc/19/50/50/1037195050.db2.gz GYOVKHHVBMOKFI-UHFFFAOYSA-N 0 3 333.775 3.562 20 5 EHBDHN Cc1ccc(CN(CCOc2ccccc2[N+](=O)[O-])CC2CC2)cn1 ZINC000592145636 1037871690 /nfs/dbraw/zinc/87/16/90/1037871690.db2.gz XHUCXDAWIJUJFY-UHFFFAOYSA-N 0 3 341.411 3.589 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])c(SCCN(C)Cc2ccccc2)n1 ZINC000432925593 1040193882 /nfs/dbraw/zinc/19/38/82/1040193882.db2.gz AEVFMLPJPRRXKE-UHFFFAOYSA-N 0 3 331.441 3.831 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N(C)CCCNC(=O)OC(C)(C)C ZINC000125250871 1041926959 /nfs/dbraw/zinc/92/69/59/1041926959.db2.gz SDXROIZQEORKOM-CYBMUJFWSA-N 0 3 337.420 3.502 20 5 EHBDHN COc1ccc(CNC/C(C)=C/c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000468890624 1042179031 /nfs/dbraw/zinc/17/90/31/1042179031.db2.gz HRNFFZAFGMFTMH-MDWZMJQESA-N 0 3 330.359 3.936 20 5 EHBDHN CC1(C)C[C@H](NCc2cccc(CO)c2)c2cc([N+](=O)[O-])ccc21 ZINC000279006172 1043173175 /nfs/dbraw/zinc/17/31/75/1043173175.db2.gz GJCOPDRRXXCZSI-SFHVURJKSA-N 0 3 326.396 3.599 20 5 EHBDHN Cc1ccc([C@H](O)CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000279029802 1043219715 /nfs/dbraw/zinc/21/97/15/1043219715.db2.gz IHPPRCYEJUXYNH-HZPDHXFCSA-N 0 3 330.384 3.542 20 5 EHBDHN CN(CC1CCCCC1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728898364 1043614455 /nfs/dbraw/zinc/61/44/55/1043614455.db2.gz UFBJNLZAODNWRL-UHFFFAOYSA-N 0 3 328.416 3.928 20 5 EHBDHN Cc1cccc([C@H](C)NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1C ZINC000183720609 1125742287 /nfs/dbraw/zinc/74/22/87/1125742287.db2.gz AHGZYCNEABRESZ-HNNXBMFYSA-N 0 3 341.411 3.809 20 5 EHBDHN C[C@@H]1CN(CCCCNc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000301580724 1128499693 /nfs/dbraw/zinc/49/96/93/1128499693.db2.gz SHSZWXCDCQVXLW-BETUJISGSA-N 0 3 341.839 3.550 20 5 EHBDHN CC[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000765846231 1128550033 /nfs/dbraw/zinc/55/00/33/1128550033.db2.gz WKNYNNZKOFQCNA-IRXDYDNUSA-N 0 3 336.338 3.647 20 5 EHBDHN CC(C)CCOC1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000193106226 1120917005 /nfs/dbraw/zinc/91/70/05/1120917005.db2.gz XNXKKRVKVRLBPC-UHFFFAOYSA-N 0 3 336.432 3.501 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)/C=C\c1ccccc1[N+](=O)[O-] ZINC000255001843 1128980399 /nfs/dbraw/zinc/98/03/99/1128980399.db2.gz CHNPZMQWRCFHDQ-KHPPLWFESA-N 0 3 339.395 3.617 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)cnc1NCCCN1CCc2ccccc2C1 ZINC000301747782 1129025868 /nfs/dbraw/zinc/02/58/68/1129025868.db2.gz RIGRANGFCFUIAR-UHFFFAOYSA-N 0 3 346.818 3.504 20 5 EHBDHN CC(=O)c1ccc(NCC(C)(C)N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301196423 1122423193 /nfs/dbraw/zinc/42/31/93/1122423193.db2.gz UJRMMZNPQIPSAW-ZDUSSCGKSA-N 0 3 333.432 3.720 20 5 EHBDHN Cc1ccc(N2CCCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000917088273 1122485614 /nfs/dbraw/zinc/48/56/14/1122485614.db2.gz HMZUDKFEBFXUPC-UHFFFAOYSA-N 0 3 325.412 3.616 20 5 EHBDHN C[C@@H]1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccco2)C1 ZINC000154388991 1122600755 /nfs/dbraw/zinc/60/07/55/1122600755.db2.gz CFMTUOYSLNUCSV-COXVUDFISA-N 0 3 330.384 3.694 20 5 EHBDHN C[C@](CO)(NCc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000610140410 1123735214 /nfs/dbraw/zinc/73/52/14/1123735214.db2.gz WGARNWADZXNQSL-MRXNPFEDSA-N 0 3 326.824 3.669 20 5 EHBDHN Cc1cccc(C(C)(C)NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000179590077 1123799223 /nfs/dbraw/zinc/79/92/23/1123799223.db2.gz RIKYNLGCPWNQDU-UHFFFAOYSA-N 0 3 341.411 3.675 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@@H]2CCCOC2)ccc1Oc1ccc(F)cc1 ZINC000237883722 1123902715 /nfs/dbraw/zinc/90/27/15/1123902715.db2.gz DNFFNNFTTIZALQ-OAHLLOKOSA-N 0 3 346.358 3.795 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)N(C)C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181738 1129316454 /nfs/dbraw/zinc/31/64/54/1129316454.db2.gz IYXZSELUSQFTLB-GJZGRUSLSA-N 0 3 331.416 3.518 20 5 EHBDHN CSc1ccc([C@H](CNc2nccc(C)c2[N+](=O)[O-])N(C)C)cc1 ZINC000338834811 1129397974 /nfs/dbraw/zinc/39/79/74/1129397974.db2.gz FHKBSUDHOUAMOA-HNNXBMFYSA-N 0 3 346.456 3.735 20 5 EHBDHN Cn1cc(CN2CCC[C@@H]3CCC[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092485400 1129548548 /nfs/dbraw/zinc/54/85/48/1129548548.db2.gz OHBGQELCUQLXGE-KSSFIOAISA-N 0 3 340.427 3.760 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCc1c(C)cc(CO)cc1C ZINC000922562322 1129570827 /nfs/dbraw/zinc/57/08/27/1129570827.db2.gz LBSXZMKJFJJDLS-UHFFFAOYSA-N 0 3 328.412 3.611 20 5 EHBDHN CCc1nc(CN[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cs1 ZINC000156405204 1129714672 /nfs/dbraw/zinc/71/46/72/1129714672.db2.gz NNQZUFALMJJXNO-OAHLLOKOSA-N 0 3 331.441 3.725 20 5 EHBDHN Cc1cc([C@@H]2CCCN2[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910417 1131916517 /nfs/dbraw/zinc/91/65/17/1131916517.db2.gz ZFIDFAGNRXRWQF-LPHOPBHVSA-N 0 3 341.411 3.976 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC3(CCC3)CC2)c1F ZINC001173180471 1131992533 /nfs/dbraw/zinc/99/25/33/1131992533.db2.gz KZLXAAOJLHDGBP-CYBMUJFWSA-N 0 3 336.407 3.940 20 5 EHBDHN Cc1cccc(N2CCN([C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173224695 1132005974 /nfs/dbraw/zinc/00/59/74/1132005974.db2.gz GLAMPWFWQZLWPB-QGZVFWFLSA-N 0 3 339.439 3.656 20 5 EHBDHN CC(C)(C)OC(=O)CCCCNCc1cc([N+](=O)[O-])ccc1Cl ZINC000773429641 1132522699 /nfs/dbraw/zinc/52/26/99/1132522699.db2.gz VAFCKNORIVGYKZ-UHFFFAOYSA-N 0 3 342.823 3.850 20 5 EHBDHN CC[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1cc(C)ccc1C ZINC001175362163 1132650018 /nfs/dbraw/zinc/65/00/18/1132650018.db2.gz RKRKEOPDAUUNEW-INIZCTEOSA-N 0 3 341.411 3.891 20 5 EHBDHN C[C@H](c1ccccc1)[C@H](CO)NCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000766967255 1132924360 /nfs/dbraw/zinc/92/43/60/1132924360.db2.gz IGQNOMCBQIYNBI-WBMJQRKESA-N 0 3 334.803 3.502 20 5 EHBDHN CC(C)CC[C@@H]1CCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767758652 1133048718 /nfs/dbraw/zinc/04/87/18/1133048718.db2.gz DUXWZSMKXMYGAK-INIZCTEOSA-N 0 3 343.431 3.711 20 5 EHBDHN CCN(CC)[C@H](CNCc1cccc([N+](=O)[O-])c1C)c1ccco1 ZINC001177554217 1133074922 /nfs/dbraw/zinc/07/49/22/1133074922.db2.gz QECFLXCRQBFVTF-QGZVFWFLSA-N 0 3 331.416 3.669 20 5 EHBDHN CCO[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2OC)C12CCCCC2 ZINC001170001414 1133241295 /nfs/dbraw/zinc/24/12/95/1133241295.db2.gz KODWAIVWIVCRNR-QZTJIDSGSA-N 0 3 348.443 3.821 20 5 EHBDHN C[C@@H]1COC[C@H]1NCc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001179644935 1133265655 /nfs/dbraw/zinc/26/56/55/1133265655.db2.gz AQHBBWLNBTUIFF-QMTHXVAHSA-N 0 3 336.775 3.633 20 5 EHBDHN CO[C@@](C)(CNCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 ZINC001181871606 1133544174 /nfs/dbraw/zinc/54/41/74/1133544174.db2.gz XGSCIXHQTFCLGD-KRWDZBQOSA-N 0 3 334.803 3.900 20 5 EHBDHN CO[C@H](c1ccccc1F)[C@H](C)N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788688723 1134157534 /nfs/dbraw/zinc/15/75/34/1134157534.db2.gz GTQQPQPTWQVQQF-PZROIBLQSA-N 0 3 347.390 3.743 20 5 EHBDHN CC(C)C[C@@H]1OCCC[C@H]1NCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775870918 1135833401 /nfs/dbraw/zinc/83/34/01/1135833401.db2.gz OWKKFTWLKSKOBC-ZBFHGGJFSA-N 0 3 326.824 3.932 20 5 EHBDHN CCOC(=O)C[C@](C)(NCc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC000775894917 1135860597 /nfs/dbraw/zinc/86/05/97/1135860597.db2.gz KOFMWXPOINDFDJ-INIZCTEOSA-N 0 3 342.823 3.706 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CNC[C@@]2(CO)C[C@@H]2c2ccccc2)c1 ZINC000810165505 1135929678 /nfs/dbraw/zinc/92/96/78/1135929678.db2.gz URSKPJDDCSLDJD-SJLPKXTDSA-N 0 3 346.814 3.504 20 5 EHBDHN C[C@@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CN1C1CC1 ZINC000811484364 1136092079 /nfs/dbraw/zinc/09/20/79/1136092079.db2.gz VJUBXPBZFORUOO-BXKDBHETSA-N 0 3 344.242 3.616 20 5 EHBDHN Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813109350 1136294200 /nfs/dbraw/zinc/29/42/00/1136294200.db2.gz IXWAMLYDKZCATR-QMMMGPOBSA-N 0 3 340.788 3.594 20 5 EHBDHN Cc1cc(C(=O)OCC(C)[N+](=O)[O-])c(C)n1[C@@H](C)c1ccccc1 ZINC000813111321 1136294479 /nfs/dbraw/zinc/29/44/79/1136294479.db2.gz GLDHHZMRTIPRDT-KGLIPLIRSA-N 0 3 330.384 3.536 20 5 EHBDHN Cc1cc(/C=C\C(=O)OCC(C)[N+](=O)[O-])c(C)n1C1CCCCC1 ZINC000813110323 1136294566 /nfs/dbraw/zinc/29/45/66/1136294566.db2.gz XQLXUXBDQFFDSE-CMUBDUJZSA-N 0 3 334.416 3.832 20 5 EHBDHN CC1(C)CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000776591398 1136453437 /nfs/dbraw/zinc/45/34/37/1136453437.db2.gz MECOHKIAHSLRCG-QZTJIDSGSA-N 0 3 326.396 3.711 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN(Cc2ccccc2F)CC2CC2)c1 ZINC000852563280 1136466721 /nfs/dbraw/zinc/46/67/21/1136466721.db2.gz BEEPYDBKLBOSJR-IBGZPJMESA-N 0 3 344.386 3.680 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CC[C@H](c3cccc(Cl)c3)C2)c1 ZINC000814667696 1136492233 /nfs/dbraw/zinc/49/22/33/1136492233.db2.gz VDVXLLXOYROSNY-YJBOKZPZSA-N 0 3 346.814 3.771 20 5 EHBDHN Cc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(CN(C)C)c1 ZINC000776924411 1136851930 /nfs/dbraw/zinc/85/19/30/1136851930.db2.gz BFKFDXROWWVLDA-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@](O)(c2ccccc2)C1 ZINC000859586368 1137021344 /nfs/dbraw/zinc/02/13/44/1137021344.db2.gz NNUFMVNEJLHNMS-DNVCBOLYSA-N 0 3 326.396 3.639 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(CCN(C)C)C1CCCCC1 ZINC001143964087 1137219647 /nfs/dbraw/zinc/21/96/47/1137219647.db2.gz DZCGSUMSPJOEET-UHFFFAOYSA-N 0 3 347.459 3.548 20 5 EHBDHN CC([C@H](OC(=O)CCCC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845872963 1137316276 /nfs/dbraw/zinc/31/62/76/1137316276.db2.gz AYGJOZCIBRRYQN-ZANVPECISA-N 0 3 337.269 3.808 20 5 EHBDHN Cc1sccc1CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845880017 1137316835 /nfs/dbraw/zinc/31/68/35/1137316835.db2.gz JXXVBKGLANAQSY-HWPZZCPQSA-N 0 3 337.372 3.688 20 5 EHBDHN C[C@@H](N[C@H](C)c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000121154332 1137369616 /nfs/dbraw/zinc/36/96/16/1137369616.db2.gz KQFUHCNSZZNGOJ-VXGBXAGGSA-N 0 3 347.802 3.926 20 5 EHBDHN C[C@H](O)C[C@H](CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872043226 1137567342 /nfs/dbraw/zinc/56/73/42/1137567342.db2.gz HPAYUNWATDAJJP-OFQRWUPVSA-N 0 3 346.402 3.939 20 5 EHBDHN C[C@@H](NCCCCC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872053407 1137568247 /nfs/dbraw/zinc/56/82/47/1137568247.db2.gz JXIDURYROWBJOG-GFCCVEGCSA-N 0 3 340.395 3.897 20 5 EHBDHN CC(C)n1ncc2c1C[C@H](N[C@H](C)c1c(F)cccc1[N+](=O)[O-])CC2 ZINC000872067618 1137569502 /nfs/dbraw/zinc/56/95/02/1137569502.db2.gz ZSUOUTRZRMOIPS-TZMCWYRMSA-N 0 3 346.406 3.719 20 5 EHBDHN C[C@@H](Cc1ccco1)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000876917364 1137665357 /nfs/dbraw/zinc/66/53/57/1137665357.db2.gz ROLVQHJZPKMSCU-QMMMGPOBSA-N 0 3 345.218 3.733 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1nnc(CN2CC[C@@H](C3CCCC3)C2)o1 ZINC000878720967 1137726107 /nfs/dbraw/zinc/72/61/07/1137726107.db2.gz RMORJGIZDKGSFJ-CQSZACIVSA-N 0 3 342.399 3.657 20 5 EHBDHN C[C@@H]1CC[C@@H](NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000119245146 1137939531 /nfs/dbraw/zinc/93/95/31/1137939531.db2.gz GXQJTLBXQIGZSW-LALPHHSUSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@H]1CC(C)(C)CC[C@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120775511 1137952417 /nfs/dbraw/zinc/95/24/17/1137952417.db2.gz NBQBXQLKNNLRII-SWLSCSKDSA-N 0 3 344.415 3.949 20 5 EHBDHN CN(Cc1csc2ccccc12)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136940716 1138044317 /nfs/dbraw/zinc/04/43/17/1138044317.db2.gz DUHZAHACEOHTIE-QGZVFWFLSA-N 0 3 342.420 3.975 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000152570094 1139098758 /nfs/dbraw/zinc/09/87/58/1139098758.db2.gz DLYYNJPGUGGIDL-BBRMVZONSA-N 0 3 347.415 3.540 20 5 EHBDHN CCOc1ccc([C@H](C)NCc2cccc(N(C)C)c2)cc1[N+](=O)[O-] ZINC000153573944 1139142586 /nfs/dbraw/zinc/14/25/86/1139142586.db2.gz AXAQCAYVNXTYNM-AWEZNQCLSA-N 0 3 343.427 3.910 20 5 EHBDHN CCC[C@H]1CCCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000185865707 1140174171 /nfs/dbraw/zinc/17/41/71/1140174171.db2.gz GIMJCOKFJFJNJP-AWEZNQCLSA-N 0 3 330.388 3.799 20 5 EHBDHN C[C@@H](CO)NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000266142435 1140647271 /nfs/dbraw/zinc/64/72/71/1140647271.db2.gz HSWYFFJAFDHXFU-NSHDSACASA-N 0 3 336.775 3.511 20 5 EHBDHN C[C@H](NC[C@H](O)c1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000266781855 1140723801 /nfs/dbraw/zinc/72/38/01/1140723801.db2.gz NEASNZXHJZMKDP-BONVTDFDSA-N 0 3 338.766 3.772 20 5 EHBDHN CC(C)n1cnnc1[C@@H]1CCCN([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000266924398 1140738079 /nfs/dbraw/zinc/73/80/79/1140738079.db2.gz MUKRJPMPPQTOKN-LSDHHAIUSA-N 0 3 343.431 3.708 20 5 EHBDHN CCc1nc(C)c([C@H](C)N(C)C[C@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625587 1141128733 /nfs/dbraw/zinc/12/87/33/1141128733.db2.gz CJVFZWRAJVFQOA-WFASDCNBSA-N 0 3 349.456 3.649 20 5 EHBDHN O=[N+]([O-])c1cc(CNC2CCC(O)(c3ccccc3)CC2)cs1 ZINC000273868872 1141436860 /nfs/dbraw/zinc/43/68/60/1141436860.db2.gz VSJCVXOMXMLLNZ-UHFFFAOYSA-N 0 3 332.425 3.576 20 5 EHBDHN Cc1nnc([C@H](C)N[C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000274238785 1141488550 /nfs/dbraw/zinc/48/85/50/1141488550.db2.gz QNIHOKAUECYERX-NJZAAPMLSA-N 0 3 346.456 3.817 20 5 EHBDHN CC(C)[C@H]1CCCCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000117346966 1015072966 /nfs/dbraw/zinc/07/29/66/1015072966.db2.gz NTOQKCUDNVCIKN-OAHLLOKOSA-N 0 3 330.388 3.655 20 5 EHBDHN C[C@@]1(NCc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCO[C@@H]1C1CC1 ZINC000559150639 1015172784 /nfs/dbraw/zinc/17/27/84/1015172784.db2.gz YJRZYLLQKNMAIZ-HUUCEWRRSA-N 0 3 344.333 3.661 20 5 EHBDHN C[C@H]1CCC[C@@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001167226897 1016662716 /nfs/dbraw/zinc/66/27/16/1016662716.db2.gz DJIBNAFALYIQGT-WCQYABFASA-N 0 3 339.823 3.697 20 5 EHBDHN CC(C)n1cc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449494381 1032658127 /nfs/dbraw/zinc/65/81/27/1032658127.db2.gz AOHBXNHZMDTMPE-QGZVFWFLSA-N 0 3 328.416 3.752 20 5 EHBDHN O=[N+]([O-])c1cnn(CCN2CCCCC[C@H]2/C=C/c2cccs2)c1 ZINC000543990651 1017117926 /nfs/dbraw/zinc/11/79/26/1017117926.db2.gz PLWRAYHAXWYARI-KIUWMYQTSA-N 0 3 346.456 3.811 20 5 EHBDHN COc1ccc([C@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])C2CC2)cn1 ZINC000599095555 1017325767 /nfs/dbraw/zinc/32/57/67/1017325767.db2.gz GXGZCFZBSHKVNZ-QFBILLFUSA-N 0 3 339.395 3.727 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@H](n2ncc3ccccc32)C1 ZINC000513412991 1019644162 /nfs/dbraw/zinc/64/41/62/1019644162.db2.gz FQJGSDCNOXFQJS-MOTZXUDYSA-N 0 3 348.406 3.905 20 5 EHBDHN COCC(C)(C)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000426314730 1021245267 /nfs/dbraw/zinc/24/52/67/1021245267.db2.gz QXMBJWVPRACZHO-SFHVURJKSA-N 0 3 328.412 3.946 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(CCO)Cc1cccc(F)c1 ZINC000426368920 1021396451 /nfs/dbraw/zinc/39/64/51/1021396451.db2.gz CHRNBRSMMGTUMP-XNTDXEJSSA-N 0 3 344.386 3.632 20 5 EHBDHN CCCCN(Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@H](C)CC ZINC000172895314 1033001044 /nfs/dbraw/zinc/00/10/44/1033001044.db2.gz HILLBUJZHDGFTR-CQSZACIVSA-N 0 3 331.420 3.711 20 5 EHBDHN C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000090920825 1021819528 /nfs/dbraw/zinc/81/95/28/1021819528.db2.gz BWEJWJDXYGWFEP-QFYYESIMSA-N 0 3 338.766 3.772 20 5 EHBDHN CC1(NCc2nc3cc([N+](=O)[O-])ccc3o2)CCC(F)(F)CC1 ZINC000602609446 1033026051 /nfs/dbraw/zinc/02/60/51/1033026051.db2.gz PTHWMOJQNUAAAT-UHFFFAOYSA-N 0 3 325.315 3.794 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548336454 1022376122 /nfs/dbraw/zinc/37/61/22/1022376122.db2.gz JTMBQUVGXPWYQY-HUUCEWRRSA-N 0 3 340.427 3.678 20 5 EHBDHN C[C@H]1CCC[C@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000026468241 1033054064 /nfs/dbraw/zinc/05/40/64/1033054064.db2.gz UUHSYJINJVXCEZ-AAEUAGOBSA-N 0 3 339.823 3.697 20 5 EHBDHN CCNC(=O)c1ccc(CN[C@@H](CC)c2cccc([N+](=O)[O-])c2)cc1 ZINC000156528402 1022513086 /nfs/dbraw/zinc/51/30/86/1022513086.db2.gz PRLKUVBDLRZHRA-SFHVURJKSA-N 0 3 341.411 3.585 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc(-n2cncn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178325508 1022669183 /nfs/dbraw/zinc/66/91/83/1022669183.db2.gz IVXIAYLPIPWLEZ-UONOGXRCSA-N 0 3 337.383 3.587 20 5 EHBDHN COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])c(C)c2)N(C)C)c1 ZINC000058940587 1033081843 /nfs/dbraw/zinc/08/18/43/1033081843.db2.gz UTANRYRFHVJXRH-GOSISDBHSA-N 0 3 329.400 3.627 20 5 EHBDHN CC(C)(C)C[C@@H]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000449769840 1033184851 /nfs/dbraw/zinc/18/48/51/1033184851.db2.gz COYCVBHBQCCXKR-ZDUSSCGKSA-N 0 3 334.416 3.719 20 5 EHBDHN CCOC(=O)CC1(NCc2ccc(Cl)cc2[N+](=O)[O-])CCCC1 ZINC000434616602 1024203621 /nfs/dbraw/zinc/20/36/21/1024203621.db2.gz RDVRFBPDDGKHOY-UHFFFAOYSA-N 0 3 340.807 3.604 20 5 EHBDHN C[C@@H]1CC[C@H](NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000119456187 1024249490 /nfs/dbraw/zinc/24/94/90/1024249490.db2.gz BKIHHQNVFDFWMQ-JMSVASOKSA-N 0 3 330.388 3.559 20 5 EHBDHN O=[N+]([O-])c1cnccc1S[C@H]1CCCN(Cc2ccccc2)C1 ZINC000425281076 1024623601 /nfs/dbraw/zinc/62/36/01/1024623601.db2.gz LGDSEZZBYMTZSW-HNNXBMFYSA-N 0 3 329.425 3.747 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@@H](CCO)c1ccc(Cl)cc1 ZINC000342293441 1024740062 /nfs/dbraw/zinc/74/00/62/1024740062.db2.gz GLMLJIDRUSTZEU-IVZVJUQRSA-N 0 3 346.814 3.975 20 5 EHBDHN CC[C@@H]1CN(Cc2cc(=O)oc3ccc4ccccc4c23)CCCO1 ZINC000281308157 1024873420 /nfs/dbraw/zinc/87/34/20/1024873420.db2.gz HUSLGUPQFZAQQS-QGZVFWFLSA-N 0 3 337.419 3.947 20 5 EHBDHN CCCCNC(=O)C1(NCc2ccc([N+](=O)[O-])cc2C)CCCCC1 ZINC000428103464 1024982572 /nfs/dbraw/zinc/98/25/72/1024982572.db2.gz QOVDKZNNWQJBHV-UHFFFAOYSA-N 0 3 347.459 3.612 20 5 EHBDHN CC[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000738417610 1026075924 /nfs/dbraw/zinc/07/59/24/1026075924.db2.gz RAQBFCDBVOTHAZ-IRXDYDNUSA-N 0 3 336.338 3.647 20 5 EHBDHN CC(C)C[C@H]1OCCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1Cl ZINC000479581134 1026709060 /nfs/dbraw/zinc/70/90/60/1026709060.db2.gz RGBALOZMLPGJPE-JKSUJKDBSA-N 0 3 326.824 3.932 20 5 EHBDHN O=[N+]([O-])c1cc(CNCCc2nc(-c3ccncc3)cs2)cs1 ZINC000344558071 1027237084 /nfs/dbraw/zinc/23/70/84/1027237084.db2.gz XKYLPGRDWNJGGR-UHFFFAOYSA-N 0 3 346.437 3.507 20 5 EHBDHN CC(C)c1nc(C2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)no1 ZINC000366647925 1027665181 /nfs/dbraw/zinc/66/51/81/1027665181.db2.gz YTLRFUOBQFRAJZ-UHFFFAOYSA-N 0 3 344.415 3.523 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nnc(CN3CC[C@@H](C4CCCC4)C3)o2)cc1 ZINC000420963899 1027932449 /nfs/dbraw/zinc/93/24/49/1027932449.db2.gz OPERNAAHVNPTSL-OAHLLOKOSA-N 0 3 342.399 3.657 20 5 EHBDHN CC[C@@H](NCc1ccc2c(c1)OCCCO2)c1cccc([N+](=O)[O-])c1 ZINC000161920979 1028360134 /nfs/dbraw/zinc/36/01/34/1028360134.db2.gz MVFDDLNXNFJVDM-QGZVFWFLSA-N 0 3 342.395 3.997 20 5 EHBDHN CC(=O)c1cc(N[C@H](C)[C@@H](c2ccccc2)N(C)C)ccc1[N+](=O)[O-] ZINC000572898103 1028365596 /nfs/dbraw/zinc/36/55/96/1028365596.db2.gz LFBMXHPQLLNHKW-YJYMSZOUSA-N 0 3 341.411 3.901 20 5 EHBDHN CCC[C@@H](N[C@@H]1CCCc2c1cnn2C)c1cccc([N+](=O)[O-])c1 ZINC000268838644 1028600880 /nfs/dbraw/zinc/60/08/80/1028600880.db2.gz SZOSBIKPZFXMPN-IAGOWNOFSA-N 0 3 328.416 3.837 20 5 EHBDHN CCC[C@@H]1[C@@H](C)CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066369 1029235556 /nfs/dbraw/zinc/23/55/56/1029235556.db2.gz WSJVREGQZGKCNL-SUMWQHHRSA-N 0 3 334.416 3.862 20 5 EHBDHN CN(C)c1cccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000447540197 1030275497 /nfs/dbraw/zinc/27/54/97/1030275497.db2.gz JCYHWBSIDUAFGK-IBGZPJMESA-N 0 3 325.412 3.828 20 5 EHBDHN CN(C)c1ccccc1CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447589618 1030327423 /nfs/dbraw/zinc/32/74/23/1030327423.db2.gz YOKRNECKCDHKOX-GOSISDBHSA-N 0 3 325.412 3.828 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@]2(C1)OCc1ccccc12 ZINC000482383577 1030364693 /nfs/dbraw/zinc/36/46/93/1030364693.db2.gz YRDPTKGZIUOMDB-HXUWFJFHSA-N 0 3 338.407 3.925 20 5 EHBDHN CCC[C@@H](C)[C@H]1CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267978 1030514988 /nfs/dbraw/zinc/51/49/88/1030514988.db2.gz PLWBTDCXRCYIBG-CXAGYDPISA-N 0 3 334.416 3.862 20 5 EHBDHN CN(CCc1nccs1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093843892 1030683304 /nfs/dbraw/zinc/68/33/04/1030683304.db2.gz IYXCANXIOUUHRK-UHFFFAOYSA-N 0 3 343.408 3.986 20 5 EHBDHN CN(C)c1cccc(CN(C)C/C=C/c2ccccc2[N+](=O)[O-])c1 ZINC000537659796 1030914384 /nfs/dbraw/zinc/91/43/84/1030914384.db2.gz RHTRPGLZJITJGS-JXMROGBWSA-N 0 3 325.412 3.806 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)Cc1cccc(F)c1 ZINC000026223908 1031386530 /nfs/dbraw/zinc/38/65/30/1031386530.db2.gz IQFBRORHHPKLPI-UHFFFAOYSA-N 0 3 345.374 3.503 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H](c1cccs1)N(C)C ZINC000595002906 1033627432 /nfs/dbraw/zinc/62/74/32/1033627432.db2.gz BEKHWQSRNHYPAX-WFASDCNBSA-N 0 3 349.456 3.618 20 5 EHBDHN C[C@@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCCCO1 ZINC000599044670 1033672971 /nfs/dbraw/zinc/67/29/71/1033672971.db2.gz RYDJUNZYWTUKPW-YGRLFVJLSA-N 0 3 332.322 3.661 20 5 EHBDHN O=[N+]([O-])c1ccc(CCN2CC3(CCOCC3)[C@@H]2c2ccco2)cc1 ZINC000595715488 1033959546 /nfs/dbraw/zinc/95/95/46/1033959546.db2.gz AKXRIPKPGVBMBX-SFHVURJKSA-N 0 3 342.395 3.584 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN(Cc1cccc(F)c1)C1CC1 ZINC000603859150 1033983304 /nfs/dbraw/zinc/98/33/04/1033983304.db2.gz GSKVQSUUEMEMDI-UHFFFAOYSA-N 0 3 330.359 3.777 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC2CC(OCc3ccccc3)C2)c(F)c1 ZINC000613283260 1035489320 /nfs/dbraw/zinc/48/93/20/1035489320.db2.gz BIUMSESHDNLMTB-UHFFFAOYSA-N 0 3 330.359 3.571 20 5 EHBDHN CN1CC[C@@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000571573351 1035538463 /nfs/dbraw/zinc/53/84/63/1035538463.db2.gz RJBZRLUDQCVAFT-SJLPKXTDSA-N 0 3 345.830 3.783 20 5 EHBDHN C[C@]12CN(Cc3nc4cc([N+](=O)[O-])ccc4o3)C[C@H]1[C@@H]1CC[C@H]2C1 ZINC000582401933 1035751645 /nfs/dbraw/zinc/75/16/45/1035751645.db2.gz PVUKRJFHFOXQEH-BKTMZONDSA-N 0 3 327.384 3.604 20 5 EHBDHN C[C@@H](NCc1ccc(N2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000122138113 1035814259 /nfs/dbraw/zinc/81/42/59/1035814259.db2.gz MQZVJWMHTOKLLU-CQSZACIVSA-N 0 3 339.395 3.572 20 5 EHBDHN CCC(CC)N(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000165380951 1036440862 /nfs/dbraw/zinc/44/08/62/1036440862.db2.gz NVFTVPHFOSOFJG-UHFFFAOYSA-N 0 3 330.388 3.798 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000589518868 1036489020 /nfs/dbraw/zinc/48/90/20/1036489020.db2.gz XERZGQCLGKBYTM-HXUWFJFHSA-N 0 3 338.407 3.873 20 5 EHBDHN CCOc1ccccc1OCCN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180406109 1036781039 /nfs/dbraw/zinc/78/10/39/1036781039.db2.gz CMTSMRNBLYSJGI-CQSZACIVSA-N 0 3 330.384 3.723 20 5 EHBDHN Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)n1 ZINC000541935855 1036862140 /nfs/dbraw/zinc/86/21/40/1036862140.db2.gz NAETWWQEKLWUHA-DOTOQJQBSA-N 0 3 340.427 3.854 20 5 EHBDHN C[C@H](NCc1ccc(Cn2cccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000180888050 1037284778 /nfs/dbraw/zinc/28/47/78/1037284778.db2.gz BUJXNGGBVBRQRP-HNNXBMFYSA-N 0 3 336.395 3.690 20 5 EHBDHN C[C@@H](NCc1cn(C)nc1-c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000181033638 1037401489 /nfs/dbraw/zinc/40/14/89/1037401489.db2.gz ULLBQGQGAUAUTG-CQSZACIVSA-N 0 3 336.395 3.846 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000532470204 1037413947 /nfs/dbraw/zinc/41/39/47/1037413947.db2.gz CFUNJGIUYAJXOM-OWQGQXMQSA-N 0 3 345.443 3.742 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[C@H](C)CC1 ZINC000249836048 1037610671 /nfs/dbraw/zinc/61/06/71/1037610671.db2.gz RXSDBQYYTWVLNO-QWHCGFSZSA-N 0 3 330.388 3.828 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN[C@@H]2CCc3c2c(F)ccc3F)cc1 ZINC000540183210 1037666397 /nfs/dbraw/zinc/66/63/97/1037666397.db2.gz YTURRHSWQGGEBX-MRXNPFEDSA-N 0 3 334.322 3.529 20 5 EHBDHN Cc1ccc([C@H](C)NC(=O)[C@@H](C(C)C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000488052305 1038809364 /nfs/dbraw/zinc/80/93/64/1038809364.db2.gz CAAVDNCDDZIRIV-MAUKXSAKSA-N 0 3 347.459 3.591 20 5 EHBDHN Cc1c(CN[C@H](C)CC(=O)Nc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000478475779 1039482377 /nfs/dbraw/zinc/48/23/77/1039482377.db2.gz ADEOIYOCKFSYNH-GFCCVEGCSA-N 0 3 345.374 3.549 20 5 EHBDHN CCOCc1ccccc1CN[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000566473382 1039711807 /nfs/dbraw/zinc/71/18/07/1039711807.db2.gz APISDCLVWJVGFM-GOSISDBHSA-N 0 3 326.396 3.908 20 5 EHBDHN COc1cc(N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991066 1039763581 /nfs/dbraw/zinc/76/35/81/1039763581.db2.gz BOYFCGANNOVSKY-KBXCAEBGSA-N 0 3 345.374 3.600 20 5 EHBDHN COc1cc(N[C@H]2CCN(C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991070 1039764421 /nfs/dbraw/zinc/76/44/21/1039764421.db2.gz BOYFCGANNOVSKY-KSSFIOAISA-N 0 3 345.374 3.600 20 5 EHBDHN COc1cc(CN2CC[C@@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000490031075 1040299321 /nfs/dbraw/zinc/29/93/21/1040299321.db2.gz NKLOBAOYFVQVLA-OAHLLOKOSA-N 0 3 330.359 3.732 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCN2CC=CCC2)c2ccccc2)c1 ZINC000479526426 1040323354 /nfs/dbraw/zinc/32/33/54/1040323354.db2.gz MJOWCBPRGPLYFH-FQEVSTJZSA-N 0 3 337.423 3.536 20 5 EHBDHN COc1ccc(CN(C)CCc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000512687361 1040539800 /nfs/dbraw/zinc/53/98/00/1040539800.db2.gz QICDKEMJDAJRKL-UHFFFAOYSA-N 0 3 334.803 3.931 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@H](C)c2ccc(NC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000192847059 1040574717 /nfs/dbraw/zinc/57/47/17/1040574717.db2.gz LQPGOCDWAWMIPC-CHWSQXEVSA-N 0 3 342.399 3.806 20 5 EHBDHN Cc1nc2c(s1)[C@H](N(C)CCOc1ccccc1[N+](=O)[O-])CCC2 ZINC000111311635 1042261119 /nfs/dbraw/zinc/26/11/19/1042261119.db2.gz XPFUJEKIFQLAKF-OAHLLOKOSA-N 0 3 347.440 3.748 20 5 EHBDHN COc1cc(C)c(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000083474257 1127367437 /nfs/dbraw/zinc/36/74/37/1127367437.db2.gz YMJOSCDWYWLUCU-UHFFFAOYSA-N 0 3 344.411 3.945 20 5 EHBDHN CC[C@H](C)CN(CC)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283258 1127473763 /nfs/dbraw/zinc/47/37/63/1127473763.db2.gz PFKBJQOHBYXWMX-NWDGAFQWSA-N 0 3 341.839 3.943 20 5 EHBDHN Cc1ccccc1[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C ZINC000091350138 1128642383 /nfs/dbraw/zinc/64/23/83/1128642383.db2.gz NYDSDCZNPLVQHN-LJQANCHMSA-N 0 3 341.411 3.829 20 5 EHBDHN O=[N+]([O-])c1ccccc1CCNCc1sccc1Br ZINC000148179881 1120196235 /nfs/dbraw/zinc/19/62/35/1120196235.db2.gz NAZZCLULYQYBJB-UHFFFAOYSA-N 0 3 341.230 3.751 20 5 EHBDHN CCC[C@H](O)CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000112377571 1128920846 /nfs/dbraw/zinc/92/08/46/1128920846.db2.gz YTPJCIXTKITHIK-HNNXBMFYSA-N 0 3 348.374 3.777 20 5 EHBDHN CC(C)CN(Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)CC(C)(C)C ZINC000761831864 1120975874 /nfs/dbraw/zinc/97/58/74/1120975874.db2.gz QJRFSBYIWLRGHS-UHFFFAOYSA-N 0 3 345.447 3.815 20 5 EHBDHN O=[N+]([O-])c1ccc(NCCN2CCc3ccccc3C2)c2ccncc21 ZINC000301073807 1121361112 /nfs/dbraw/zinc/36/11/12/1121361112.db2.gz MLYPESYPTODRTR-UHFFFAOYSA-N 0 3 348.406 3.613 20 5 EHBDHN CCC1CCC(N(C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000921045887 1123458684 /nfs/dbraw/zinc/45/86/84/1123458684.db2.gz HDEVUTQHSIJFLU-UHFFFAOYSA-N 0 3 343.431 3.711 20 5 EHBDHN CCOc1cc(CN2CCC[C@@H](C[C@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216825 1124100458 /nfs/dbraw/zinc/10/04/58/1124100458.db2.gz ZQJWZVYOHHMWIH-DOTOQJQBSA-N 0 3 348.443 3.632 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CC(C3CCOCC3)C2)o1 ZINC000619726552 1125390198 /nfs/dbraw/zinc/39/01/98/1125390198.db2.gz GRJPPLZOUHRQQL-UHFFFAOYSA-N 0 3 342.395 3.713 20 5 EHBDHN Cc1ccc(CN2CC[C@@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000093684041 1129599499 /nfs/dbraw/zinc/59/94/99/1129599499.db2.gz ZIKOPFBZNSIWJH-LJQANCHMSA-N 0 3 340.423 3.942 20 5 EHBDHN CCOC(=O)CC[C@@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000162044414 1129796666 /nfs/dbraw/zinc/79/66/66/1129796666.db2.gz CNUYOTNLQMSFMT-GJZGRUSLSA-N 0 3 334.416 3.711 20 5 EHBDHN Cc1cccc(F)c1CN[C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000766215175 1131411513 /nfs/dbraw/zinc/41/15/13/1131411513.db2.gz FPRGEVNZFJSVFC-ZDUSSCGKSA-N 0 3 345.374 3.549 20 5 EHBDHN C[C@@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)c1cccc([N+](=O)[O-])c1 ZINC000173328765 1130207966 /nfs/dbraw/zinc/20/79/66/1130207966.db2.gz YVWLGZGODDJRDQ-CHWSQXEVSA-N 0 3 339.395 3.891 20 5 EHBDHN C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(-n2ccnn2)c1 ZINC000348082830 1131150198 /nfs/dbraw/zinc/15/01/98/1131150198.db2.gz TZTHCZVPPGSGMK-KGLIPLIRSA-N 0 3 337.383 3.587 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@H](NCc1nc3ccccc3o1)CC2 ZINC001172895689 1131900724 /nfs/dbraw/zinc/90/07/24/1131900724.db2.gz HLIRZFVUMWDJAC-OAHLLOKOSA-N 0 3 337.379 3.773 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NC(C)(C)c2ccccn2)c1F ZINC001173182114 1131994022 /nfs/dbraw/zinc/99/40/22/1131994022.db2.gz HLLMXMLFMBLCRK-LBPRGKRZSA-N 0 3 347.390 3.593 20 5 EHBDHN O=[N+]([O-])c1ccc2cnn(CN(CCc3ccccc3)C3CC3)c2c1 ZINC000746022518 1132350033 /nfs/dbraw/zinc/35/00/33/1132350033.db2.gz CXXNHHKPOJTHTE-UHFFFAOYSA-N 0 3 336.395 3.609 20 5 EHBDHN CCc1ccccc1-c1nc(CN[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cs1 ZINC001169006394 1132630317 /nfs/dbraw/zinc/63/03/17/1132630317.db2.gz HPBKZQHOBZSZBO-UKRRQHHQSA-N 0 3 345.468 3.908 20 5 EHBDHN CC(C)CSCCNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001178412161 1133167500 /nfs/dbraw/zinc/16/75/00/1133167500.db2.gz DVTCXTFSIBMHEG-UHFFFAOYSA-N 0 3 334.388 3.675 20 5 EHBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1nccc2c1CCCC2 ZINC001181696904 1133518591 /nfs/dbraw/zinc/51/85/91/1133518591.db2.gz CYYLBDXQZNRYAS-UHFFFAOYSA-N 0 3 325.412 3.543 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@H](O)c1c(F)cccc1F)CCC2 ZINC000774249577 1133643341 /nfs/dbraw/zinc/64/33/41/1133643341.db2.gz BUIJDVPDHDRKSJ-SJORKVTESA-N 0 3 348.349 3.574 20 5 EHBDHN CC[C@H](C)C[C@@H](CO)NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001182519790 1133692376 /nfs/dbraw/zinc/69/23/76/1133692376.db2.gz BQHLDDXUVRMXNI-GWCFXTLKSA-N 0 3 334.338 3.500 20 5 EHBDHN CC[C@@H](C)C[C@H](CO)NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001182519796 1133692511 /nfs/dbraw/zinc/69/25/11/1133692511.db2.gz BQHLDDXUVRMXNI-ZWNOBZJWSA-N 0 3 334.338 3.500 20 5 EHBDHN COc1ccc(F)cc1CCNCc1ccc([N+](=O)[O-])cc1Cl ZINC001183811282 1133856231 /nfs/dbraw/zinc/85/62/31/1133856231.db2.gz HTYGKLCWMFUVKP-UHFFFAOYSA-N 0 3 338.766 3.728 20 5 EHBDHN O=[N+]([O-])c1cc(CN2CCCC[C@@H]([C@@H]3CCOC3)C2)ccc1Cl ZINC001198563867 1135831073 /nfs/dbraw/zinc/83/10/73/1135831073.db2.gz TXPOPYPMTOLTCL-HUUCEWRRSA-N 0 3 338.835 3.887 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC1(CO)CCCC1 ZINC000811491097 1136093474 /nfs/dbraw/zinc/09/34/74/1136093474.db2.gz ZVBXMJAFYSSFCE-UHFFFAOYSA-N 0 3 333.215 3.544 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCCOCC1CC1 ZINC000811472207 1136095034 /nfs/dbraw/zinc/09/50/34/1136095034.db2.gz AKLODTYWXRHPHN-UHFFFAOYSA-N 0 3 333.215 3.808 20 5 EHBDHN CC(COC(=O)[C@H](C)Sc1cc(Cl)ccc1Cl)[N+](=O)[O-] ZINC000813109784 1136294031 /nfs/dbraw/zinc/29/40/31/1136294031.db2.gz OKJBRONJRWXFSC-YUMQZZPRSA-N 0 3 338.212 3.682 20 5 EHBDHN CC(COC(=O)c1cccc(F)c1Sc1ccccc1)[N+](=O)[O-] ZINC000813110274 1136294916 /nfs/dbraw/zinc/29/49/16/1136294916.db2.gz WJHPAFMPCHERPG-LLVKDONJSA-N 0 3 335.356 3.799 20 5 EHBDHN CC(C)c1ccc(-c2nc(C(=O)OCC(C)[N+](=O)[O-])cs2)cc1 ZINC000813113684 1136294925 /nfs/dbraw/zinc/29/49/25/1136294925.db2.gz HUKSWYCYZZIVBW-NSHDSACASA-N 0 3 334.397 3.756 20 5 EHBDHN C[C@@H](NC[C@@H](O)c1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1 ZINC000815081446 1136548581 /nfs/dbraw/zinc/54/85/81/1136548581.db2.gz DTGZEUOQXQJNES-MLGOLLRUSA-N 0 3 326.352 3.725 20 5 EHBDHN Cc1c(F)nccc1CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000862386279 1137141848 /nfs/dbraw/zinc/14/18/48/1137141848.db2.gz NWOGDGWHAHFELY-INIZCTEOSA-N 0 3 329.375 3.817 20 5 EHBDHN CS[C@H](C)CCC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874963 1137316527 /nfs/dbraw/zinc/31/65/27/1137316527.db2.gz JCEDMSBEIHTZQS-UEKVPHQBSA-N 0 3 329.393 3.607 20 5 EHBDHN CC([C@H](OC(=O)[C@H](C)c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881188 1137316701 /nfs/dbraw/zinc/31/67/01/1137316701.db2.gz ZENLTFVNDZVPQR-IGCXYCKISA-N 0 3 331.343 3.879 20 5 EHBDHN CC([C@@H](OC(=O)[C@H](C)CC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845883761 1137317017 /nfs/dbraw/zinc/31/70/17/1137317017.db2.gz VUFKYQPCMOTCJO-KBVBSXBZSA-N 0 3 337.269 3.664 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](O)c1ccccc1Cl ZINC000773011003 1137459211 /nfs/dbraw/zinc/45/92/11/1137459211.db2.gz QQJVHGFYNSZALU-SJCJKPOMSA-N 0 3 334.803 3.941 20 5 EHBDHN C[C@H](NC[C@H]1CCN(c2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020793 1137565128 /nfs/dbraw/zinc/56/51/28/1137565128.db2.gz KKPINGGUGNTMOU-LSDHHAIUSA-N 0 3 343.402 3.911 20 5 EHBDHN C[C@@H](N[C@@H](C)CC(=O)N(C)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000872129789 1137573076 /nfs/dbraw/zinc/57/30/76/1137573076.db2.gz TZLRSULDVHQSIH-LSDHHAIUSA-N 0 3 341.411 3.687 20 5 EHBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)c1nccnc1C ZINC000872133454 1137573462 /nfs/dbraw/zinc/57/34/62/1137573462.db2.gz MUJNYDNKMCBGII-KBPBESRZSA-N 0 3 346.456 3.915 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000873097789 1137590149 /nfs/dbraw/zinc/59/01/49/1137590149.db2.gz FZHGVGQKFVNBHC-BSEYFRJRSA-N 0 3 346.452 3.800 20 5 EHBDHN Cc1nc(C2C[C@H]3CC[C@@H](C2)N3[C@H](C)c2cccc([N+](=O)[O-])c2)no1 ZINC000879680689 1137755018 /nfs/dbraw/zinc/75/50/18/1137755018.db2.gz VZPJLUSFMLSQMH-GVZPALNKSA-N 0 3 342.399 3.758 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCCC[C@@H](C)C1 ZINC000187991340 1140279675 /nfs/dbraw/zinc/27/96/75/1140279675.db2.gz LJGJAQVSCLQIHB-OLZOCXBDSA-N 0 3 330.388 3.828 20 5 EHBDHN C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269635075 1141129437 /nfs/dbraw/zinc/12/94/37/1141129437.db2.gz AOPCBQVRUAMYFF-APPDUMDISA-N 0 3 336.338 3.599 20 5 EHBDHN COc1cc(CN[C@H]2CCC2(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000349037209 1141626288 /nfs/dbraw/zinc/62/62/88/1141626288.db2.gz RBPZUPRDUISFJB-AWEZNQCLSA-N 0 3 344.358 3.526 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@H]4CCCC[C@@H]43)n2)cc1 ZINC000103266258 1016817637 /nfs/dbraw/zinc/81/76/37/1016817637.db2.gz MMCVKFGFNRHEQZ-CJNGLKHVSA-N 0 3 342.399 3.799 20 5 EHBDHN CCOc1cc(NC[C@H](c2cccs2)N(C)C)ccc1[N+](=O)[O-] ZINC000080763405 1032194804 /nfs/dbraw/zinc/19/48/04/1032194804.db2.gz VXCNBTKGPBZUBJ-CQSZACIVSA-N 0 3 335.429 3.770 20 5 EHBDHN CC[C@H](C[C@H](C)CO)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610345669 1018360422 /nfs/dbraw/zinc/36/04/22/1018360422.db2.gz YGLVEXOWMUJLCN-GXTWGEPZSA-N 0 3 349.456 3.605 20 5 EHBDHN O=[N+]([O-])c1ccc(NC[C@H](c2ccccc2)N2CCCC2)c(F)c1 ZINC000513087554 1018938571 /nfs/dbraw/zinc/93/85/71/1018938571.db2.gz FJCYQRQOXTWGFF-GOSISDBHSA-N 0 3 329.375 3.983 20 5 EHBDHN Cc1ccc(CN2CC[C@]3(C2)CCc2ccccc2O3)cc1[N+](=O)[O-] ZINC000581103328 1020433079 /nfs/dbraw/zinc/43/30/79/1020433079.db2.gz OJSMVNKARAUKBC-FQEVSTJZSA-N 0 3 338.407 3.873 20 5 EHBDHN COc1cc(CNC2CCC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000337338644 1021400461 /nfs/dbraw/zinc/40/04/61/1021400461.db2.gz NYJJHGLXLJNELP-UHFFFAOYSA-N 0 3 342.395 3.825 20 5 EHBDHN COc1cc(CN2CC(C)(C)[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000516670756 1021639501 /nfs/dbraw/zinc/63/95/01/1021639501.db2.gz RHBUNVPQVBMEIP-KGLIPLIRSA-N 0 3 334.416 3.623 20 5 EHBDHN COc1cc(CN[C@@H]2CCCC[C@@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000517029115 1021957376 /nfs/dbraw/zinc/95/73/76/1021957376.db2.gz VNHCWVMZMBKYAI-NWDGAFQWSA-N 0 3 332.322 3.814 20 5 EHBDHN CCNC(=O)c1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000156517302 1022496587 /nfs/dbraw/zinc/49/65/87/1022496587.db2.gz JNFJUGDBOSLXOX-CQSZACIVSA-N 0 3 341.411 3.504 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN(C[C@H]1CCCO1)C1CCCC1 ZINC000441452441 1022866770 /nfs/dbraw/zinc/86/67/70/1022866770.db2.gz XFOQKKOKZYVICG-QGZVFWFLSA-N 0 3 334.416 3.527 20 5 EHBDHN O=[N+]([O-])c1sc(CN[C@@H]2CCCC23CC3)cc1Br ZINC000602727570 1033114379 /nfs/dbraw/zinc/11/43/79/1033114379.db2.gz CXGBFVXPAGRRDW-SNVBAGLBSA-N 0 3 331.235 3.841 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC(c2ccncn2)CC1 ZINC000414473820 1024127312 /nfs/dbraw/zinc/12/73/12/1024127312.db2.gz WJACBSLIIBQEOG-RVDMUPIBSA-N 0 3 338.411 3.668 20 5 EHBDHN C[C@@H]1CN(C2CC2)C[C@H]1Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000514176397 1024202050 /nfs/dbraw/zinc/20/20/50/1024202050.db2.gz PBOYEFHPLSBSDC-NOZJJQNGSA-N 0 3 329.322 3.508 20 5 EHBDHN CCN(CC)[C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000346404119 1024723390 /nfs/dbraw/zinc/72/33/90/1024723390.db2.gz PYLOXXMDCYNEQN-ZDUSSCGKSA-N 0 3 338.795 3.731 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[C@H]([C@H]2CCCO2)C1 ZINC000895844051 1024891796 /nfs/dbraw/zinc/89/17/96/1024891796.db2.gz LOBOKPPTPOVYLV-SWLSCSKDSA-N 0 3 344.333 3.615 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CC[C@H](c3ccc4cccnc4n3)C2)cc1 ZINC000602889921 1033243623 /nfs/dbraw/zinc/24/36/23/1033243623.db2.gz XAMPVCFOVPVQEF-INIZCTEOSA-N 0 3 334.379 3.528 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]1CC(C)(C)C ZINC000435441720 1024928508 /nfs/dbraw/zinc/92/85/08/1024928508.db2.gz HJIQQKIJLYRHQZ-OAHLLOKOSA-N 0 3 333.432 3.742 20 5 EHBDHN O=[N+]([O-])c1sc(CN[C@@H]2C[C@H]3CCC[C@H]32)cc1Br ZINC000897958704 1033259599 /nfs/dbraw/zinc/25/95/99/1033259599.db2.gz MHSGWLQUHKNQQL-BCMRRPTOSA-N 0 3 331.235 3.697 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000515506208 1025317157 /nfs/dbraw/zinc/31/71/57/1025317157.db2.gz OZMQLTRNPRBWEU-AWEZNQCLSA-N 0 3 341.411 3.707 20 5 EHBDHN COC(=O)[C@H](CCN[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000425461757 1025367486 /nfs/dbraw/zinc/36/74/86/1025367486.db2.gz SJOQELMWSYLMHX-WMLDXEAASA-N 0 3 342.395 3.592 20 5 EHBDHN C[C@H]1CCC[C@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467893 1025466025 /nfs/dbraw/zinc/46/60/25/1025466025.db2.gz OHVOOXVKXRUJFQ-RYUDHWBXSA-N 0 3 339.823 3.697 20 5 EHBDHN C[C@H]1CCC[C@@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467880 1025466573 /nfs/dbraw/zinc/46/65/73/1025466573.db2.gz OHVOOXVKXRUJFQ-NWDGAFQWSA-N 0 3 339.823 3.697 20 5 EHBDHN CN(Cc1ccccc1[N+](=O)[O-])[C@H]1CCCN(c2ccccc2)C1 ZINC000531378700 1026848935 /nfs/dbraw/zinc/84/89/35/1026848935.db2.gz WWKMICAQNCWYCF-SFHVURJKSA-N 0 3 325.412 3.696 20 5 EHBDHN Cc1cnc(NC[C@H]2CCCN(C)[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000078668100 1028067371 /nfs/dbraw/zinc/06/73/71/1028067371.db2.gz NRPXYXQGNBOLEV-CJNGLKHVSA-N 0 3 346.456 3.855 20 5 EHBDHN CCC[C@@H]1[C@H](C)CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066366 1029236255 /nfs/dbraw/zinc/23/62/55/1029236255.db2.gz WSJVREGQZGKCNL-CXAGYDPISA-N 0 3 334.416 3.862 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCC[C@H]1CCCC[C@H]1O ZINC000897534341 1029397255 /nfs/dbraw/zinc/39/72/55/1029397255.db2.gz SQNFJVFQADDSTP-IAQYHMDHSA-N 0 3 346.349 3.644 20 5 EHBDHN Cc1ccc([C@@H](C)NCc2ccccc2-n2ccnc2)cc1[N+](=O)[O-] ZINC000152234976 1029802958 /nfs/dbraw/zinc/80/29/58/1029802958.db2.gz LVBXDOKODQBNNV-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN Cc1ccccc1C1CC(NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000446832522 1029816085 /nfs/dbraw/zinc/81/60/85/1029816085.db2.gz BVJWYELILKGHTO-UHFFFAOYSA-N 0 3 336.395 3.815 20 5 EHBDHN CC[C@H](C)N[C@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000343248210 1029883452 /nfs/dbraw/zinc/88/34/52/1029883452.db2.gz IVWJELPYHMRMLP-BLLLJJGKSA-N 0 3 345.399 3.932 20 5 EHBDHN CC(C)C[C@@H]1OCCC[C@@H]1NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481756599 1029905380 /nfs/dbraw/zinc/90/53/80/1029905380.db2.gz NBDYRMSMXFYLAL-HOCLYGCPSA-N 0 3 326.824 3.932 20 5 EHBDHN C[C@H](CC(C)(C)O)N[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453325781 1030109349 /nfs/dbraw/zinc/10/93/49/1030109349.db2.gz RQJFXFMWAADXJG-KDOFPFPSSA-N 0 3 328.412 3.823 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@@H](C)C1CCCCC1 ZINC000447388357 1030156731 /nfs/dbraw/zinc/15/67/31/1030156731.db2.gz WNGOFNNJTIINHJ-AWEZNQCLSA-N 0 3 333.432 3.742 20 5 EHBDHN CC(C)CC[C@H]1CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532013893 1030273625 /nfs/dbraw/zinc/27/36/25/1030273625.db2.gz ZEALOROLMXXQAH-MRXNPFEDSA-N 0 3 334.416 3.862 20 5 EHBDHN C[C@H]1[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)CCCN1C ZINC000343436011 1030867291 /nfs/dbraw/zinc/86/72/91/1030867291.db2.gz LJGSGCBFLROKBB-LIRRHRJNSA-N 0 3 333.435 3.601 20 5 EHBDHN C[C@H]1CCN(c2sccc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000302016333 1031768586 /nfs/dbraw/zinc/76/85/86/1031768586.db2.gz LVBGUAKCUYQTLL-AWEZNQCLSA-N 0 3 331.441 3.757 20 5 EHBDHN C[C@H](NCc1ccc(O[C@H]2CCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000594923939 1033547407 /nfs/dbraw/zinc/54/74/07/1033547407.db2.gz HADRBSBWYULAQS-LIRRHRJNSA-N 0 3 342.395 3.613 20 5 EHBDHN COc1ccc([C@@H](NCc2ccc([N+](=O)[O-])cc2C)C2CC2)cn1 ZINC000599019262 1033667560 /nfs/dbraw/zinc/66/75/60/1033667560.db2.gz CRKJYTFYSBBIOO-SFHVURJKSA-N 0 3 327.384 3.548 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(Cc3cc(CO)ccc3F)C2)cc1 ZINC000599434160 1033934196 /nfs/dbraw/zinc/93/41/96/1033934196.db2.gz SLEATYOPWADEBI-MRXNPFEDSA-N 0 3 344.386 3.606 20 5 EHBDHN C[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCC(F)CC1 ZINC000595819288 1033993382 /nfs/dbraw/zinc/99/33/82/1033993382.db2.gz NNZMFBZMRDLLKP-LKSINWNRSA-N 0 3 348.378 3.651 20 5 EHBDHN C[C@@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCC(F)CC1 ZINC000595818813 1033993881 /nfs/dbraw/zinc/99/38/81/1033993881.db2.gz JZRLFDXNJZLIAA-LKSINWNRSA-N 0 3 348.378 3.651 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@H]1CC1(C)C ZINC000595909473 1034027167 /nfs/dbraw/zinc/02/71/67/1034027167.db2.gz OLRVGBRNXHMSRK-DGCLKSJQSA-N 0 3 330.388 3.684 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCOCCF)o2)c(Cl)c1 ZINC000596056996 1034056992 /nfs/dbraw/zinc/05/69/92/1034056992.db2.gz DWQDSAYFCSDYCR-UHFFFAOYSA-N 0 3 342.754 3.584 20 5 EHBDHN CN(CCCC(=O)c1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000450973388 1034998223 /nfs/dbraw/zinc/99/82/23/1034998223.db2.gz JWRJVNVHNQVJBY-UHFFFAOYSA-N 0 3 326.396 3.732 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000056201741 1036140106 /nfs/dbraw/zinc/14/01/06/1036140106.db2.gz YEWDODNKXBSBLW-ZIAGYGMSSA-N 0 3 327.384 3.581 20 5 EHBDHN CC(C)c1ccc(CN[C@@H](C(C)C)[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000589820585 1036646043 /nfs/dbraw/zinc/64/60/43/1036646043.db2.gz WDQHRNSMJXLXDX-GJZGRUSLSA-N 0 3 348.365 3.756 20 5 EHBDHN CN1Cc2ccccc2[C@@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000590082352 1036734981 /nfs/dbraw/zinc/73/49/81/1036734981.db2.gz RZYNJDSXEPWDFB-KRWDZBQOSA-N 0 3 334.379 3.742 20 5 EHBDHN CC[C@H](O)CN(C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850726 1037280275 /nfs/dbraw/zinc/28/02/75/1037280275.db2.gz OVBWTWHPUMFJCJ-BEBFYNPSSA-N 0 3 340.423 3.881 20 5 EHBDHN CCN(CCC1CC1)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000760883248 1037553172 /nfs/dbraw/zinc/55/31/72/1037553172.db2.gz BCSWVQAHHDNSMV-LLVKDONJSA-N 0 3 339.823 3.697 20 5 EHBDHN C/C(=C/c1ccccc1)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737318 1038500733 /nfs/dbraw/zinc/50/07/33/1038500733.db2.gz VVQCPKXQVUSWFV-HKBKRHGFSA-N 0 3 338.411 3.580 20 5 EHBDHN Cc1cc(N[C@H]2CCN(C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461959429 1038696870 /nfs/dbraw/zinc/69/68/70/1038696870.db2.gz PLTVMAQXRFUFKC-YJBOKZPZSA-N 0 3 329.375 3.900 20 5 EHBDHN COc1cc(N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991072 1039764255 /nfs/dbraw/zinc/76/42/55/1039764255.db2.gz BOYFCGANNOVSKY-RDTXWAMCSA-N 0 3 345.374 3.600 20 5 EHBDHN CSc1ccc(C(=O)Nc2ccccc2CN(C)C)cc1[N+](=O)[O-] ZINC000024808255 1039813393 /nfs/dbraw/zinc/81/33/93/1039813393.db2.gz RDJKOUTZXOVDGO-UHFFFAOYSA-N 0 3 345.424 3.631 20 5 EHBDHN O=[N+]([O-])c1cccnc1N[C@H](CN1CCCCC1)c1ccccc1 ZINC000078333924 1041017404 /nfs/dbraw/zinc/01/74/04/1041017404.db2.gz QJADMPYURGXITO-MRXNPFEDSA-N 0 3 326.400 3.629 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@@H]2CCCN(c3ccccc3)C2)c(F)c1 ZINC000433199005 1041049965 /nfs/dbraw/zinc/04/99/65/1041049965.db2.gz JDJHCSAEDDGPAL-HNNXBMFYSA-N 0 3 343.402 3.740 20 5 EHBDHN CCC[C@]1(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCOC1 ZINC000512890744 1041180538 /nfs/dbraw/zinc/18/05/38/1041180538.db2.gz MIJVNJTXFCOKSQ-SFHVURJKSA-N 0 3 330.384 3.904 20 5 EHBDHN CC[C@@H]1CCCCCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000150744372 1041257593 /nfs/dbraw/zinc/25/75/93/1041257593.db2.gz CGVCBAUCRFLLRF-CQSZACIVSA-N 0 3 330.388 3.799 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)N[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000107071092 1041815106 /nfs/dbraw/zinc/81/51/06/1041815106.db2.gz WIEMDAXVWDXFQZ-KGLIPLIRSA-N 0 3 327.384 3.581 20 5 EHBDHN Cc1cnc([C@H](C)CNCc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000893576977 1042734651 /nfs/dbraw/zinc/73/46/51/1042734651.db2.gz WEZCDXIERJYZOL-SECBINFHSA-N 0 3 325.821 3.906 20 5 EHBDHN C[C@@H]1CC(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H](C)O1 ZINC000128713871 1042869530 /nfs/dbraw/zinc/86/95/30/1042869530.db2.gz AZYCNJAXBFQCSM-VXGBXAGGSA-N 0 3 347.440 3.764 20 5 EHBDHN C[C@H](NC[C@H](O)c1cc(F)cc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000279542807 1044207702 /nfs/dbraw/zinc/20/77/02/1044207702.db2.gz QGJDBLKZLRGOQZ-QFYYESIMSA-N 0 3 338.766 3.772 20 5 EHBDHN CCN(CC)C(=O)C1(NCc2ccc([N+](=O)[O-])cc2C)CCCCC1 ZINC000542699471 1128546386 /nfs/dbraw/zinc/54/63/86/1128546386.db2.gz IRYRZMWSOQYSDZ-UHFFFAOYSA-N 0 3 347.459 3.564 20 5 EHBDHN CC[C@@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000765846232 1128550142 /nfs/dbraw/zinc/55/01/42/1128550142.db2.gz WKNYNNZKOFQCNA-SJORKVTESA-N 0 3 336.338 3.647 20 5 EHBDHN COC(=O)c1oc([C@H](C)N(C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000554847844 1128716054 /nfs/dbraw/zinc/71/60/54/1128716054.db2.gz GDQKFPSWKAVNOK-ZDUSSCGKSA-N 0 3 346.383 3.518 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CC[C@@H]3SCCS[C@H]23)c1 ZINC000762613010 1121382077 /nfs/dbraw/zinc/38/20/77/1121382077.db2.gz GPJVEMOVJVUEEB-HZSPNIEDSA-N 0 3 344.889 3.717 20 5 EHBDHN C[C@H](C[C@H]1CCCO1)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113333109 1129002578 /nfs/dbraw/zinc/00/25/78/1129002578.db2.gz WGRUHMROZABVMO-MLGOLLRUSA-N 0 3 347.440 3.766 20 5 EHBDHN C[C@H]1CCCC[C@H]1N(C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143323 1121784839 /nfs/dbraw/zinc/78/48/39/1121784839.db2.gz OXLCSTUULHJZSO-SWLSCSKDSA-N 0 3 330.388 3.655 20 5 EHBDHN Cc1ccc(N2CCCN(Cc3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000917089830 1122487070 /nfs/dbraw/zinc/48/70/70/1122487070.db2.gz NRSVLLMJBIZWCD-UHFFFAOYSA-N 0 3 339.439 3.924 20 5 EHBDHN COc1ccc(CNCCOc2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000609287731 1122939668 /nfs/dbraw/zinc/93/96/68/1122939668.db2.gz XVOGEQAHSBWAHL-UHFFFAOYSA-N 0 3 344.411 3.895 20 5 EHBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@H](C)c1c(F)cncc1F ZINC000556916375 1123201139 /nfs/dbraw/zinc/20/11/39/1123201139.db2.gz IDLJTEXNDQOAPZ-VXGBXAGGSA-N 0 3 335.354 3.940 20 5 EHBDHN Cc1ccc(OC2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000609739561 1123657839 /nfs/dbraw/zinc/65/78/39/1123657839.db2.gz MGKCERPHFLXQLZ-UHFFFAOYSA-N 0 3 340.423 3.989 20 5 EHBDHN CC1CCC(N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000198202628 1125402647 /nfs/dbraw/zinc/40/26/47/1125402647.db2.gz YLMGSRYWXSSGRK-UHFFFAOYSA-N 0 3 339.823 3.697 20 5 EHBDHN CC(C)[C@H]1CCCCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000117349717 1129435121 /nfs/dbraw/zinc/43/51/21/1129435121.db2.gz NKWUWLWPRFYDSB-OAHLLOKOSA-N 0 3 330.388 3.655 20 5 EHBDHN CC(C)(C)c1ccc(Oc2ccc(CNCCO)cc2[N+](=O)[O-])cc1 ZINC000499948376 1129587844 /nfs/dbraw/zinc/58/78/44/1129587844.db2.gz UXYZRJOVRCPGGN-UHFFFAOYSA-N 0 3 344.411 3.767 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(C(=O)N(C)C(C)C)CC1 ZINC000330738181 1129644302 /nfs/dbraw/zinc/64/43/02/1129644302.db2.gz ZBKKHNNNDSBRBC-HNNXBMFYSA-N 0 3 347.459 3.543 20 5 EHBDHN COc1cccc([C@H](CNc2cccc(C)c2[N+](=O)[O-])N(C)C)c1 ZINC000302483915 1129779938 /nfs/dbraw/zinc/77/99/38/1129779938.db2.gz HKNDJPDRFLDMEA-KRWDZBQOSA-N 0 3 329.400 3.627 20 5 EHBDHN CC[C@H](C)[C@H]1CCCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059332 1131462078 /nfs/dbraw/zinc/46/20/78/1131462078.db2.gz XKSQBTZGXBOLFE-WMLDXEAASA-N 0 3 343.431 3.711 20 5 EHBDHN CC[C@H](C)[C@H]1CCCCN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057481 1131462102 /nfs/dbraw/zinc/46/21/02/1131462102.db2.gz RJVNCKDXBOWOOH-WMLDXEAASA-N 0 3 343.431 3.711 20 5 EHBDHN CCCCCCN1CCN([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173226402 1132007201 /nfs/dbraw/zinc/00/72/01/1132007201.db2.gz JRVJHLHPMMUFQN-QGZVFWFLSA-N 0 3 333.476 3.724 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N(C)Cc1nc2ccccc2o1 ZINC001173231721 1132008957 /nfs/dbraw/zinc/00/89/57/1132008957.db2.gz CMKYGZACFCBLNC-ZDUSSCGKSA-N 0 3 325.368 3.799 20 5 EHBDHN CC(C)Oc1ccccc1[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000774981596 1134176434 /nfs/dbraw/zinc/17/64/34/1134176434.db2.gz RASXMRULHYRVOE-KDOFPFPSSA-N 0 3 344.411 3.766 20 5 EHBDHN CCOCOc1ccc(CNCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000791000423 1134491103 /nfs/dbraw/zinc/49/11/03/1134491103.db2.gz VMMXGQNBYLKPBD-UHFFFAOYSA-N 0 3 330.384 3.566 20 5 EHBDHN CC[C@H](C)N[C@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccco1 ZINC000804784284 1135200545 /nfs/dbraw/zinc/20/05/45/1135200545.db2.gz ZMCVOHGOQVPRDR-SMDDNHRTSA-N 0 3 348.359 3.637 20 5 EHBDHN CCCCCCN1CCN(c2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC001193989032 1135211824 /nfs/dbraw/zinc/21/18/24/1135211824.db2.gz JMKPTIWQFMNBJO-UHFFFAOYSA-N 0 3 335.448 3.696 20 5 EHBDHN CN(C/C=C/c1ccccc1[N+](=O)[O-])CCc1ccccc1[N+](=O)[O-] ZINC000809689320 1135871762 /nfs/dbraw/zinc/87/17/62/1135871762.db2.gz XPMSDRWAVJGPJO-RMKNXTFCSA-N 0 3 341.367 3.691 20 5 EHBDHN CC[C@H](C)[C@@](C)(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811479552 1136097622 /nfs/dbraw/zinc/09/76/22/1136097622.db2.gz HVRXDBQZIDHSQR-XPTSAGLGSA-N 0 3 335.231 3.788 20 5 EHBDHN CCN(Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812851549 1136261176 /nfs/dbraw/zinc/26/11/76/1136261176.db2.gz SMMDYKIBYGWRCN-ACJLOTCBSA-N 0 3 332.375 3.678 20 5 EHBDHN CC(COC(=O)c1ccc(-c2cccc3cccnc32)cc1)[N+](=O)[O-] ZINC000813105709 1136289741 /nfs/dbraw/zinc/28/97/41/1136289741.db2.gz SIOPYFZZEQXQEM-ZDUSSCGKSA-N 0 3 336.347 3.724 20 5 EHBDHN C[C@@H]1CCCC[C@@H]1N(C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000173190354 1136341705 /nfs/dbraw/zinc/34/17/05/1136341705.db2.gz OADQQRRUZPCSFL-DOMZBBRYSA-N 0 3 330.388 3.655 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776591249 1136451175 /nfs/dbraw/zinc/45/11/75/1136451175.db2.gz IETFKUXXOIPIBY-MOPGFXCFSA-N 0 3 344.386 3.995 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CC[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666337 1136491821 /nfs/dbraw/zinc/49/18/21/1136491821.db2.gz GMGJIIKVNURMBM-QAPCUYQASA-N 0 3 346.814 3.771 20 5 EHBDHN C[C@H](NCc1cc2c(s1)CCCC2)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815570303 1136617409 /nfs/dbraw/zinc/61/74/09/1136617409.db2.gz YPMHLHKKHDMPEA-NSHDSACASA-N 0 3 331.441 3.968 20 5 EHBDHN Cc1nn(CN2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000776774782 1136661197 /nfs/dbraw/zinc/66/11/97/1136661197.db2.gz OKJBUSBDADPSKT-KURKYZTESA-N 0 3 340.427 3.715 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@](O)(c2ccccc2)C1 ZINC000859585273 1137021477 /nfs/dbraw/zinc/02/14/77/1137021477.db2.gz MMZIJTMMDVNQFC-HNAYVOBHSA-N 0 3 326.396 3.639 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@@H]2CCO[C@H]2c2ccccc2)ccc1Cl ZINC000865650357 1137301553 /nfs/dbraw/zinc/30/15/53/1137301553.db2.gz JBZOLQFVUAOBGQ-WBVHZDCISA-N 0 3 332.787 3.868 20 5 EHBDHN CC(C)c1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845873283 1137316331 /nfs/dbraw/zinc/31/63/31/1137316331.db2.gz CFSOPPDSJDQGHU-PXAZEXFGSA-N 0 3 346.358 3.907 20 5 EHBDHN CC([C@H](OC(=O)C=C1CCSCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878780 1137316609 /nfs/dbraw/zinc/31/66/09/1137316609.db2.gz SRLHYSXXHNQDQO-ZBEGNZNMSA-N 0 3 339.388 3.529 20 5 EHBDHN CC([C@@H](OC(=O)[C@H]1CCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845881951 1137317071 /nfs/dbraw/zinc/31/70/71/1137317071.db2.gz MZNJYYGGHGYVHR-GBIKHYSHSA-N 0 3 331.290 3.511 20 5 EHBDHN CC([C@@H](OC(=O)[C@H]1CCCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845883736 1137317177 /nfs/dbraw/zinc/31/71/77/1137317177.db2.gz VHQATZLYHNBWLQ-UHIISALHSA-N 0 3 345.317 3.901 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCNC2(c3ccccc3F)CCC2)cc1 ZINC001171523459 1137496296 /nfs/dbraw/zinc/49/62/96/1137496296.db2.gz OUTYEUWQIHUWGM-UHFFFAOYSA-N 0 3 330.359 3.782 20 5 EHBDHN C[C@@H](NC[C@@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872038695 1137566952 /nfs/dbraw/zinc/56/69/52/1137566952.db2.gz OZMBRPKQGUDYRT-UKRRQHHQSA-N 0 3 332.375 3.551 20 5 EHBDHN CC1CCC(N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000877919713 1137695729 /nfs/dbraw/zinc/69/57/29/1137695729.db2.gz VEKAOGWYJQYAER-UHFFFAOYSA-N 0 3 330.388 3.655 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1nnc(CN2CCC[C@@H]2C2CCCC2)o1 ZINC000877986061 1137698434 /nfs/dbraw/zinc/69/84/34/1137698434.db2.gz KILVPSYZPCFXLG-OAHLLOKOSA-N 0 3 342.399 3.799 20 5 EHBDHN CC[C@H]1CCCCCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878124654 1137703441 /nfs/dbraw/zinc/70/34/41/1137703441.db2.gz JUPLQOMQXSOAII-ZDUSSCGKSA-N 0 3 330.388 3.799 20 5 EHBDHN CC[C@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CC1(C)C ZINC000878717752 1137726101 /nfs/dbraw/zinc/72/61/01/1137726101.db2.gz HMOVDFAQZNHOBT-OLZOCXBDSA-N 0 3 330.388 3.559 20 5 EHBDHN CC[C@@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CC1(C)C ZINC000878717753 1137726233 /nfs/dbraw/zinc/72/62/33/1137726233.db2.gz HMOVDFAQZNHOBT-QWHCGFSZSA-N 0 3 330.388 3.559 20 5 EHBDHN CC[C@H](NCc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC000878950671 1137733306 /nfs/dbraw/zinc/73/33/06/1137733306.db2.gz XIEBKVKEQRMEPN-LBPRGKRZSA-N 0 3 336.779 3.576 20 5 EHBDHN CCOc1cc(CN2CC[C@H](c3nc(C)cs3)C2)ccc1[N+](=O)[O-] ZINC000880012606 1137765476 /nfs/dbraw/zinc/76/54/76/1137765476.db2.gz VQNXSDMAYHSVMH-AWEZNQCLSA-N 0 3 347.440 3.748 20 5 EHBDHN CCN1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000264645663 1138589463 /nfs/dbraw/zinc/58/94/63/1138589463.db2.gz RKEBGKYWYYDEBL-UHFFFAOYSA-N 0 3 333.435 3.556 20 5 EHBDHN CCOc1ccc([C@H](C)NCc2ccccc2COC)cc1[N+](=O)[O-] ZINC000152715179 1139105216 /nfs/dbraw/zinc/10/52/16/1139105216.db2.gz XIOKMLNQACDYAB-AWEZNQCLSA-N 0 3 344.411 3.991 20 5 EHBDHN CCOc1ccc([C@@H](C)NC[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000152743557 1139106124 /nfs/dbraw/zinc/10/61/24/1139106124.db2.gz NXZPLSONPVDFBG-PXAZEXFGSA-N 0 3 348.374 3.517 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCSC2(CCOCC2)C1 ZINC000186841767 1140224671 /nfs/dbraw/zinc/22/46/71/1140224671.db2.gz VCGIJHWYDLYQTO-AWEZNQCLSA-N 0 3 336.457 3.562 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000267441945 1140791732 /nfs/dbraw/zinc/79/17/32/1140791732.db2.gz IDZVVRPXWQOADD-GOEBONIOSA-N 0 3 332.425 3.744 20 5 EHBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCc1c(C)noc1C ZINC000271202082 1141324830 /nfs/dbraw/zinc/32/48/30/1141324830.db2.gz ZMRQFEVSIXCTMA-ZDUSSCGKSA-N 0 3 335.429 3.860 20 5 EHBDHN CC[C@@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000340153731 1016506580 /nfs/dbraw/zinc/50/65/80/1016506580.db2.gz BKZUJMQUUZUVBB-KBXCAEBGSA-N 0 3 341.411 3.971 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593522 1032314419 /nfs/dbraw/zinc/31/44/19/1032314419.db2.gz VOYBOPWMXNVOAE-FZKQIMNGSA-N 0 3 334.416 3.710 20 5 EHBDHN CCC[C@@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCC1 ZINC000459790224 1032476012 /nfs/dbraw/zinc/47/60/12/1032476012.db2.gz GKYKHMIHYKOPKK-OAHLLOKOSA-N 0 3 330.388 3.703 20 5 EHBDHN COc1cc(C)nc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000449504365 1032687142 /nfs/dbraw/zinc/68/71/42/1032687142.db2.gz VVKRQVCHBJSLLK-INIZCTEOSA-N 0 3 341.411 3.686 20 5 EHBDHN Cc1cnc(N[C@@H](CN2CCCCC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610284254 1017622060 /nfs/dbraw/zinc/62/20/60/1017622060.db2.gz DWBMCJURVYCAOS-KRWDZBQOSA-N 0 3 340.427 3.937 20 5 EHBDHN COc1c([O-])ccc(C[NH2+][C@H](C)[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000893099339 1018470021 /nfs/dbraw/zinc/47/00/21/1018470021.db2.gz LPSCNUHECWEEGT-QWHCGFSZSA-N 0 3 330.384 3.591 20 5 EHBDHN C[C@@H](O)C[C@H](CNCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000893128116 1018577165 /nfs/dbraw/zinc/57/71/65/1018577165.db2.gz LHZCNMQZPLKIET-CZUORRHYSA-N 0 3 348.830 3.893 20 5 EHBDHN Cc1c(CN[C@@H](C)c2ccccc2-n2cccn2)cccc1[N+](=O)[O-] ZINC000183163376 1020430566 /nfs/dbraw/zinc/43/05/66/1020430566.db2.gz NLHYTGGYPRFDKH-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN COc1cccc([C@H]2C[C@H](NCc3ccc([N+](=O)[O-])cc3F)C2)c1 ZINC000449619970 1032906690 /nfs/dbraw/zinc/90/66/90/1032906690.db2.gz RTZZRKMMZIYNOZ-SHTZXODSSA-N 0 3 330.359 3.778 20 5 EHBDHN Cc1nn(CN2CCCC[C@H]2CCC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000760409290 1032938949 /nfs/dbraw/zinc/93/89/49/1032938949.db2.gz QNKKLZLJXPWFSX-HNNXBMFYSA-N 0 3 345.447 3.896 20 5 EHBDHN COc1cccc(COCCN[C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000090806557 1021090430 /nfs/dbraw/zinc/09/04/30/1021090430.db2.gz NCIMVPFIDVRXRV-OAHLLOKOSA-N 0 3 344.411 3.779 20 5 EHBDHN CC(C)(C)[C@H]1OCCC[C@@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602549540 1032957410 /nfs/dbraw/zinc/95/74/10/1032957410.db2.gz DKFQMDQCTKHNJU-PXAZEXFGSA-N 0 3 347.415 3.667 20 5 EHBDHN Cc1ccc(CN[C@@H]2CCCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000449655596 1032985571 /nfs/dbraw/zinc/98/55/71/1032985571.db2.gz ZMGANZQYYILTON-QGZVFWFLSA-N 0 3 325.412 3.964 20 5 EHBDHN CCCN(CCc1ccccn1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602654594 1033053865 /nfs/dbraw/zinc/05/38/65/1033053865.db2.gz DEGCHNLSWOIEHR-UHFFFAOYSA-N 0 3 340.383 3.586 20 5 EHBDHN C[C@@H](c1ccc(Cl)cc1)N(CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000176214674 1023883059 /nfs/dbraw/zinc/88/30/59/1023883059.db2.gz RDNQYOPNYMKOKK-LBPRGKRZSA-N 0 3 334.807 3.670 20 5 EHBDHN CCC[C@@H](NCCn1c(C)ncc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000602806432 1033181508 /nfs/dbraw/zinc/18/15/08/1033181508.db2.gz SPGSCCQPYFOSDM-OAHLLOKOSA-N 0 3 338.358 3.509 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](OCc2ccncc2)C1 ZINC000280899666 1024411746 /nfs/dbraw/zinc/41/17/46/1024411746.db2.gz DSUPKIIDKRLVOC-CRAIPNDOSA-N 0 3 341.411 3.650 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@H](c2nccs2)C1 ZINC000895581235 1024637652 /nfs/dbraw/zinc/63/76/52/1024637652.db2.gz MNEWZKZQSMPCEW-GLNPCMGASA-N 0 3 329.425 3.944 20 5 EHBDHN CCC[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)(C)C ZINC000451442254 1025974901 /nfs/dbraw/zinc/97/49/01/1025974901.db2.gz UZOBGQJVAQSSGK-AWEZNQCLSA-N 0 3 332.404 3.949 20 5 EHBDHN Cc1cnc([C@@H](C)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553125 1026105541 /nfs/dbraw/zinc/10/55/41/1026105541.db2.gz XKWYEGNAIJXXGW-GDBMZVCRSA-N 0 3 326.400 3.634 20 5 EHBDHN COc1cc(CN2C[C@H](C)CC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000530626635 1026151240 /nfs/dbraw/zinc/15/12/40/1026151240.db2.gz RBJIOJOUNJMIRW-SNVBAGLBSA-N 0 3 344.358 3.825 20 5 EHBDHN COc1cc(CN2C[C@@H](C)CC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000530626632 1026151450 /nfs/dbraw/zinc/15/14/50/1026151450.db2.gz RBJIOJOUNJMIRW-JTQLQIEISA-N 0 3 344.358 3.825 20 5 EHBDHN Cc1nn(C(C)C)c(C)c1CN(C)CCc1cccc([N+](=O)[O-])c1 ZINC000894271438 1027681156 /nfs/dbraw/zinc/68/11/56/1027681156.db2.gz GTQKBJJVCBJRJK-UHFFFAOYSA-N 0 3 330.432 3.664 20 5 EHBDHN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)CC1CCCC1 ZINC000533398448 1027769756 /nfs/dbraw/zinc/76/97/56/1027769756.db2.gz QIVBLYKMLMNCBN-LLVKDONJSA-N 0 3 339.823 3.697 20 5 EHBDHN C[C@@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCCOC1 ZINC000503932547 1028236981 /nfs/dbraw/zinc/23/69/81/1028236981.db2.gz VIBZBMYCWJQVKL-TZMCWYRMSA-N 0 3 347.440 3.623 20 5 EHBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCc1cnccc1OC ZINC000340401604 1028784713 /nfs/dbraw/zinc/78/47/13/1028784713.db2.gz XEMJSFGOYVOMCF-AWEZNQCLSA-N 0 3 347.440 3.659 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCCC2(O)CCC2)c2ccccc2)c1 ZINC000421851280 1028837565 /nfs/dbraw/zinc/83/75/65/1028837565.db2.gz FQDVQVOOQQXXEP-IBGZPJMESA-N 0 3 340.423 3.969 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(-n2cccn2)cc1 ZINC000532202643 1030475772 /nfs/dbraw/zinc/47/57/72/1030475772.db2.gz QBCQJCSTPJMDNC-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CO[C@@H](C3CC3)C2)o1 ZINC000599006856 1033641753 /nfs/dbraw/zinc/64/17/53/1033641753.db2.gz LNXHIIRFKQMHOX-SCLBCKFNSA-N 0 3 328.368 3.512 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H](C)c1c(C)noc1C ZINC000595035037 1033654979 /nfs/dbraw/zinc/65/49/79/1033654979.db2.gz GMLKMSHAFHKRJQ-MNOVXSKESA-N 0 3 333.388 3.663 20 5 EHBDHN CC[C@H](OCCNCc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000593664441 1033663890 /nfs/dbraw/zinc/66/38/90/1033663890.db2.gz NHOPSASMRHBLDO-SFHVURJKSA-N 0 3 344.411 3.861 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NC[C@@H](CO)CC2CC2)c2ccccc2)c1 ZINC000595089275 1033698352 /nfs/dbraw/zinc/69/83/52/1033698352.db2.gz NBWMPSDUGGHEPQ-JXFKEZNVSA-N 0 3 340.423 3.682 20 5 EHBDHN Cc1c(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000593013118 1033804196 /nfs/dbraw/zinc/80/41/96/1033804196.db2.gz CWLHBEJIAMLPKN-GHMZBOCLSA-N 0 3 346.305 3.589 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(Cc3cnc4ccccc4n3)C2)cc1 ZINC000595520809 1033839813 /nfs/dbraw/zinc/83/98/13/1033839813.db2.gz FEWPTOIXMKXSEP-MRXNPFEDSA-N 0 3 348.406 3.918 20 5 EHBDHN O=C(CN1CCC[C@H]1C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000603896346 1034003726 /nfs/dbraw/zinc/00/37/26/1034003726.db2.gz OOMSGTDZLFPLKM-INIZCTEOSA-N 0 3 331.416 3.578 20 5 EHBDHN CCOc1ccc([C@H](C)NCc2ccc([C@@H](C)O)cc2)cc1[N+](=O)[O-] ZINC000179406799 1034279807 /nfs/dbraw/zinc/27/98/07/1034279807.db2.gz LUEIYBIKKWIFHM-UONOGXRCSA-N 0 3 344.411 3.898 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000604484205 1034388571 /nfs/dbraw/zinc/38/85/71/1034388571.db2.gz FGHYIMXUQKUYBW-GOSISDBHSA-N 0 3 328.368 3.516 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CCC4(COC4)C3)o2)c(Cl)c1 ZINC000597228641 1034611128 /nfs/dbraw/zinc/61/11/28/1034611128.db2.gz FNWCAWHXAVDXTJ-UHFFFAOYSA-N 0 3 348.786 3.731 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(CN2CCCC2)c1 ZINC000060551358 1034726842 /nfs/dbraw/zinc/72/68/42/1034726842.db2.gz NEKKKFVWYASDBZ-UHFFFAOYSA-N 0 3 339.395 3.751 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000612593291 1035084541 /nfs/dbraw/zinc/08/45/41/1035084541.db2.gz ZMXSRVXWQQCWNQ-QAPCUYQASA-N 0 3 348.349 3.883 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCCn2ccnc2)c2ccccc2)c1 ZINC000179963792 1035095676 /nfs/dbraw/zinc/09/56/76/1035095676.db2.gz BWPUXWHXTTXJFX-IBGZPJMESA-N 0 3 336.395 3.561 20 5 EHBDHN C[C@@H](NC[C@@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000122135213 1035866975 /nfs/dbraw/zinc/86/69/75/1035866975.db2.gz CNMRHKJZMPPCFJ-PBHICJAKSA-N 0 3 329.400 3.676 20 5 EHBDHN CN1Cc2ccccc2[C@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000590082353 1036735929 /nfs/dbraw/zinc/73/59/29/1036735929.db2.gz RZYNJDSXEPWDFB-QGZVFWFLSA-N 0 3 334.379 3.742 20 5 EHBDHN O=[N+]([O-])c1ccn(CCN2CCCCC[C@@H]2/C=C/c2cccs2)n1 ZINC000542131642 1037107281 /nfs/dbraw/zinc/10/72/81/1037107281.db2.gz NKZDUSHJMZKCTR-MVGZEHJDSA-N 0 3 346.456 3.811 20 5 EHBDHN O=[N+]([O-])c1cc(CNCCc2ccc(Br)s2)cs1 ZINC000225588002 1037840634 /nfs/dbraw/zinc/84/06/34/1037840634.db2.gz BSIBIVFSGWUOOI-UHFFFAOYSA-N 0 3 347.259 3.813 20 5 EHBDHN C[C@@H]1CC(C)(C)CC[C@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000481117027 1038156444 /nfs/dbraw/zinc/15/64/44/1038156444.db2.gz QFPHWJQJMOTNLO-IUODEOHRSA-N 0 3 344.415 3.949 20 5 EHBDHN CCN1CCN(c2cccc(Nc3sccc3[N+](=O)[O-])c2)CC1 ZINC000613704712 1038607140 /nfs/dbraw/zinc/60/71/40/1038607140.db2.gz MEHLPYWGYIOMEV-UHFFFAOYSA-N 0 3 332.429 3.542 20 5 EHBDHN CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])[n-]1 ZINC000488465425 1039206190 /nfs/dbraw/zinc/20/61/90/1039206190.db2.gz OHIZDSVDFHALTP-MELADBBJSA-N 0 3 345.447 3.898 20 5 EHBDHN Cc1c(CN[C@@H](C)CC(=O)Nc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000478475780 1039480994 /nfs/dbraw/zinc/48/09/94/1039480994.db2.gz ADEOIYOCKFSYNH-LBPRGKRZSA-N 0 3 345.374 3.549 20 5 EHBDHN CCc1ccc([C@@H](NCC2(N(C)C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000417357839 1039715988 /nfs/dbraw/zinc/71/59/88/1039715988.db2.gz SGGXAWBEICPAAZ-SFHVURJKSA-N 0 3 343.427 3.523 20 5 EHBDHN C[C@@H](Cc1ccc(O)cc1)N(C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000125513761 1042250316 /nfs/dbraw/zinc/25/03/16/1042250316.db2.gz FSZHYAAOAMYHLE-LBPRGKRZSA-N 0 3 341.367 3.505 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000112700805 1042419824 /nfs/dbraw/zinc/41/98/24/1042419824.db2.gz YFBZPXXNOAJOIW-HUUCEWRRSA-N 0 3 347.459 3.530 20 5 EHBDHN COc1ccc2nc(CNCCc3ccccc3[N+](=O)[O-])sc2c1 ZINC000344061796 1043186487 /nfs/dbraw/zinc/18/64/87/1043186487.db2.gz JKGBFFRBRRSEOJ-UHFFFAOYSA-N 0 3 343.408 3.545 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(C[C@@H](O)c2cccc(Cl)c2)C2CC2)cc1 ZINC000764491630 1127498864 /nfs/dbraw/zinc/49/88/64/1127498864.db2.gz DLYJTQIFZXOEDH-GOSISDBHSA-N 0 3 346.814 3.946 20 5 EHBDHN CCOc1cc(NC[C@@H]2CCN2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000715698825 1128730004 /nfs/dbraw/zinc/73/00/04/1128730004.db2.gz UXRHJYUBBJYQNO-KRWDZBQOSA-N 0 3 341.411 3.680 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@H](c1ccccc1)C(C)(C)CO ZINC000554867370 1128742048 /nfs/dbraw/zinc/74/20/48/1128742048.db2.gz OCHLLROXDHDDEN-SFHVURJKSA-N 0 3 328.412 3.753 20 5 EHBDHN Cc1c(CN2CCCO[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000609233632 1121836936 /nfs/dbraw/zinc/83/69/36/1121836936.db2.gz FMCLMZOGDWGEHI-LJQANCHMSA-N 0 3 326.396 3.867 20 5 EHBDHN Cc1ccc(NC(=O)/C=C\c2ccccc2[N+](=O)[O-])c(CN(C)C)c1 ZINC000255131908 1129023329 /nfs/dbraw/zinc/02/33/29/1129023329.db2.gz VANZXQXZSRHDCF-LUAWRHEFSA-N 0 3 339.395 3.617 20 5 EHBDHN CN(Cc1cc2ccccc2o1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154394320 1122596439 /nfs/dbraw/zinc/59/64/39/1122596439.db2.gz LYNXKZWHWHWQPB-KRWDZBQOSA-N 0 3 326.352 3.506 20 5 EHBDHN COc1cccc(CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1F ZINC000619715461 1125388201 /nfs/dbraw/zinc/38/82/01/1125388201.db2.gz JFDODWMGVLIGPQ-UHFFFAOYSA-N 0 3 338.766 3.728 20 5 EHBDHN O=[N+]([O-])c1cccc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c1 ZINC000079924158 1129307119 /nfs/dbraw/zinc/30/71/19/1129307119.db2.gz SXHPVHUTPYKPBU-LJQANCHMSA-N 0 3 340.379 3.607 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CNCCc1nc2c(s1)CCC2 ZINC000922715873 1129638561 /nfs/dbraw/zinc/63/85/61/1129638561.db2.gz XKISMYIYPKFNBL-UHFFFAOYSA-N 0 3 337.832 3.526 20 5 EHBDHN C[C@H](N[C@@H]1CCCC[C@@H]1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171414167 1130054965 /nfs/dbraw/zinc/05/49/65/1130054965.db2.gz QCLLMALIXMXFJB-SLEUVZQESA-N 0 3 330.388 3.874 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000245518110 1130228314 /nfs/dbraw/zinc/22/83/14/1130228314.db2.gz HJXJVCGQFUZNQS-UONOGXRCSA-N 0 3 334.416 3.628 20 5 EHBDHN O=[N+]([O-])c1ccc2c(cnn2CN2CCC[C@@]3(CC=CCC3)C2)c1 ZINC000733992029 1131180491 /nfs/dbraw/zinc/18/04/91/1131180491.db2.gz LNCZXIRPJQYIKR-SFHVURJKSA-N 0 3 326.400 3.724 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N(C)Cc2ccsc2)c1F ZINC001173195169 1131995795 /nfs/dbraw/zinc/99/57/95/1131995795.db2.gz CSZNIQRMHFHAIG-LLVKDONJSA-N 0 3 338.404 3.867 20 5 EHBDHN CCCCN(Cn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCCCC1 ZINC000746044210 1132352551 /nfs/dbraw/zinc/35/25/51/1132352551.db2.gz KITSPWGKKRMOCP-UHFFFAOYSA-N 0 3 347.415 3.895 20 5 EHBDHN CN(Cc1c2ccccc2c(Cl)c2ccccc21)[C@@H]1CCNC1=O ZINC000770378155 1133416276 /nfs/dbraw/zinc/41/62/76/1133416276.db2.gz DPPZPTDFHGZLGY-GOSISDBHSA-N 0 3 338.838 3.967 20 5 EHBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CNCc1nnc(-c2ccccc2)[nH]1 ZINC000786813690 1133910565 /nfs/dbraw/zinc/91/05/65/1133910565.db2.gz MBHQGGXUALONLZ-UVTDQMKNSA-N 0 3 349.394 3.573 20 5 EHBDHN CCCN(CCn1c(C)ncc1[N+](=O)[O-])[C@@H](C)c1ccccc1OC ZINC001190582184 1134722744 /nfs/dbraw/zinc/72/27/44/1134722744.db2.gz ROVKIAYDYONYFZ-AWEZNQCLSA-N 0 3 346.431 3.582 20 5 EHBDHN CC(C)C1CCC(N2CCN(Cc3ccccc3[N+](=O)[O-])CC2)CC1 ZINC001191438034 1134867928 /nfs/dbraw/zinc/86/79/28/1134867928.db2.gz XRXAFRLMEOZJAN-UHFFFAOYSA-N 0 3 345.487 3.927 20 5 EHBDHN COc1cc(CNC(C)C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000101588715 1135356218 /nfs/dbraw/zinc/35/62/18/1135356218.db2.gz AXTQYVAWPTVMKU-UHFFFAOYSA-N 0 3 330.384 3.680 20 5 EHBDHN C[C@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CN1C1CC1 ZINC000811484365 1136091904 /nfs/dbraw/zinc/09/19/04/1136091904.db2.gz VJUBXPBZFORUOO-CABZTGNLSA-N 0 3 344.242 3.616 20 5 EHBDHN CC[C@@H]1c2ccsc2CCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275026 1136129145 /nfs/dbraw/zinc/12/91/45/1136129145.db2.gz FOMIBXORJSPDOV-CVEARBPZSA-N 0 3 332.425 3.699 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776279706 1136134854 /nfs/dbraw/zinc/13/48/54/1136134854.db2.gz XENNFJNEXIYUNE-ZWKOTPCHSA-N 0 3 330.359 3.604 20 5 EHBDHN Cc1ccc(CN2CCC[C@H]2COc2ccccc2)cc1[N+](=O)[O-] ZINC001170650429 1136154582 /nfs/dbraw/zinc/15/45/82/1136154582.db2.gz LYHYKUVYSKVQRK-KRWDZBQOSA-N 0 3 326.396 3.947 20 5 EHBDHN CC(C)[C@H](NCc1ccc(F)cc1[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000852034817 1136428636 /nfs/dbraw/zinc/42/86/36/1136428636.db2.gz JFHDHUVTBJXUFX-ROUUACIJSA-N 0 3 332.375 3.582 20 5 EHBDHN CC(C)[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000852446121 1136456555 /nfs/dbraw/zinc/45/65/55/1136456555.db2.gz DJTQCZWZZCYTOG-ZWKOTPCHSA-N 0 3 332.375 3.754 20 5 EHBDHN CCC(CC)N(CC)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001170754433 1136484225 /nfs/dbraw/zinc/48/42/25/1136484225.db2.gz BPWCEHRNVNDVBI-UHFFFAOYSA-N 0 3 327.812 3.697 20 5 EHBDHN CCN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](C)C(C)C ZINC000112659428 1136644064 /nfs/dbraw/zinc/64/40/64/1136644064.db2.gz RMHVWJFCUJPNRJ-NSHDSACASA-N 0 3 327.812 3.553 20 5 EHBDHN Cc1cc2c(o1)CC(C)(C)C[C@H]2NC[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818961853 1136891186 /nfs/dbraw/zinc/89/11/86/1136891186.db2.gz VVOIPONRXYOYGE-IAGOWNOFSA-N 0 3 344.411 3.833 20 5 EHBDHN CC([C@@H](OC(=O)C[C@H](C)C(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000860855251 1137081223 /nfs/dbraw/zinc/08/12/23/1137081223.db2.gz VOGSOGQWHLPQGA-IGJMFERPSA-N 0 3 337.269 3.664 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H](F)Cc1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845873715 1137316211 /nfs/dbraw/zinc/31/62/11/1137316211.db2.gz DRPICCPHTINLGT-OAUYIBNBSA-N 0 3 349.333 3.656 20 5 EHBDHN CC([C@H](OC(=O)[C@H]1Cc2ccc(F)cc21)c1ccccc1F)[N+](=O)[O-] ZINC000845875603 1137316285 /nfs/dbraw/zinc/31/62/85/1137316285.db2.gz AEMXYMISTRLIKL-PHEKWQANSA-N 0 3 347.317 3.554 20 5 EHBDHN CC([C@@H](OC(=O)C(F)=C1CCCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845877046 1137316408 /nfs/dbraw/zinc/31/64/08/1137316408.db2.gz DNLMYIBHGUWAIR-ZUZCIYMTSA-N 0 3 325.311 3.873 20 5 EHBDHN CSc1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])o1 ZINC000845878170 1137316469 /nfs/dbraw/zinc/31/64/69/1137316469.db2.gz UWVGZNWONADBQD-LKFCYVNXSA-N 0 3 339.344 3.704 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H](C)c1cccs1)c1ccccc1F)[N+](=O)[O-] ZINC000845880657 1137316895 /nfs/dbraw/zinc/31/68/95/1137316895.db2.gz XNZMEGOZLPCYFT-ZIBATOQPSA-N 0 3 337.372 3.940 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCc1csc(C)n1 ZINC000872020017 1137565039 /nfs/dbraw/zinc/56/50/39/1137565039.db2.gz BXHCORWZPWCFFY-SNVBAGLBSA-N 0 3 337.470 3.975 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCc1c(C)noc1C ZINC000872035549 1137566787 /nfs/dbraw/zinc/56/67/87/1137566787.db2.gz WXAREGONOJWKLI-JTQLQIEISA-N 0 3 335.429 3.815 20 5 EHBDHN CC(C)n1ncc2c1C[C@@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])CC2 ZINC000872067616 1137569516 /nfs/dbraw/zinc/56/95/16/1137569516.db2.gz ZSUOUTRZRMOIPS-JSGCOSHPSA-N 0 3 346.406 3.719 20 5 EHBDHN C[C@H](CC(=O)Nc1ccc(F)cc1)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872131254 1137573272 /nfs/dbraw/zinc/57/32/72/1137573272.db2.gz YXPGREOAGBOLEB-CHWSQXEVSA-N 0 3 345.374 3.802 20 5 EHBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)c1nccnc1C ZINC000872133457 1137573369 /nfs/dbraw/zinc/57/33/69/1137573369.db2.gz MUJNYDNKMCBGII-ZIAGYGMSSA-N 0 3 346.456 3.915 20 5 EHBDHN CCOc1cc(CN2CCC[C@@H](OC3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000872279229 1137577674 /nfs/dbraw/zinc/57/76/74/1137577674.db2.gz CXBDOVCVHGONNY-QGZVFWFLSA-N 0 3 348.443 3.917 20 5 EHBDHN COC(=O)Nc1cccc(CNCc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000873126577 1137590789 /nfs/dbraw/zinc/59/07/89/1137590789.db2.gz USGRDCQGFCILBQ-UHFFFAOYSA-N 0 3 343.383 3.680 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000877804831 1137690507 /nfs/dbraw/zinc/69/05/07/1137690507.db2.gz FAPDISZVZOJNPL-XEGUGMAKSA-N 0 3 344.333 3.661 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1nnc(CN2CCC[C@H]2C2CCCC2)o1 ZINC000877986060 1137698470 /nfs/dbraw/zinc/69/84/70/1137698470.db2.gz KILVPSYZPCFXLG-HNNXBMFYSA-N 0 3 342.399 3.799 20 5 EHBDHN C[C@@H]1CCC[C@H](C)CN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878128345 1137703582 /nfs/dbraw/zinc/70/35/82/1137703582.db2.gz CNZLIJAJKLBCMY-QWHCGFSZSA-N 0 3 330.388 3.655 20 5 EHBDHN O=[N+]([O-])c1ccc(OC2CCN(C[C@@H]3CCC4(CCC4)O3)CC2)cc1 ZINC000878148261 1137704456 /nfs/dbraw/zinc/70/44/56/1137704456.db2.gz FXGRXUUQUGJNBL-SFHVURJKSA-N 0 3 346.427 3.540 20 5 EHBDHN C[C@@H]1CCC[C@H](C)[C@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878351735 1137712172 /nfs/dbraw/zinc/71/21/72/1137712172.db2.gz YYYORIHGIMNKLG-ATCWAGBWSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@@H]1CC[C@H](NCc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C1 ZINC000878447310 1137716404 /nfs/dbraw/zinc/71/64/04/1137716404.db2.gz LKKDUMIJSFZSMP-DYEKYZERSA-N 0 3 330.388 3.559 20 5 EHBDHN CCC[C@@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)(C)C ZINC000878670272 1137724442 /nfs/dbraw/zinc/72/44/42/1137724442.db2.gz TUVCKZIDAUKTHE-CQSZACIVSA-N 0 3 332.404 3.949 20 5 EHBDHN CCOc1cc(CN2CC[C@@H](c3nc(C)cs3)C2)ccc1[N+](=O)[O-] ZINC000880012607 1137765427 /nfs/dbraw/zinc/76/54/27/1137765427.db2.gz VQNXSDMAYHSVMH-CQSZACIVSA-N 0 3 347.440 3.748 20 5 EHBDHN CC[C@@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCCOC1 ZINC000880469364 1137779647 /nfs/dbraw/zinc/77/96/47/1137779647.db2.gz KEDDAQTURDFCBJ-WMLDXEAASA-N 0 3 345.399 3.545 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000134777162 1137960657 /nfs/dbraw/zinc/96/06/57/1137960657.db2.gz BVODMWWGHIFQFK-HKUYNNGSSA-N 0 3 344.386 3.822 20 5 EHBDHN O=[N+]([O-])c1ccccc1C[C@@H](NCc1cc(C2CC2)no1)C1CC1 ZINC000886684679 1138115121 /nfs/dbraw/zinc/11/51/21/1138115121.db2.gz PVOHXFACGYNXCT-MRXNPFEDSA-N 0 3 327.384 3.571 20 5 EHBDHN COCc1ccccc1CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192632648 1140541977 /nfs/dbraw/zinc/54/19/77/1140541977.db2.gz NSSSMMMSRWWAOY-LJQANCHMSA-N 0 3 326.396 3.908 20 5 EHBDHN C[C@@H]1CN(C)[C@@H](C)CN1c1ccc2ccc3ccc(Cl)nc3c2n1 ZINC001164643637 719204460 /nfs/dbraw/zinc/20/44/60/719204460.db2.gz ZVADVIGMJFPKTK-QWHCGFSZSA-N 0 3 340.858 3.965 20 5 EHBDHN COc1cc(C[NH2+]C[C@@]2(C)C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1[O-] ZINC000339445879 1014500226 /nfs/dbraw/zinc/50/02/26/1014500226.db2.gz SOUWWHOEGVXOIB-HNAYVOBHSA-N 0 3 342.395 3.592 20 5 EHBDHN C[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000339503476 1014601701 /nfs/dbraw/zinc/60/17/01/1014601701.db2.gz BRMDSBXTLIXBTL-AOKXMQKFSA-N 0 3 344.436 3.696 20 5 EHBDHN CC(C)[C@@H](NCc1c(Cl)cccc1[N+](=O)[O-])C1(CO)CCC1 ZINC000339727277 1015608926 /nfs/dbraw/zinc/60/89/26/1015608926.db2.gz JVLDCZPXCUNRPF-OAHLLOKOSA-N 0 3 326.824 3.525 20 5 EHBDHN CCOC[C@@H](NCc1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000233734364 1015759385 /nfs/dbraw/zinc/75/93/85/1015759385.db2.gz DHTSDAMBZSUIDT-CYBMUJFWSA-N 0 3 345.237 3.508 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000075680406 1032651627 /nfs/dbraw/zinc/65/16/27/1032651627.db2.gz UYUQMSWONFHLRB-UONOGXRCSA-N 0 3 349.431 3.502 20 5 EHBDHN COc1ccc(C2CCN(Cc3cccc([N+](=O)[O-])c3C)CC2)nc1 ZINC000593041480 1032676714 /nfs/dbraw/zinc/67/67/14/1032676714.db2.gz QIBGRFRUWUMKKG-UHFFFAOYSA-N 0 3 341.411 3.686 20 5 EHBDHN CN(CCc1cccc([N+](=O)[O-])c1)Cc1cc(-c2ccccc2)no1 ZINC000549170409 1017486931 /nfs/dbraw/zinc/48/69/31/1017486931.db2.gz CFKJODGLSSNZFP-UHFFFAOYSA-N 0 3 337.379 3.924 20 5 EHBDHN CCS[C@@H]1CCCC[C@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000190064360 1017973723 /nfs/dbraw/zinc/97/37/23/1017973723.db2.gz NANVFCRWJOEMKS-IUODEOHRSA-N 0 3 335.429 3.890 20 5 EHBDHN C[C@H](NCc1cnn(C)c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151144327 1019377911 /nfs/dbraw/zinc/37/79/11/1019377911.db2.gz VYWYNTZOYSGXFA-LBPRGKRZSA-N 0 3 342.424 3.908 20 5 EHBDHN CC(C)(C)[C@H]1CCCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000280577322 1020481398 /nfs/dbraw/zinc/48/13/98/1020481398.db2.gz SMIFVZKJEVKUKJ-AWEZNQCLSA-N 0 3 344.415 3.903 20 5 EHBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000610516020 1021171428 /nfs/dbraw/zinc/17/14/28/1021171428.db2.gz VJHPYSSOWHHLOI-UKRRQHHQSA-N 0 3 331.441 3.979 20 5 EHBDHN Cc1ccc(C[C@H](C)NCc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000602559266 1032973485 /nfs/dbraw/zinc/97/34/85/1032973485.db2.gz XNJQINIUHKOCNS-JTQLQIEISA-N 0 3 331.397 3.827 20 5 EHBDHN CO[C@@](C)(CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000602677781 1033081527 /nfs/dbraw/zinc/08/15/27/1033081527.db2.gz UKUKOUWYPVZKRM-AWEZNQCLSA-N 0 3 332.322 3.518 20 5 EHBDHN Cc1ncc([C@H](C)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684816 1033085992 /nfs/dbraw/zinc/08/59/92/1033085992.db2.gz IQIBPTJSJWHWRW-WMLDXEAASA-N 0 3 340.427 3.942 20 5 EHBDHN O=C(C[C@@H]1CCCN1CCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000431002492 1023098697 /nfs/dbraw/zinc/09/86/97/1023098697.db2.gz ZFKSRTKKPUJPJE-INIZCTEOSA-N 0 3 344.436 3.936 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(Cc2cccc(-n3cccn3)c2)C2CC2)cc1 ZINC000507155636 1023162407 /nfs/dbraw/zinc/16/24/07/1023162407.db2.gz PQLRBNVNDNLDJX-UHFFFAOYSA-N 0 3 348.406 3.945 20 5 EHBDHN C[C@@H]1CCC[C@H](NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]1C ZINC000248552675 1024341264 /nfs/dbraw/zinc/34/12/64/1024341264.db2.gz JDODQEOSTWJJNY-XUJVJEKNSA-N 0 3 330.388 3.559 20 5 EHBDHN COc1c(O)ccc(CNCC2(C(F)(F)F)CCCC2)c1[N+](=O)[O-] ZINC000895656333 1024693266 /nfs/dbraw/zinc/69/32/66/1024693266.db2.gz JYBFLDVUYOLGFQ-UHFFFAOYSA-N 0 3 348.321 3.521 20 5 EHBDHN CCC(C)(C)N1CCN(C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CC1 ZINC000594101211 1033256408 /nfs/dbraw/zinc/25/64/08/1033256408.db2.gz XCQXVRAQJABQIV-UHFFFAOYSA-N 0 3 348.447 3.550 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1ccccc1Cn1ccnc1 ZINC000574530521 1033276055 /nfs/dbraw/zinc/27/60/55/1033276055.db2.gz BORYFPCPGXLAQG-IBGZPJMESA-N 0 3 348.406 3.617 20 5 EHBDHN Cc1ccccc1CCN(C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000451166170 1025625089 /nfs/dbraw/zinc/62/50/89/1025625089.db2.gz FSXFDZBXJWCOEL-UHFFFAOYSA-N 0 3 325.368 3.719 20 5 EHBDHN CC(=O)c1ccc(N[C@H](C)[C@@H](c2ccccc2)N(C)C)c([N+](=O)[O-])c1 ZINC000439128821 1025792646 /nfs/dbraw/zinc/79/26/46/1025792646.db2.gz PKKNKPZHMUKKLE-YJYMSZOUSA-N 0 3 341.411 3.901 20 5 EHBDHN Cc1c(-c2nc(-c3ccc(CN(C)C)cc3)no2)cccc1[N+](=O)[O-] ZINC000530632904 1026139430 /nfs/dbraw/zinc/13/94/30/1026139430.db2.gz AFXWBOUSGROLRF-UHFFFAOYSA-N 0 3 338.367 3.682 20 5 EHBDHN C[C@H](NCc1cccc(Cn2cccn2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178648505 1027265336 /nfs/dbraw/zinc/26/53/36/1027265336.db2.gz KNNCBDXSRFOFFQ-HNNXBMFYSA-N 0 3 336.395 3.690 20 5 EHBDHN CC(C)[C@@H](COCc1ccccc1)NCc1ccccc1[N+](=O)[O-] ZINC000446922665 1029854782 /nfs/dbraw/zinc/85/47/82/1029854782.db2.gz NIEWFPZHVATVPO-GOSISDBHSA-N 0 3 328.412 3.926 20 5 EHBDHN CCOc1ccc([C@H](C)N[C@H](C)c2cc[nH]c(=O)c2)cc1[N+](=O)[O-] ZINC000340448122 1030503362 /nfs/dbraw/zinc/50/33/62/1030503362.db2.gz GDUPUWUVPYTMNF-NWDGAFQWSA-N 0 3 331.372 3.506 20 5 EHBDHN C[C@H]1CCCC[C@@H]1N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623408 1030793340 /nfs/dbraw/zinc/79/33/40/1030793340.db2.gz AFUFJFGCNGIEKP-NHYWBVRUSA-N 0 3 339.823 3.697 20 5 EHBDHN C[C@@H](CC(=O)N(C)c1ccccc1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000296040317 1031167030 /nfs/dbraw/zinc/16/70/30/1031167030.db2.gz NZGVUYYVBBOFGS-GJZGRUSLSA-N 0 3 341.411 3.687 20 5 EHBDHN C[C@H](NC[C@H]1CCC[C@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC000926916527 1031273398 /nfs/dbraw/zinc/27/33/98/1031273398.db2.gz QDUBSAUDZWPPOT-MISXGVKJSA-N 0 3 332.322 3.745 20 5 EHBDHN C[C@@H]1C[C@@H](C)[C@@H](C)N(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000475728742 1031658976 /nfs/dbraw/zinc/65/89/76/1031658976.db2.gz CPDQPXJSTPIIGJ-JHJVBQTASA-N 0 3 330.388 3.511 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCNCc2ccc(C(F)(F)F)s2)cc1 ZINC000515197593 1033477375 /nfs/dbraw/zinc/47/73/75/1033477375.db2.gz MAMIESPIAACTGB-UHFFFAOYSA-N 0 3 346.330 3.844 20 5 EHBDHN Cc1nn(CN2CC[C@H](c3ccccc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761290383 1033488103 /nfs/dbraw/zinc/48/81/03/1033488103.db2.gz OTJAYRXUUVAXDJ-INIZCTEOSA-N 0 3 336.395 3.700 20 5 EHBDHN C[C@H](NCc1ccc(O[C@@H]2CCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000594923935 1033547560 /nfs/dbraw/zinc/54/75/60/1033547560.db2.gz HADRBSBWYULAQS-IFXJQAMLSA-N 0 3 342.395 3.613 20 5 EHBDHN CC1(C)[C@H](CNCc2cc([N+](=O)[O-])ccc2OC(F)F)C1(F)F ZINC000594990792 1033621437 /nfs/dbraw/zinc/62/14/37/1033621437.db2.gz ADRJUQLDFIHKAP-NSHDSACASA-N 0 3 336.285 3.577 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H](c1cccs1)N(C)C ZINC000595002903 1033628983 /nfs/dbraw/zinc/62/89/83/1033628983.db2.gz BEKHWQSRNHYPAX-DOMZBBRYSA-N 0 3 349.456 3.618 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CO[C@@H](C4CC4)C3)o2)cc1 ZINC000599007609 1033640185 /nfs/dbraw/zinc/64/01/85/1033640185.db2.gz QPLRZCUXFOCPRO-KBXCAEBGSA-N 0 3 328.368 3.512 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@H]3CO[C@@H](C4CC4)C3)o2)c1 ZINC000599006393 1033640271 /nfs/dbraw/zinc/64/02/71/1033640271.db2.gz HTWYBDMZTYYTAF-RDTXWAMCSA-N 0 3 328.368 3.512 20 5 EHBDHN C[C@H](COCC1CC1)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000593682579 1033753282 /nfs/dbraw/zinc/75/32/82/1033753282.db2.gz WEYFWKKHPRRIDQ-CYBMUJFWSA-N 0 3 330.384 3.760 20 5 EHBDHN Cc1noc(CN2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)c1[N+](=O)[O-] ZINC000595489382 1033812336 /nfs/dbraw/zinc/81/23/36/1033812336.db2.gz ABBHJUKMPPXTFV-BZUAXINKSA-N 0 3 327.384 3.659 20 5 EHBDHN CC[C@@H]1CCC[C@H](C)N1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000595868058 1034030838 /nfs/dbraw/zinc/03/08/38/1034030838.db2.gz RGXYGGLFIPCEMS-GXTWGEPZSA-N 0 3 330.388 3.798 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000599625115 1034072841 /nfs/dbraw/zinc/07/28/41/1034072841.db2.gz FZZHRHYDQOAXFV-QOBXEIRBSA-N 0 3 332.322 3.515 20 5 EHBDHN CC[C@@H](NCCN(C)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000310054807 1034210185 /nfs/dbraw/zinc/21/01/85/1034210185.db2.gz YOVLQJVXBNVUMT-OAHLLOKOSA-N 0 3 337.420 3.502 20 5 EHBDHN C/C(=C/C(=O)Nc1ccccc1CN(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000785216469 1034296351 /nfs/dbraw/zinc/29/63/51/1034296351.db2.gz CTDIWOINISGOGC-OWBHPGMISA-N 0 3 339.395 3.698 20 5 EHBDHN C[C@H](O)C1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000597233838 1034613863 /nfs/dbraw/zinc/61/38/63/1034613863.db2.gz AWPJQNJHRGUXBV-JTQLQIEISA-N 0 3 336.775 3.511 20 5 EHBDHN CCOc1cc(N(C)CCCN(C)Cc2ccco2)ccc1[N+](=O)[O-] ZINC000343818135 1034787176 /nfs/dbraw/zinc/78/71/76/1034787176.db2.gz ZFEQSTXNXSGKFR-UHFFFAOYSA-N 0 3 347.415 3.545 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)[C@@H]1CCCc2c1cnn2C ZINC000615835123 1035027921 /nfs/dbraw/zinc/02/79/21/1035027921.db2.gz PURRORKVIFRPAP-RXEWJAMOSA-N 0 3 340.427 3.741 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612584139 1035076760 /nfs/dbraw/zinc/07/67/60/1035076760.db2.gz RSZVAGLVYHLWKK-GOSISDBHSA-N 0 3 330.359 3.696 20 5 EHBDHN CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000164554236 1035666992 /nfs/dbraw/zinc/66/69/92/1035666992.db2.gz CQQVUZMRQVZUCV-HOCLYGCPSA-N 0 3 349.431 3.645 20 5 EHBDHN CCOc1cc(CN(CCc2nccs2)C(C)C)ccc1[N+](=O)[O-] ZINC000492584127 1036031755 /nfs/dbraw/zinc/03/17/55/1036031755.db2.gz UDVUWSIZOYYEIQ-UHFFFAOYSA-N 0 3 349.456 3.903 20 5 EHBDHN Cc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000056201740 1036139443 /nfs/dbraw/zinc/13/94/43/1036139443.db2.gz YEWDODNKXBSBLW-KBPBESRZSA-N 0 3 327.384 3.581 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN[C@H](C)[C@@H]1Oc2ccccc2[C@H]1C ZINC000541691065 1036562464 /nfs/dbraw/zinc/56/24/64/1036562464.db2.gz URABNAIBUJMKBI-VLXJIEOASA-N 0 3 342.395 3.646 20 5 EHBDHN CCOc1cccc(N[C@H]2CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000310831174 1036913369 /nfs/dbraw/zinc/91/33/69/1036913369.db2.gz YXIIDBRCVPPYJT-INIZCTEOSA-N 0 3 341.411 3.680 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](SC)C(C)(C)C ZINC000542315659 1037282032 /nfs/dbraw/zinc/28/20/32/1037282032.db2.gz UJUWOJIACNVBET-OAHLLOKOSA-N 0 3 326.462 3.861 20 5 EHBDHN CCC[C@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000193042376 1037297978 /nfs/dbraw/zinc/29/79/78/1037297978.db2.gz VUUBRQOPDPFNOA-SFHVURJKSA-N 0 3 341.411 3.689 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc(CN3CCCC[C@H]3C3CCC3)n2)cc1 ZINC000592198939 1037943758 /nfs/dbraw/zinc/94/37/58/1037943758.db2.gz MTWLXNQUWKXYPE-INIZCTEOSA-N 0 3 342.399 3.799 20 5 EHBDHN Cc1ccc([C@H](C)NCCOc2ncccc2Cl)cc1[N+](=O)[O-] ZINC000090408294 1038055461 /nfs/dbraw/zinc/05/54/61/1038055461.db2.gz MOYCORZASYGXEI-LBPRGKRZSA-N 0 3 335.791 3.681 20 5 EHBDHN CCN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCO1 ZINC000511540508 1038362285 /nfs/dbraw/zinc/36/22/85/1038362285.db2.gz HZQZSCOMOVGRDH-CQSZACIVSA-N 0 3 330.384 3.856 20 5 EHBDHN C[C@H]1CC(C)(C)CC[C@@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000481117030 1040363477 /nfs/dbraw/zinc/36/34/77/1040363477.db2.gz QFPHWJQJMOTNLO-WFASDCNBSA-N 0 3 344.415 3.949 20 5 EHBDHN CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCCC[C@H]1O ZINC000555420385 1040556154 /nfs/dbraw/zinc/55/61/54/1040556154.db2.gz GXVWRWVKWOIUED-IAQYHMDHSA-N 0 3 346.349 3.597 20 5 EHBDHN Cc1ccc([C@@H](C)NCCC(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000164977344 1042580916 /nfs/dbraw/zinc/58/09/16/1042580916.db2.gz AMCNDAGWSQBHCU-CQSZACIVSA-N 0 3 327.384 3.583 20 5 EHBDHN C[C@@H](NC[C@@H](O)c1cc(F)cc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000279542810 1044209140 /nfs/dbraw/zinc/20/91/40/1044209140.db2.gz QGJDBLKZLRGOQZ-QLJPJBMISA-N 0 3 338.766 3.772 20 5 EHBDHN CS(=O)(=O)[C@@H]1CCN(Cc2c3ccccc3cc3ccccc32)C1 ZINC000282256059 1128132703 /nfs/dbraw/zinc/13/27/03/1128132703.db2.gz BMRGFSQXPPQGAM-QGZVFWFLSA-N 0 3 339.460 3.612 20 5 EHBDHN CO[C@@H](c1ccccc1F)[C@@H](C)NCc1ccc([N+](=O)[O-])cc1C ZINC000542725225 1128563106 /nfs/dbraw/zinc/56/31/06/1128563106.db2.gz ZOPHUXMGXXLCBB-FZKQIMNGSA-N 0 3 332.375 3.908 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@@H]2c2ccncc2)cc1 ZINC000153854096 1128776263 /nfs/dbraw/zinc/77/62/63/1128776263.db2.gz PKBPIBWZFMSCIR-GOSISDBHSA-N 0 3 327.384 3.596 20 5 EHBDHN Cc1nc(NC[C@H](c2cccs2)N2CCCC2)ccc1[N+](=O)[O-] ZINC000301657100 1128846788 /nfs/dbraw/zinc/84/67/88/1128846788.db2.gz SFMXKZMFXFREEX-CQSZACIVSA-N 0 3 332.429 3.609 20 5 EHBDHN CC1(C)CC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)O1 ZINC000495165378 1120973444 /nfs/dbraw/zinc/97/34/44/1120973444.db2.gz DTVMSKXWZPOMJG-INIZCTEOSA-N 0 3 330.384 3.902 20 5 EHBDHN CCC[C@@H](NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000193630414 1121514608 /nfs/dbraw/zinc/51/46/08/1121514608.db2.gz XAYUXTXJKAYUDV-QGZVFWFLSA-N 0 3 341.411 3.973 20 5 EHBDHN CCCC(=O)Nc1ccc(CNCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000917137375 1122531127 /nfs/dbraw/zinc/53/11/27/1122531127.db2.gz MBAOFRNXDDCAKX-UHFFFAOYSA-N 0 3 341.411 3.932 20 5 EHBDHN CN(C)[C@@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1cccs1 ZINC000301807420 1129106720 /nfs/dbraw/zinc/10/67/20/1129106720.db2.gz WLPAMTSKAMWAMW-LBPRGKRZSA-N 0 3 327.356 3.649 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCOCC2(CCCC2)C1 ZINC000615838774 1123885253 /nfs/dbraw/zinc/88/52/53/1123885253.db2.gz CHYYPNGXYRDDJB-LFIBNONCSA-N 0 3 330.428 3.891 20 5 EHBDHN CSC1(CNc2cc(C)nc3ccc([N+](=O)[O-])cc32)CCOCC1 ZINC000272802772 1124634574 /nfs/dbraw/zinc/63/45/74/1124634574.db2.gz DZXUDWMNTQLAAT-UHFFFAOYSA-N 0 3 347.440 3.776 20 5 EHBDHN C[C@]1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO[C@H]1C1CC1 ZINC000543242501 1129366752 /nfs/dbraw/zinc/36/67/52/1129366752.db2.gz QWYHRVXJECBNQF-OALUTQOASA-N 0 3 342.395 3.902 20 5 EHBDHN C[C@@H](N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000701878121 1130178554 /nfs/dbraw/zinc/17/85/54/1130178554.db2.gz JYAIVDKNIFZNSQ-QWHCGFSZSA-N 0 3 337.420 3.501 20 5 EHBDHN C[C@@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C[C@H](C)O ZINC000246055817 1130338885 /nfs/dbraw/zinc/33/88/85/1130338885.db2.gz YRPNWGWIWNQGAB-ZRGWGRIASA-N 0 3 328.412 3.681 20 5 EHBDHN CC[C@@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000738417611 1131469190 /nfs/dbraw/zinc/46/91/90/1131469190.db2.gz RAQBFCDBVOTHAZ-SJORKVTESA-N 0 3 336.338 3.647 20 5 EHBDHN O=[N+]([O-])c1ccccc1CCNCc1ccc(CSC(F)F)o1 ZINC000742379909 1131718440 /nfs/dbraw/zinc/71/84/40/1131718440.db2.gz FYCOIUHZGMMZGK-UHFFFAOYSA-N 0 3 342.367 3.976 20 5 EHBDHN Cc1cc([C@H]2CCCN2[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910419 1131916983 /nfs/dbraw/zinc/91/69/83/1131916983.db2.gz ZFIDFAGNRXRWQF-VQIMIIECSA-N 0 3 341.411 3.976 20 5 EHBDHN C[C@@H](c1ccccc1)[C@H](CO)NCc1ccc([N+](=O)[O-])cc1Cl ZINC001168991820 1132626037 /nfs/dbraw/zinc/62/60/37/1132626037.db2.gz CERNDIOBGIMJKF-SJCJKPOMSA-N 0 3 334.803 3.502 20 5 EHBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCSC[C@H]2c2cccc(Cl)c2)C1 ZINC001169037128 1132636719 /nfs/dbraw/zinc/63/67/19/1132636719.db2.gz JBPHTXISHRIDJD-WQVCFCJDSA-N 0 3 340.876 3.875 20 5 EHBDHN NCc1ccc2c(n1)N(c1ccc([N+](=O)[O-])c3ccccc31)CCC2 ZINC001169590767 1132790247 /nfs/dbraw/zinc/79/02/47/1132790247.db2.gz NINMECXDOGWMEL-UHFFFAOYSA-N 0 3 334.379 3.686 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@@H](c3nc4c(s3)CCC4)C2)c1 ZINC001176234819 1132883627 /nfs/dbraw/zinc/88/36/27/1132883627.db2.gz IOYLJBAHHHHOKK-CQSZACIVSA-N 0 3 343.452 3.920 20 5 EHBDHN CC(C)CC[C@H]1CCCN1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767766834 1133050029 /nfs/dbraw/zinc/05/00/29/1133050029.db2.gz XWISEZADOXSUPF-MRXNPFEDSA-N 0 3 343.431 3.711 20 5 EHBDHN CN(CC(=O)Nc1cc2cccnc2c2ncccc12)C1CCCC1 ZINC001180628791 1133400903 /nfs/dbraw/zinc/40/09/03/1133400903.db2.gz AOWBKDGKWUKVDU-UHFFFAOYSA-N 0 3 334.423 3.596 20 5 EHBDHN COc1cccc2c1CC[C@H]2N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788631773 1134153770 /nfs/dbraw/zinc/15/37/70/1134153770.db2.gz MWZZSBBOSVDGHN-BDJLRTHQSA-N 0 3 327.384 3.524 20 5 EHBDHN COc1ccc(C[C@@H](C)N[C@H](C)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC001170297604 1134737002 /nfs/dbraw/zinc/73/70/02/1134737002.db2.gz QPHNAKGPHUIHCJ-ZYHUDNBSSA-N 0 3 335.429 3.650 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCc3c(C)cccc3C2)c([N+](=O)[O-])c1 ZINC001170330108 1134749798 /nfs/dbraw/zinc/74/97/98/1134749798.db2.gz YVPDKJGSVZBVNA-HNNXBMFYSA-N 0 3 340.423 3.901 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCC[C@@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344944 1134758211 /nfs/dbraw/zinc/75/82/11/1134758211.db2.gz FSOCCLMTBDCXFX-WCQYABFASA-N 0 3 328.359 3.512 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2C[C@H]3[C@H](C[C@@H]3c3ccccc3)C2)c(F)c1 ZINC001196899319 1135628461 /nfs/dbraw/zinc/62/84/61/1135628461.db2.gz UMWJSTFDUBNEIG-NXHRZFHOSA-N 0 3 326.371 3.969 20 5 EHBDHN CC(C)c1ccc2c(c1)CCN(C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC001198845364 1135859938 /nfs/dbraw/zinc/85/99/38/1135859938.db2.gz ZKYHRQHJZABMAR-HXUWFJFHSA-N 0 3 340.423 3.810 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCCc3cscn3)o2)c1 ZINC001201140856 1135988129 /nfs/dbraw/zinc/98/81/29/1135988129.db2.gz QACWSBBUEZZPIM-UHFFFAOYSA-N 0 3 329.381 3.644 20 5 EHBDHN Cc1cccc2c1OC[C@@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)C2 ZINC000811518393 1136098233 /nfs/dbraw/zinc/09/82/33/1136098233.db2.gz MQJXFMPTCOVTNG-AWEZNQCLSA-N 0 3 332.787 3.650 20 5 EHBDHN Cc1c2cc(F)ccc2oc1CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275871 1136129918 /nfs/dbraw/zinc/12/99/18/1136129918.db2.gz HYPFLQFOSDPSLA-MRXNPFEDSA-N 0 3 344.342 3.612 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC[C@@](C)(O)c1ccccc1 ZINC000850462394 1136264246 /nfs/dbraw/zinc/26/42/46/1136264246.db2.gz NYKQYMIBXZROPK-AUUYWEPGSA-N 0 3 344.411 3.552 20 5 EHBDHN CC(COC(=O)c1cn(Cc2ccccc2)c2ccccc12)[N+](=O)[O-] ZINC000813110838 1136294160 /nfs/dbraw/zinc/29/41/60/1136294160.db2.gz KKOSHDQVNZLBMI-CQSZACIVSA-N 0 3 338.363 3.512 20 5 EHBDHN CC(COC(=O)C1(c2c(Cl)cccc2Cl)CCC1)[N+](=O)[O-] ZINC000813110283 1136294819 /nfs/dbraw/zinc/29/48/19/1136294819.db2.gz WMKPHZQCBXRTRK-VIFPVBQESA-N 0 3 332.183 3.624 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CNC2(c3cccc(Cl)c3)CC2)cc1 ZINC000776604830 1136468649 /nfs/dbraw/zinc/46/86/49/1136468649.db2.gz HTUMYYUIKDLWTE-INIZCTEOSA-N 0 3 332.787 3.561 20 5 EHBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@](O)(c2ccccc2)C1 ZINC000859586367 1137021427 /nfs/dbraw/zinc/02/14/27/1137021427.db2.gz NNUFMVNEJLHNMS-BEFAXECRSA-N 0 3 326.396 3.639 20 5 EHBDHN CC([C@@H](OC(=O)c1ccc(C(F)F)o1)c1ccccc1F)[N+](=O)[O-] ZINC000860854804 1137081262 /nfs/dbraw/zinc/08/12/62/1137081262.db2.gz JQLLRYYMKPDYIM-ISVAXAHUSA-N 0 3 343.257 3.920 20 5 EHBDHN CC(C)(C)[C@@H]1CCCN(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000794707003 1137239254 /nfs/dbraw/zinc/23/92/54/1137239254.db2.gz SBKSBRWXHGQUMZ-OAHLLOKOSA-N 0 3 343.431 3.569 20 5 EHBDHN COc1ccc(CN[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000865831985 1137314970 /nfs/dbraw/zinc/31/49/70/1137314970.db2.gz FQYVHXLQALZZDO-VXGBXAGGSA-N 0 3 330.306 3.590 20 5 EHBDHN CC([C@@H](OC(=O)[C@H](C)c1ccccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845881189 1137316768 /nfs/dbraw/zinc/31/67/68/1137316768.db2.gz ZENLTFVNDZVPQR-IIYDPXPESA-N 0 3 331.343 3.879 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2nonc2c1 ZINC000846783286 1137365409 /nfs/dbraw/zinc/36/54/09/1137365409.db2.gz NKSDQUGAOSGJNB-UHFFFAOYSA-N 0 3 326.356 3.542 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCc3ccccc3OC2)c(Cl)c1 ZINC000509444570 1137467825 /nfs/dbraw/zinc/46/78/25/1137467825.db2.gz RUIYQDBIJOXMDA-CQSZACIVSA-N 0 3 332.787 3.732 20 5 EHBDHN Cc1ccc([C@@H](C)NC[C@H](O)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000124746062 1137608320 /nfs/dbraw/zinc/60/83/20/1137608320.db2.gz HJDYQJLKPRJTHQ-DIFFPNOSSA-N 0 3 336.338 3.566 20 5 EHBDHN C[C@@H]1CCCC[C@]1(C)NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878699151 1137725611 /nfs/dbraw/zinc/72/56/11/1137725611.db2.gz NYOQHZFUAZQRBJ-PXAZEXFGSA-N 0 3 330.388 3.703 20 5 EHBDHN CCC1(CC)CCCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000880093807 1137768031 /nfs/dbraw/zinc/76/80/31/1137768031.db2.gz LJTZBTSEYUDTTD-UHFFFAOYSA-N 0 3 330.388 3.799 20 5 EHBDHN C[C@@H](c1ccncc1)N1CCC(Nc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000119294021 1137940224 /nfs/dbraw/zinc/94/02/24/1137940224.db2.gz BGBCEWOBSFEVDY-ZDUSSCGKSA-N 0 3 344.390 3.766 20 5 EHBDHN Cc1c(NC(=O)c2cccc(CN3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000060551548 1138067148 /nfs/dbraw/zinc/06/71/48/1138067148.db2.gz BQMGKOWZKSVPRU-UHFFFAOYSA-N 0 3 339.395 3.751 20 5 EHBDHN C[C@@H](O)CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000061011972 1138067303 /nfs/dbraw/zinc/06/73/03/1138067303.db2.gz NSGRTNJVWWUZJD-LLVKDONJSA-N 0 3 336.775 3.511 20 5 EHBDHN Cc1nc(C2CCN(Cc3cc([N+](=O)[O-])ccc3Cl)CC2)[nH]c1C ZINC000886665671 1138111440 /nfs/dbraw/zinc/11/14/40/1138111440.db2.gz DMFQNYBNYZLARV-UHFFFAOYSA-N 0 3 348.834 3.968 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000079324890 1138155134 /nfs/dbraw/zinc/15/51/34/1138155134.db2.gz MBNRSNNKAQZDDM-ZIAGYGMSSA-N 0 3 327.384 3.581 20 5 EHBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CCCc2c[nH]nc21 ZINC000271558778 1141397305 /nfs/dbraw/zinc/39/73/05/1141397305.db2.gz WIBDAPHEKCVWEI-KGLIPLIRSA-N 0 3 346.456 3.856 20 5 EHBDHN C[C@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cc[nH]c(=O)c1 ZINC000339457977 1014520995 /nfs/dbraw/zinc/52/09/95/1014520995.db2.gz JTJGRLKUUKYZNW-LBPRGKRZSA-N 0 3 339.351 3.806 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000157668299 1015183892 /nfs/dbraw/zinc/18/38/92/1015183892.db2.gz FNKYSVFIBUGZAY-AWEZNQCLSA-N 0 3 348.786 3.607 20 5 EHBDHN CCC[C@H](NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000485201333 1032377109 /nfs/dbraw/zinc/37/71/09/1032377109.db2.gz GVLLDSHRXYYJKJ-INIZCTEOSA-N 0 3 341.411 3.973 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN1CCC(c2c[nH]c3ncccc23)CC1 ZINC000118837630 1017627057 /nfs/dbraw/zinc/62/70/57/1017627057.db2.gz BNAZDKOAJDMBSY-UHFFFAOYSA-N 0 3 336.395 3.851 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCC2(CC2(F)F)CC1 ZINC000593072676 1032769888 /nfs/dbraw/zinc/76/98/88/1032769888.db2.gz KPOCBSHESXTGLK-UHFFFAOYSA-N 0 3 326.343 3.615 20 5 EHBDHN CO[C@@H]([C@H](C)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000449627035 1032923038 /nfs/dbraw/zinc/92/30/38/1032923038.db2.gz FOKDNRWCYAKQKN-SGTLLEGYSA-N 0 3 330.384 3.758 20 5 EHBDHN Cc1ccc(CCNCc2cc(Br)c([N+](=O)[O-])s2)o1 ZINC000602510725 1032948030 /nfs/dbraw/zinc/94/80/30/1032948030.db2.gz MFWPKZNKKXKTIK-UHFFFAOYSA-N 0 3 345.218 3.653 20 5 EHBDHN CO[C@@H]([C@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000449633533 1032966255 /nfs/dbraw/zinc/96/62/55/1032966255.db2.gz ULVVFSATIJVLKE-SGTLLEGYSA-N 0 3 330.384 3.758 20 5 EHBDHN CCOC1CC(N(C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000516603619 1021581357 /nfs/dbraw/zinc/58/13/57/1021581357.db2.gz DPAIMNNLETXMMA-UHFFFAOYSA-N 0 3 330.384 3.854 20 5 EHBDHN CCCCN(Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@@H](C)CC ZINC000172895307 1033001139 /nfs/dbraw/zinc/00/11/39/1033001139.db2.gz HILLBUJZHDGFTR-AWEZNQCLSA-N 0 3 331.420 3.711 20 5 EHBDHN Cc1ccc(C2CCN(Cc3ccc(C)c([N+](=O)[O-])c3)CC2)cn1 ZINC000341562948 1022345294 /nfs/dbraw/zinc/34/52/94/1022345294.db2.gz LDPCRIHDHKXCFX-UHFFFAOYSA-N 0 3 325.412 3.986 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CNCC3CCC(F)(F)CC3)nc2c1 ZINC000602654034 1033054769 /nfs/dbraw/zinc/05/47/69/1033054769.db2.gz SOYXOTMPMMQEJH-UHFFFAOYSA-N 0 3 325.315 3.651 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(Cc3cnn(C4CCC4)c3)C2)cc1 ZINC000894719610 1022791085 /nfs/dbraw/zinc/79/10/85/1022791085.db2.gz PEHRBYNKUVQWSP-KRWDZBQOSA-N 0 3 340.427 3.896 20 5 EHBDHN O=C(CN[C@H](CC1CC1)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000610831071 1023780651 /nfs/dbraw/zinc/78/06/51/1023780651.db2.gz LZACGELWXJJKGE-QGZVFWFLSA-N 0 3 339.395 3.664 20 5 EHBDHN C[C@@H]1CC2(CC(NCc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)CO1 ZINC000897776528 1033162285 /nfs/dbraw/zinc/16/22/85/1033162285.db2.gz SBLKVCYWIXMNPM-ZZJLNTIPSA-N 0 3 344.333 3.661 20 5 EHBDHN COc1cc(C[NH2+]CC[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1[O-] ZINC000507942995 1024788960 /nfs/dbraw/zinc/78/89/60/1024788960.db2.gz WLTKSPGRPPBJBI-CYBMUJFWSA-N 0 3 330.384 3.592 20 5 EHBDHN CC(C)c1ccc(CN2CCC[C@](CO)(C(C)C)C2)cc1[N+](=O)[O-] ZINC000521083815 1025193036 /nfs/dbraw/zinc/19/30/36/1025193036.db2.gz XCKFYDNRMLBWTC-IBGZPJMESA-N 0 3 334.460 3.949 20 5 EHBDHN CC1(C)CCCC[C@@H]1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000119927085 1025434187 /nfs/dbraw/zinc/43/41/87/1025434187.db2.gz PAUMYXIDGBLDIK-AWEZNQCLSA-N 0 3 330.388 3.703 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2Cc3[nH]c4ccccc4c3C2)c(Cl)c1 ZINC000442852937 1025550064 /nfs/dbraw/zinc/55/00/64/1025550064.db2.gz YRXFWRUYQIPMEV-LBPRGKRZSA-N 0 3 341.798 3.987 20 5 EHBDHN Cc1ccn(-c2ccccc2CN[C@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000127667985 1026279318 /nfs/dbraw/zinc/27/93/18/1026279318.db2.gz NQIPIHDFIPLOFR-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN CC(=O)c1ccc(NC[C@@H](C)N(C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000347318100 1026580975 /nfs/dbraw/zinc/58/09/75/1026580975.db2.gz RKXZWMLXMKUJCN-CQSZACIVSA-N 0 3 341.411 3.730 20 5 EHBDHN CN(C)[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)c1cccs1 ZINC000729629835 1027369741 /nfs/dbraw/zinc/36/97/41/1027369741.db2.gz GFDZWPMVINMMMT-LBPRGKRZSA-N 0 3 348.453 3.981 20 5 EHBDHN Cc1ccc2nccc(N3CCOc4ccc([N+](=O)[O-])cc4C3)c2c1 ZINC000582757980 1027607067 /nfs/dbraw/zinc/60/70/67/1027607067.db2.gz AVQATDLPAVYNHD-UHFFFAOYSA-N 0 3 335.363 3.850 20 5 EHBDHN COc1ccc(OCCN(C)Cc2ccc(F)c(C)c2)c([N+](=O)[O-])c1 ZINC000444739467 1028226633 /nfs/dbraw/zinc/22/66/33/1028226633.db2.gz RSMQBVRLWQWGHY-UHFFFAOYSA-N 0 3 348.374 3.562 20 5 EHBDHN CC[C@H](NCc1ccc2c(c1)OCCCO2)c1cccc([N+](=O)[O-])c1 ZINC000161920849 1028360089 /nfs/dbraw/zinc/36/00/89/1028360089.db2.gz MVFDDLNXNFJVDM-KRWDZBQOSA-N 0 3 342.395 3.997 20 5 EHBDHN CCCCN1CCCC[C@H]1CNc1ncc([N+](=O)[O-])cc1Cl ZINC000524236645 1029014988 /nfs/dbraw/zinc/01/49/88/1029014988.db2.gz YZWNNPKZDZPTHA-LBPRGKRZSA-N 0 3 326.828 3.710 20 5 EHBDHN Nc1ccc2c(c1)CCC[C@H]2NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000841059220 1029717218 /nfs/dbraw/zinc/71/72/18/1029717218.db2.gz NKXIQNYIEXCQFD-MRXNPFEDSA-N 0 3 331.803 3.998 20 5 EHBDHN CN(C)c1cccc([C@@H]2CCCN2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000525271802 1029767501 /nfs/dbraw/zinc/76/75/01/1029767501.db2.gz RUVNFWYNTYLZFP-IBGZPJMESA-N 0 3 325.412 3.998 20 5 EHBDHN Cc1ccc([C@H](C)NCc2ccccc2-n2ccnc2)cc1[N+](=O)[O-] ZINC000152235065 1029802717 /nfs/dbraw/zinc/80/27/17/1029802717.db2.gz LVBXDOKODQBNNV-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN CC(C)(CO)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453268787 1030004948 /nfs/dbraw/zinc/00/49/48/1030004948.db2.gz BHUMIOVHGVZULW-SFHVURJKSA-N 0 3 328.412 3.682 20 5 EHBDHN CC[C@H](C)N[C@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000343272884 1030037197 /nfs/dbraw/zinc/03/71/97/1030037197.db2.gz VXJHWFBFDQRZTJ-GXFFZTMASA-N 0 3 338.795 3.778 20 5 EHBDHN C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)CC1CCCC1 ZINC000064021343 1030397107 /nfs/dbraw/zinc/39/71/07/1030397107.db2.gz LYOBQJFISICCKL-LLVKDONJSA-N 0 3 339.823 3.697 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H](c2nc(C)no2)C1 ZINC000347365245 1031902121 /nfs/dbraw/zinc/90/21/21/1031902121.db2.gz SZUBITLGGQRBPE-RCBBPTIPSA-N 0 3 342.399 3.569 20 5 EHBDHN COC(=O)c1ccc2c(c1)[C@@H](NCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000594500741 1033401799 /nfs/dbraw/zinc/40/17/99/1033401799.db2.gz AUYBRKPVCFDWQP-SFHVURJKSA-N 0 3 340.379 3.549 20 5 EHBDHN CC(C)[C@@H]1CCCC[C@@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000460350126 1033529296 /nfs/dbraw/zinc/52/92/96/1033529296.db2.gz UWKZVLKNBSREBN-HOTGVXAUSA-N 0 3 344.415 3.949 20 5 EHBDHN CCC1(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCOCC1 ZINC000537508597 1033537391 /nfs/dbraw/zinc/53/73/91/1033537391.db2.gz XIXOTUPDUCSMOP-UHFFFAOYSA-N 0 3 347.440 3.767 20 5 EHBDHN CCO[C@H]1C[C@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000595071432 1033646003 /nfs/dbraw/zinc/64/60/03/1033646003.db2.gz ZBLQSUIHUACVBM-BHIYHBOVSA-N 0 3 326.396 3.841 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C1CC1)[C@@H]1CCCCO1 ZINC000595044488 1033662579 /nfs/dbraw/zinc/66/25/79/1033662579.db2.gz ALYJPADQFRQXRL-ULFGMLNVSA-N 0 3 334.416 3.602 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F ZINC000593013359 1033805365 /nfs/dbraw/zinc/80/53/65/1033805365.db2.gz IAVWYLSAJOYQOK-NEPJUHHUSA-N 0 3 346.305 3.589 20 5 EHBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000595467665 1033822195 /nfs/dbraw/zinc/82/21/95/1033822195.db2.gz SPTZADJTEBLXAR-LZLYRXPVSA-N 0 3 336.407 3.640 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN(Cc2cccc(F)c2)C2CC2)c1 ZINC000603859173 1033982766 /nfs/dbraw/zinc/98/27/66/1033982766.db2.gz JCGKWRKYHIIEFE-UHFFFAOYSA-N 0 3 330.359 3.777 20 5 EHBDHN CN(Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@@H]1CCc2ccccc21 ZINC000595881793 1034017755 /nfs/dbraw/zinc/01/77/55/1034017755.db2.gz WSSMANCLKGFVCX-AWEZNQCLSA-N 0 3 337.379 3.898 20 5 EHBDHN CC(C)(C)CCN1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000603942746 1034058258 /nfs/dbraw/zinc/05/82/58/1034058258.db2.gz UTWIFRPBNQLNEP-UHFFFAOYSA-N 0 3 342.443 3.701 20 5 EHBDHN COc1cc(N2CCCN(C(C)(C)C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596097527 1034060229 /nfs/dbraw/zinc/06/02/29/1034060229.db2.gz YRRJXODWJRFGRR-UHFFFAOYSA-N 0 3 341.839 3.567 20 5 EHBDHN COc1ccc(C[C@@H](C)CN(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000537620060 1034196535 /nfs/dbraw/zinc/19/65/35/1034196535.db2.gz OTKPILRHYDIZJA-OAHLLOKOSA-N 0 3 328.412 3.914 20 5 EHBDHN CCOC1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000179499626 1034341261 /nfs/dbraw/zinc/34/12/61/1034341261.db2.gz GGYJAJCMKUNQIH-UHFFFAOYSA-N 0 3 330.384 3.856 20 5 EHBDHN CCC[C@@](C)(O)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492223242 1035511595 /nfs/dbraw/zinc/51/15/95/1035511595.db2.gz KJPKBMVZVVPMOW-RBUKOAKNSA-N 0 3 328.412 3.825 20 5 EHBDHN CC(C)[C@@H](O)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000493050286 1036580066 /nfs/dbraw/zinc/58/00/66/1036580066.db2.gz BKIQFWBDZJERCU-OALUTQOASA-N 0 3 328.412 3.681 20 5 EHBDHN COc1ccc(COCCNC(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000590020173 1036707030 /nfs/dbraw/zinc/70/70/30/1036707030.db2.gz FOYVASZWPSVVFB-UHFFFAOYSA-N 0 3 344.411 3.645 20 5 EHBDHN CC[C@H](C)[C@@H](O)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180531562 1036922803 /nfs/dbraw/zinc/92/28/03/1036922803.db2.gz OSXQVIVIVROWSG-JVPBZIDWSA-N 0 3 328.412 3.681 20 5 EHBDHN COc1ccccc1CCN(C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761512792 1037086399 /nfs/dbraw/zinc/08/63/99/1037086399.db2.gz XECGQDBPGNRQBR-UHFFFAOYSA-N 0 3 334.803 3.931 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1C[C@H]1Cc1ccccc1 ZINC000462751803 1037364700 /nfs/dbraw/zinc/36/47/00/1037364700.db2.gz CFKAMZYKGYEIPL-QAPCUYQASA-N 0 3 326.396 3.714 20 5 EHBDHN C[C@H]1C[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)CN1C1CC1 ZINC000177185160 1037410540 /nfs/dbraw/zinc/41/05/40/1037410540.db2.gz CRTWYUFDTRZXTO-GOEBONIOSA-N 0 3 345.446 3.743 20 5 EHBDHN CO[C@H]1CCC[C@H]1CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000540328650 1037825115 /nfs/dbraw/zinc/82/51/15/1037825115.db2.gz OWBCTZQYDFUUMM-BBRMVZONSA-N 0 3 347.440 3.623 20 5 EHBDHN O=[N+]([O-])c1cccc(CN[C@@H](c2ccccc2)C2(CO)CC=CC2)c1 ZINC000592175282 1037915950 /nfs/dbraw/zinc/91/59/50/1037915950.db2.gz JSJQRTIGKRVTGE-IBGZPJMESA-N 0 3 338.407 3.754 20 5 EHBDHN Cc1ccc([C@@H](C)NC(=O)[C@@H](C(C)C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000488052303 1038811142 /nfs/dbraw/zinc/81/11/42/1038811142.db2.gz CAAVDNCDDZIRIV-CRAIPNDOSA-N 0 3 347.459 3.591 20 5 EHBDHN CC(C)(CNCc1csc([N+](=O)[O-])c1)Oc1cc(F)cc(F)c1 ZINC000512511525 1039553698 /nfs/dbraw/zinc/55/36/98/1039553698.db2.gz IODJGFUXMVDBOE-UHFFFAOYSA-N 0 3 342.367 3.882 20 5 EHBDHN CSc1ccc(C(=O)Nc2cccc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000192839952 1040437916 /nfs/dbraw/zinc/43/79/16/1040437916.db2.gz FKEHTDVDYDROLA-UHFFFAOYSA-N 0 3 345.424 3.631 20 5 EHBDHN CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCCC[C@H]1O ZINC000555420388 1040557237 /nfs/dbraw/zinc/55/72/37/1040557237.db2.gz GXVWRWVKWOIUED-XHDPSFHLSA-N 0 3 346.349 3.597 20 5 EHBDHN CC[C@@H](N[C@@H](C)c1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000192848835 1040573305 /nfs/dbraw/zinc/57/33/05/1040573305.db2.gz JRULVDWBAONMII-YVEFUNNKSA-N 0 3 342.399 3.887 20 5 EHBDHN C[C@H](CN(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000066854519 1041241864 /nfs/dbraw/zinc/24/18/64/1041241864.db2.gz QCVNWMDOXGJSKO-CQSZACIVSA-N 0 3 342.395 3.697 20 5 EHBDHN CC[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CC1(C)C ZINC000419313681 1041249546 /nfs/dbraw/zinc/24/95/46/1041249546.db2.gz GNHFZXJFHWBANZ-KBPBESRZSA-N 0 3 330.388 3.559 20 5 EHBDHN CN(C)Cc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000024643617 1041572015 /nfs/dbraw/zinc/57/20/15/1041572015.db2.gz MXTYREGKCQHMKB-UHFFFAOYSA-N 0 3 333.775 3.562 20 5 EHBDHN Cc1ccc([C@H](C)NC[C@@H](c2ccco2)N2CCCC2)cc1[N+](=O)[O-] ZINC000120315906 1042390204 /nfs/dbraw/zinc/39/02/04/1042390204.db2.gz HXSFQSJUXLYBPP-YJBOKZPZSA-N 0 3 343.427 3.984 20 5 EHBDHN O=[N+]([O-])c1cc(CNC[C@@H](O)CC2CCCC2)cc(C(F)(F)F)c1 ZINC000568619784 1042802760 /nfs/dbraw/zinc/80/27/60/1042802760.db2.gz IRSFRGBTZOSKQN-HNNXBMFYSA-N 0 3 346.349 3.644 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2cnn(CN3CC[C@H](c4ccccc4)C3)c2)cc1 ZINC000728899653 1043716125 /nfs/dbraw/zinc/71/61/25/1043716125.db2.gz KJHDMFZDWITBAS-SFHVURJKSA-N 0 3 348.406 3.905 20 5 EHBDHN Cc1cc([N+](=O)[O-])cnc1NC[C@@H](c1cccs1)N1CCCC1 ZINC000301553668 1128497042 /nfs/dbraw/zinc/49/70/42/1128497042.db2.gz WBHHQCRTJIBFBZ-AWEZNQCLSA-N 0 3 332.429 3.609 20 5 EHBDHN CCC[C@H](NCc1ccc(C(=O)NC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000327011371 1128583823 /nfs/dbraw/zinc/58/38/23/1128583823.db2.gz MOGNSGDGCMHPNB-SFHVURJKSA-N 0 3 341.411 3.585 20 5 EHBDHN COC(=O)c1oc([C@@H](C)N(C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000554847836 1128717046 /nfs/dbraw/zinc/71/70/46/1128717046.db2.gz GDQKFPSWKAVNOK-CYBMUJFWSA-N 0 3 346.383 3.518 20 5 EHBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000089513253 1121277425 /nfs/dbraw/zinc/27/74/25/1121277425.db2.gz KTLBDBCFRUGLAA-LBPRGKRZSA-N 0 3 339.395 3.675 20 5 EHBDHN O=[N+]([O-])c1cc(F)c(NC2CCN(Cc3ccccc3)CC2)c(F)c1 ZINC000301784284 1129074294 /nfs/dbraw/zinc/07/42/94/1129074294.db2.gz KXDTXJPNCVFJBE-UHFFFAOYSA-N 0 3 347.365 3.950 20 5 EHBDHN C[C@@H](N[C@@H](C)CCc1ccccc1[N+](=O)[O-])c1c(F)cncc1F ZINC000556916373 1123201146 /nfs/dbraw/zinc/20/11/46/1123201146.db2.gz IDLJTEXNDQOAPZ-NWDGAFQWSA-N 0 3 335.354 3.940 20 5 EHBDHN COCCN(CCCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000065958746 1129115489 /nfs/dbraw/zinc/11/54/89/1129115489.db2.gz CMIXAUDSMNPHAB-UHFFFAOYSA-N 0 3 328.412 3.676 20 5 EHBDHN CC[C@@H]1c2ccccc2CCN1CCOc1ccccc1[N+](=O)[O-] ZINC000609625623 1123628202 /nfs/dbraw/zinc/62/82/02/1123628202.db2.gz CXKDLVUASJAOFQ-QGZVFWFLSA-N 0 3 326.396 3.983 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000609672670 1123641648 /nfs/dbraw/zinc/64/16/48/1123641648.db2.gz WAOXMCXHAVGYLV-HOCLYGCPSA-N 0 3 326.396 3.981 20 5 EHBDHN COc1cccc([C@@H](CNc2ccc(Cl)cc2[N+](=O)[O-])N(C)C)c1 ZINC000301245064 1123739489 /nfs/dbraw/zinc/73/94/89/1123739489.db2.gz ZRKLYZZASFFNQU-QGZVFWFLSA-N 0 3 349.818 3.972 20 5 EHBDHN COc1cc(CN2CC[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000155064278 1129610097 /nfs/dbraw/zinc/61/00/97/1129610097.db2.gz DKXCNFMJRDSZBC-HNNXBMFYSA-N 0 3 342.395 3.602 20 5 EHBDHN C[C@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H](C)C1 ZINC000246802489 1130414391 /nfs/dbraw/zinc/41/43/91/1130414391.db2.gz SUSAXAMKTUKPHK-STQMWFEESA-N 0 3 330.388 3.513 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@H](N1CCCC(F)(F)[C@H](F)C1)CC2 ZINC001172905331 1131886939 /nfs/dbraw/zinc/88/69/39/1131886939.db2.gz RFKALELCSMBZLM-GDBMZVCRSA-N 0 3 342.361 3.911 20 5 EHBDHN O=[N+]([O-])c1ccc(N2CCN(CCC3CC3)CC2)c(C(F)(F)F)c1 ZINC000743845857 1131984247 /nfs/dbraw/zinc/98/42/47/1131984247.db2.gz SQFCWWAWKKQWAL-UHFFFAOYSA-N 0 3 343.349 3.536 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]1COCc1ccccc1 ZINC001173225936 1132006823 /nfs/dbraw/zinc/00/68/23/1132006823.db2.gz GTJQWEGJIAHDJY-OXJNMPFZSA-N 0 3 340.423 3.817 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(C(F)(F)F)o1 ZINC001173227523 1132008115 /nfs/dbraw/zinc/00/81/15/1132008115.db2.gz GSWSFFZSVHEIKV-JTQLQIEISA-N 0 3 328.290 3.927 20 5 EHBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCSC[C@@H]2c2cccc(Cl)c2)C1 ZINC001169037127 1132636653 /nfs/dbraw/zinc/63/66/53/1132636653.db2.gz JBPHTXISHRIDJD-UHOFOFEASA-N 0 3 340.876 3.875 20 5 EHBDHN CC(C)[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCN1C ZINC001175473735 1132676489 /nfs/dbraw/zinc/67/64/89/1132676489.db2.gz XGPJMNKQNFZMSY-CQSZACIVSA-N 0 3 346.258 3.674 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@@H](CN2CCCCC2)c2ccccc2)cs1 ZINC001169188538 1132686861 /nfs/dbraw/zinc/68/68/61/1132686861.db2.gz XYXHBAFGAPDNTI-KRWDZBQOSA-N 0 3 345.468 3.973 20 5 EHBDHN C[C@@H](c1ccccc1)[C@H](CO)NCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000766967251 1132924490 /nfs/dbraw/zinc/92/44/90/1132924490.db2.gz IGQNOMCBQIYNBI-LRDDRELGSA-N 0 3 334.803 3.502 20 5 EHBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])NCc1noc2cc(F)ccc12 ZINC001183481175 1133812469 /nfs/dbraw/zinc/81/24/69/1133812469.db2.gz FDEFQFSFQOUVNI-GFCCVEGCSA-N 0 3 343.358 3.986 20 5 EHBDHN COC[C@@H](Cc1ccccc1)N(C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000789584988 1134299054 /nfs/dbraw/zinc/29/90/54/1134299054.db2.gz UKPYNFTYIXXTTK-MRXNPFEDSA-N 0 3 348.830 3.938 20 5 EHBDHN CCCCO[C@H]1C[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(C)C ZINC001170118489 1134327019 /nfs/dbraw/zinc/32/70/19/1134327019.db2.gz QXANYTVPNYAAFJ-CVEARBPZSA-N 0 3 346.431 3.545 20 5 EHBDHN CO[C@@H]1[C@@H](C)[C@@H](NCc2cc([N+](=O)[O-])ccc2OC(C)C)C1(C)C ZINC001170397972 1134763971 /nfs/dbraw/zinc/76/39/71/1134763971.db2.gz BWVPFEYDSAIGLM-JCURWCKSSA-N 0 3 336.432 3.531 20 5 EHBDHN CCC[C@@H](NCc1ccc([N+](=O)[O-])cc1F)[C@@H](O)c1ccccc1 ZINC000793239053 1134885698 /nfs/dbraw/zinc/88/56/98/1134885698.db2.gz QJWPSNUTAPMPAD-MSOLQXFVSA-N 0 3 332.375 3.726 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCc1cc(C)ccc1F ZINC001202426711 1136140670 /nfs/dbraw/zinc/14/06/70/1136140670.db2.gz MADFACPFIHTMAR-UHFFFAOYSA-N 0 3 332.375 3.773 20 5 EHBDHN Cc1ccc(-c2cc(C(=O)OCC(C)[N+](=O)[O-])c3ccccc3n2)o1 ZINC000813104652 1136288292 /nfs/dbraw/zinc/28/82/92/1136288292.db2.gz FRFQOLMNUYDKKC-LLVKDONJSA-N 0 3 340.335 3.625 20 5 EHBDHN CC(COC(=O)c1cc(-c2cccs2)nc2ccccc21)[N+](=O)[O-] ZINC000813104492 1136288452 /nfs/dbraw/zinc/28/84/52/1136288452.db2.gz NGHOBQRFQMTQFM-NSHDSACASA-N 0 3 342.376 3.785 20 5 EHBDHN CCc1ccccc1O[C@H](C(=O)OCC(C)[N+](=O)[O-])c1ccccc1 ZINC000813110249 1136294699 /nfs/dbraw/zinc/29/46/99/1136294699.db2.gz VQWCXIBLQKOLOW-KSSFIOAISA-N 0 3 343.379 3.578 20 5 EHBDHN CC(C)[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C1(CO)CCC1 ZINC000814169702 1136415038 /nfs/dbraw/zinc/41/50/38/1136415038.db2.gz MEGJEUVESOMRNS-HNNXBMFYSA-N 0 3 326.824 3.525 20 5 EHBDHN CC1(C)CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000776591401 1136453430 /nfs/dbraw/zinc/45/34/30/1136453430.db2.gz MECOHKIAHSLRCG-ROUUACIJSA-N 0 3 326.396 3.711 20 5 EHBDHN CC(C)Oc1ccccc1[C@H](C)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776606605 1136470592 /nfs/dbraw/zinc/47/05/92/1136470592.db2.gz YJSCDWIOZNNSBX-KBXCAEBGSA-N 0 3 344.411 3.766 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CC[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000814667689 1136492374 /nfs/dbraw/zinc/49/23/74/1136492374.db2.gz VDVXLLXOYROSNY-CRAIPNDOSA-N 0 3 346.814 3.771 20 5 EHBDHN CC(C)OCc1ccccc1CN[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815566136 1136611911 /nfs/dbraw/zinc/61/19/11/1136611911.db2.gz JRVHDKWZJLNKDI-AWEZNQCLSA-N 0 3 343.427 3.953 20 5 EHBDHN C[C@@H](NC[C@H]1COC2(CCC(C)CC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776740094 1136620035 /nfs/dbraw/zinc/62/00/35/1136620035.db2.gz IEXHTURWYJIJHP-HGDQPMEPSA-N 0 3 334.416 3.567 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCCC1(O)CCC1 ZINC000817413807 1136806276 /nfs/dbraw/zinc/80/62/76/1136806276.db2.gz ALVBUWRMYMNWDM-UHFFFAOYSA-N 0 3 333.215 3.686 20 5 EHBDHN CC[C@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000817414681 1136806738 /nfs/dbraw/zinc/80/67/38/1136806738.db2.gz ICZMXEJNNGWRTH-RYUDHWBXSA-N 0 3 333.215 3.949 20 5 EHBDHN Cc1cc2c(o1)CC(C)(C)C[C@H]2NC[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818961855 1136891551 /nfs/dbraw/zinc/89/15/51/1136891551.db2.gz VVOIPONRXYOYGE-SJORKVTESA-N 0 3 344.411 3.833 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@H]2CCO[C@H](c3ccncc3)C2)c1 ZINC000824949074 1137158992 /nfs/dbraw/zinc/15/89/92/1137158992.db2.gz XGIRVTLZIPFVQN-YOEHRIQHSA-N 0 3 347.802 3.653 20 5 EHBDHN Cc1cccc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845873081 1137316250 /nfs/dbraw/zinc/31/62/50/1137316250.db2.gz BAUBRCMJSQPIKV-FZKQIMNGSA-N 0 3 331.343 3.626 20 5 EHBDHN CC[C@H](CC(F)F)C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845878647 1137316578 /nfs/dbraw/zinc/31/65/78/1137316578.db2.gz HYBKQJAWRUHAPY-RULNRJAQSA-N 0 3 333.306 3.757 20 5 EHBDHN CC([C@H](OC(=O)CCCOC(C)(C)C)c1ccccc1F)[N+](=O)[O-] ZINC000845883823 1137317082 /nfs/dbraw/zinc/31/70/82/1137317082.db2.gz WFPMMFVMXQEKEK-LRDDRELGSA-N 0 3 341.379 3.671 20 5 EHBDHN CN1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc2ccccc2c2cccnc12 ZINC000874842446 1137624623 /nfs/dbraw/zinc/62/46/23/1137624623.db2.gz HMSGIULCUUKMML-WOJBJXKFSA-N 0 3 345.446 3.697 20 5 EHBDHN C[C@@H]1CCC[C@H](NCc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1C ZINC000878446543 1137716408 /nfs/dbraw/zinc/71/64/08/1137716408.db2.gz GNYSIRQZZLGKCH-BZPMIXESSA-N 0 3 330.388 3.559 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1nnc(CN(CC2CC2)CC2CCC2)o1 ZINC000878544200 1137719496 /nfs/dbraw/zinc/71/94/96/1137719496.db2.gz NVKQQTOZYXQJBM-UHFFFAOYSA-N 0 3 342.399 3.657 20 5 EHBDHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000089580875 1138201892 /nfs/dbraw/zinc/20/18/92/1138201892.db2.gz DDPXDURRZJZSDJ-CYBMUJFWSA-N 0 3 346.431 3.584 20 5 EHBDHN CC[C@@H](NCc1ccnc(N2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000131447856 1138518401 /nfs/dbraw/zinc/51/84/01/1138518401.db2.gz CPWCDIKZCJLAHW-GOSISDBHSA-N 0 3 340.427 3.831 20 5 EHBDHN Cc1c([C@@H](C)NC[C@@H]2COC3(CCC(C)CC3)O2)cccc1[N+](=O)[O-] ZINC000777311264 1139567700 /nfs/dbraw/zinc/56/77/00/1139567700.db2.gz AYOJDMNMENZCKH-BYGOXVSRSA-N 0 3 348.443 3.876 20 5 EHBDHN CCCC(=O)NC[C@H]1CCCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182736962 1139989244 /nfs/dbraw/zinc/98/92/44/1139989244.db2.gz ZFPVKUUNPBDOFW-JKSUJKDBSA-N 0 3 347.459 3.593 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ccc3c(c1)OCCO3)CCC2 ZINC000192603336 1140539504 /nfs/dbraw/zinc/53/95/04/1140539504.db2.gz XHPAQZLIABUUGE-QGZVFWFLSA-N 0 3 340.379 3.533 20 5 EHBDHN C[C@H](N[C@@H](C)c1ccc2c(c1)CC(=O)N2C)c1ccc([N+](=O)[O-])cc1 ZINC000267460866 1140793896 /nfs/dbraw/zinc/79/38/96/1140793896.db2.gz VBFIZNNVCDHYPJ-STQMWFEESA-N 0 3 339.395 3.526 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCCCC[C@@H]2c2ccco2)c1 ZINC000269633877 1141130150 /nfs/dbraw/zinc/13/01/50/1141130150.db2.gz GNBCBKDESGSINQ-SJORKVTESA-N 0 3 330.384 3.839 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@@H](O)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271025740 1141296512 /nfs/dbraw/zinc/29/65/12/1141296512.db2.gz BBXDJHABSSFHEL-YVEFUNNKSA-N 0 3 348.374 3.517 20 5 EHBDHN CC[C@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000340153734 1016507691 /nfs/dbraw/zinc/50/76/91/1016507691.db2.gz BKZUJMQUUZUVBB-KDOFPFPSSA-N 0 3 341.411 3.971 20 5 EHBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@H](C)c1nc2c(s1)CCC2 ZINC000459645385 1032367738 /nfs/dbraw/zinc/36/77/38/1032367738.db2.gz GKDWITWLUBHBKE-VXGBXAGGSA-N 0 3 331.441 3.822 20 5 EHBDHN C[C@@H]1CCC[C@@H](C)C1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000182955989 1019851983 /nfs/dbraw/zinc/85/19/83/1019851983.db2.gz NQERNQCGGRZCJV-VXGBXAGGSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510403173 1020767315 /nfs/dbraw/zinc/76/73/15/1020767315.db2.gz UDIOURXSBPUGRQ-RDTXWAMCSA-N 0 3 336.395 3.953 20 5 EHBDHN O=[N+]([O-])c1sc(CNCCc2ccsc2)cc1Br ZINC000602511582 1032947378 /nfs/dbraw/zinc/94/73/78/1032947378.db2.gz OZSJLJIMSMDYCC-UHFFFAOYSA-N 0 3 347.259 3.813 20 5 EHBDHN CCN(CCOc1ccccc1OC)Cc1cccc([N+](=O)[O-])c1 ZINC000051086032 1021116753 /nfs/dbraw/zinc/11/67/53/1021116753.db2.gz WYYCNTZEPOWULT-UHFFFAOYSA-N 0 3 330.384 3.504 20 5 EHBDHN Cc1ccc(C[C@@H](C)NCc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000602559275 1032973769 /nfs/dbraw/zinc/97/37/69/1032973769.db2.gz XNJQINIUHKOCNS-SNVBAGLBSA-N 0 3 331.397 3.827 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC[C@H](c2cccs2)N2CCCC2)n1 ZINC000178150583 1021794095 /nfs/dbraw/zinc/79/40/95/1021794095.db2.gz KRGYHAIJHXCZBF-CQSZACIVSA-N 0 3 332.429 3.609 20 5 EHBDHN Cc1nn(C(C)C)c(C)c1CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000894392415 1021837617 /nfs/dbraw/zinc/83/76/17/1021837617.db2.gz YMAUDTNVNXOZIM-UHFFFAOYSA-N 0 3 330.432 3.664 20 5 EHBDHN C[C@@H]1CCC[C@@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000026468218 1033055137 /nfs/dbraw/zinc/05/51/37/1033055137.db2.gz UUHSYJINJVXCEZ-DGCLKSJQSA-N 0 3 339.823 3.697 20 5 EHBDHN CCNC(=O)c1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000156517217 1022495571 /nfs/dbraw/zinc/49/55/71/1022495571.db2.gz JNFJUGDBOSLXOX-AWEZNQCLSA-N 0 3 341.411 3.504 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@H](c2ccccc2C)C1 ZINC000507180880 1023165666 /nfs/dbraw/zinc/16/56/66/1023165666.db2.gz OSZLZQVJNGERBD-HNNXBMFYSA-N 0 3 326.396 3.901 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](c2ccccc2C)C1 ZINC000507180881 1023165748 /nfs/dbraw/zinc/16/57/48/1023165748.db2.gz OSZLZQVJNGERBD-OAHLLOKOSA-N 0 3 326.396 3.901 20 5 EHBDHN CC1=NO[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000895311373 1024268476 /nfs/dbraw/zinc/26/84/76/1024268476.db2.gz PPBMEMBZOGWEDB-CQSZACIVSA-N 0 3 331.397 3.578 20 5 EHBDHN COCCNc1ccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000127077193 1025680166 /nfs/dbraw/zinc/68/01/66/1025680166.db2.gz VTGPNKKCOKUGPG-OAHLLOKOSA-N 0 3 343.427 3.812 20 5 EHBDHN CCOC(C)(C)CNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000436414181 1025695027 /nfs/dbraw/zinc/69/50/27/1025695027.db2.gz QJOXJFLEQKFQNW-UHFFFAOYSA-N 0 3 348.399 3.768 20 5 EHBDHN CCC[C@@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000451427333 1025968290 /nfs/dbraw/zinc/96/82/90/1025968290.db2.gz WYEZLQISHKJEBA-CQSZACIVSA-N 0 3 332.404 3.949 20 5 EHBDHN COC1(CNCc2cc([N+](=O)[O-])ccc2OC(F)F)CCCCC1 ZINC000479418915 1026626749 /nfs/dbraw/zinc/62/67/49/1026626749.db2.gz GVTKJNPOTOVXKL-UHFFFAOYSA-N 0 3 344.358 3.635 20 5 EHBDHN C[C@@H](NC(=O)c1cc2ccccc2c2cccnc12)C1=CCN(C)CC1 ZINC000272949628 1027192195 /nfs/dbraw/zinc/19/21/95/1027192195.db2.gz MRAIMZSQIOPHEJ-OAHLLOKOSA-N 0 3 345.446 3.768 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000302755987 1027454199 /nfs/dbraw/zinc/45/41/99/1027454199.db2.gz GDPGUKBJAMHOOU-OAHLLOKOSA-N 0 3 331.803 3.935 20 5 EHBDHN CCCN(CCc1cccs1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444684048 1028154891 /nfs/dbraw/zinc/15/48/91/1028154891.db2.gz KDCNKWCAJNRVTK-UHFFFAOYSA-N 0 3 344.440 3.987 20 5 EHBDHN C[C@@H](NCc1ccc(-n2ccnc2)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000153673379 1028556262 /nfs/dbraw/zinc/55/62/62/1028556262.db2.gz KOEJXIZSDLLPNI-CYBMUJFWSA-N 0 3 340.358 3.770 20 5 EHBDHN CC(C)(C)[C@H]1CCCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000475630563 1028924617 /nfs/dbraw/zinc/92/46/17/1028924617.db2.gz GVUDRGNISXPOED-HNNXBMFYSA-N 0 3 334.416 3.719 20 5 EHBDHN CCc1nc(C)c([C@@H](C)N(C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000525122505 1029694996 /nfs/dbraw/zinc/69/49/96/1029694996.db2.gz IIDXBUDFIRTVRO-CYBMUJFWSA-N 0 3 349.456 3.994 20 5 EHBDHN CCOC(=O)[C@]1(C(C)C)CCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000446890942 1029842297 /nfs/dbraw/zinc/84/22/97/1029842297.db2.gz RKEAYSJBNSWOIL-GXVATQTDSA-N 0 3 346.427 3.519 20 5 EHBDHN CN(CC=Cc1ccccc1[N+](=O)[O-])Cc1cc(C(C)(C)C)[nH]n1 ZINC000447075158 1029922596 /nfs/dbraw/zinc/92/25/96/1029922596.db2.gz BNUCVAQRDRZPHC-VQHVLOKHSA-N 0 3 328.416 3.761 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC[C@H](c2ccc(Cl)cc2)N(C)C)n1 ZINC000532217626 1030485894 /nfs/dbraw/zinc/48/58/94/1030485894.db2.gz BKWBTXMKZLTMFI-OAHLLOKOSA-N 0 3 334.807 3.666 20 5 EHBDHN CCC[C@H](C)[C@H]1CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267981 1030514657 /nfs/dbraw/zinc/51/46/57/1030514657.db2.gz PLWBTDCXRCYIBG-SUMWQHHRSA-N 0 3 334.416 3.862 20 5 EHBDHN CCn1nc(C)c(CNC/C(C)=C\c2cccc([N+](=O)[O-])c2)c1C ZINC000527038641 1030586914 /nfs/dbraw/zinc/58/69/14/1030586914.db2.gz RBOYTODWGFNRQX-LCYFTJDESA-N 0 3 328.416 3.621 20 5 EHBDHN C[C@@H]1C[C@H](C)[C@@H](C)N(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000475728740 1031659070 /nfs/dbraw/zinc/65/90/70/1031659070.db2.gz CPDQPXJSTPIIGJ-FRRDWIJNSA-N 0 3 330.388 3.511 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@H](c2nc(C)no2)C1 ZINC000347365246 1031900192 /nfs/dbraw/zinc/90/01/92/1031900192.db2.gz SZUBITLGGQRBPE-WQMJKPAKSA-N 0 3 342.399 3.569 20 5 EHBDHN CCc1cnc(CCN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)s1 ZINC000595025003 1033617499 /nfs/dbraw/zinc/61/74/99/1033617499.db2.gz JDBTUXKKCKIXCF-NSHDSACASA-N 0 3 335.429 3.516 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC(C)(C)c1ccc(C)cn1 ZINC000599069711 1033710613 /nfs/dbraw/zinc/71/06/13/1033710613.db2.gz VGTSHZKPPUTUSJ-CQSZACIVSA-N 0 3 343.427 3.935 20 5 EHBDHN C[C@H](COCC1CC1)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000593682501 1033753528 /nfs/dbraw/zinc/75/35/28/1033753528.db2.gz QSSMKXCVBZNDSI-CYBMUJFWSA-N 0 3 330.384 3.760 20 5 EHBDHN Cc1cc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000593118291 1033966725 /nfs/dbraw/zinc/96/67/25/1033966725.db2.gz POFDSYBOCUCIPG-NEPJUHHUSA-N 0 3 346.305 3.589 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCC(F)CC1 ZINC000595818812 1033992877 /nfs/dbraw/zinc/99/28/77/1033992877.db2.gz JZRLFDXNJZLIAA-DCBWTQNWSA-N 0 3 348.378 3.651 20 5 EHBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@@H]2c2ccc(O)cc2)c1 ZINC000604484186 1034388655 /nfs/dbraw/zinc/38/86/55/1034388655.db2.gz CNHSJGNVLHAVGU-GOSISDBHSA-N 0 3 328.368 3.516 20 5 EHBDHN COc1cc(CNC2CC(C)(C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000597239422 1034618742 /nfs/dbraw/zinc/61/87/42/1034618742.db2.gz KUAPFQVKXWOLAG-UHFFFAOYSA-N 0 3 344.358 3.526 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC([C@H]2CCCCO2)CC1 ZINC000597225011 1034625957 /nfs/dbraw/zinc/62/59/57/1034625957.db2.gz LOTZPSJAFNQSCE-SUOMESGTSA-N 0 3 330.428 3.889 20 5 EHBDHN CC(C)n1ncc2c1C[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000365139437 1034923502 /nfs/dbraw/zinc/92/35/02/1034923502.db2.gz RWUNUMNOACHQNQ-CQSZACIVSA-N 0 3 348.834 3.673 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCc2ccccn2)c2ccccc2)c1 ZINC000179966959 1035095486 /nfs/dbraw/zinc/09/54/86/1035095486.db2.gz DTSPELOIYVHPOY-FQEVSTJZSA-N 0 3 333.391 3.912 20 5 EHBDHN O=[N+]([O-])c1cc(CNC[C@@H]2CCCN(c3ccccc3)C2)cs1 ZINC000365503326 1035367054 /nfs/dbraw/zinc/36/70/54/1035367054.db2.gz DYWHUGCMYRGASP-AWEZNQCLSA-N 0 3 331.441 3.663 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000589200177 1036305325 /nfs/dbraw/zinc/30/53/25/1036305325.db2.gz VQUVAWFZZFZSGV-YQIFSTGGSA-N 0 3 330.428 3.747 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CNC1(c2ccccc2)CCOCC1 ZINC000541776655 1036628991 /nfs/dbraw/zinc/62/89/91/1036628991.db2.gz SFDGVNMDWFOBTQ-UHFFFAOYSA-N 0 3 326.396 3.699 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(CN(C)C)c2)c1C ZINC000888137971 1036700903 /nfs/dbraw/zinc/70/09/03/1036700903.db2.gz GTQFQYVEIUDSOI-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN C[C@@H](N[C@@H]1CCCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191290591 1036889680 /nfs/dbraw/zinc/88/96/80/1036889680.db2.gz GKIYEJFGJXXJCQ-BXUZGUMPSA-N 0 3 330.388 3.874 20 5 EHBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@H](CCO)c1ccccc1 ZINC000539826868 1037252123 /nfs/dbraw/zinc/25/21/23/1037252123.db2.gz CTVPUZGPAFOGBW-RLGIIYIFSA-N 0 3 326.396 3.664 20 5 EHBDHN CC[C@@H]1CCCC[C@@H]1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000163410796 1037381168 /nfs/dbraw/zinc/38/11/68/1037381168.db2.gz XTSAZFUQMBCSMZ-DOMZBBRYSA-N 0 3 330.388 3.703 20 5 EHBDHN COc1ccc(CN[C@H]2c3cc(F)ccc3C[C@H]2C)cc1[N+](=O)[O-] ZINC000540173946 1037641594 /nfs/dbraw/zinc/64/15/94/1037641594.db2.gz NLMBMVKLTCKRAJ-ADLMAVQZSA-N 0 3 330.359 3.766 20 5 EHBDHN CC[C@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341221651 1037780786 /nfs/dbraw/zinc/78/07/86/1037780786.db2.gz QVBHBQJKBYYJCC-GUYCJALGSA-N 0 3 327.384 3.663 20 5 EHBDHN Cc1cc(C)cc([C@@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000540410483 1037909054 /nfs/dbraw/zinc/90/90/54/1037909054.db2.gz ZNLCJWYWDFNHES-HUUCEWRRSA-N 0 3 341.411 3.889 20 5 EHBDHN CC[C@H](NCCOc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000540446157 1037946663 /nfs/dbraw/zinc/94/66/63/1037946663.db2.gz PBJNYYHDIRJOME-HNNXBMFYSA-N 0 3 336.338 3.993 20 5 EHBDHN COc1ccc(CN2CCC[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000552274210 1039145408 /nfs/dbraw/zinc/14/54/08/1039145408.db2.gz HBRJOOGAUSKDQN-QGZVFWFLSA-N 0 3 326.396 3.983 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCCC[C@@H](C)C1 ZINC000248557217 1042526802 /nfs/dbraw/zinc/52/68/02/1042526802.db2.gz LJGJAQVSCLQIHB-CHWSQXEVSA-N 0 3 330.388 3.828 20 5 EHBDHN O=[N+]([O-])c1cc(CNC2(CO)CC2)ccc1Oc1ccccc1Cl ZINC000120373491 1042771290 /nfs/dbraw/zinc/77/12/90/1042771290.db2.gz MNBFAUUXSAKGMB-UHFFFAOYSA-N 0 3 348.786 3.655 20 5 EHBDHN Cc1c([C@@H](C)N[C@H](C)c2ccc(NC(N)=O)cc2)cccc1[N+](=O)[O-] ZINC000165435124 1042814629 /nfs/dbraw/zinc/81/46/29/1042814629.db2.gz SEUBGSDNDNVAGX-CHWSQXEVSA-N 0 3 342.399 3.806 20 5 EHBDHN C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2ccnn2)cc1 ZINC000090879383 1127081776 /nfs/dbraw/zinc/08/17/76/1127081776.db2.gz MQYGOFPBLUKSJB-KGLIPLIRSA-N 0 3 337.383 3.587 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(C[S@](C)=O)cc1 ZINC000552317875 1127749049 /nfs/dbraw/zinc/74/90/49/1127749049.db2.gz JWEQKVYLLIKZAQ-BSEYFRJRSA-N 0 3 346.452 3.633 20 5 EHBDHN C[C@@H](N[C@H](C)C1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172171402 1127798768 /nfs/dbraw/zinc/79/87/68/1127798768.db2.gz UHIUAKVAROPBOS-VXGBXAGGSA-N 0 3 330.388 3.874 20 5 EHBDHN O=[N+]([O-])c1cc(CNC2(CO)CCC2)ccc1Oc1ccc(F)cc1 ZINC000347642836 1128504872 /nfs/dbraw/zinc/50/48/72/1128504872.db2.gz CVIAIKRFSMKHKX-UHFFFAOYSA-N 0 3 346.358 3.531 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCSc3ccc(F)cc32)cc1 ZINC000765844698 1128547383 /nfs/dbraw/zinc/54/73/83/1128547383.db2.gz HXFKTPKBPJGEMF-HOTGVXAUSA-N 0 3 348.399 3.594 20 5 EHBDHN COC(=O)Nc1cccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000495744929 1121396341 /nfs/dbraw/zinc/39/63/41/1121396341.db2.gz IWGSYAVMHCGDNK-LBPRGKRZSA-N 0 3 329.356 3.624 20 5 EHBDHN Cc1c(CNCc2ccc([N+](=O)[O-])cc2)sc2nc(C)nc(C)c12 ZINC000916839558 1122364471 /nfs/dbraw/zinc/36/44/71/1122364471.db2.gz FSQCVJJIRLNBFK-UHFFFAOYSA-N 0 3 342.424 3.815 20 5 EHBDHN C[C@@H]1c2ccccc2CCN1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609315894 1123374068 /nfs/dbraw/zinc/37/40/68/1123374068.db2.gz IQSGGOIHQPGAQQ-OAHLLOKOSA-N 0 3 326.396 3.983 20 5 EHBDHN C[C@H](O)CN(Cc1cc([N+](=O)[O-])ccc1Cl)C1CCCCC1 ZINC000735491941 1131353259 /nfs/dbraw/zinc/35/32/59/1131353259.db2.gz LZLIJMWUGCMYAB-LBPRGKRZSA-N 0 3 326.824 3.764 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)N(C)C[C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181740 1129316363 /nfs/dbraw/zinc/31/63/63/1129316363.db2.gz IYXZSELUSQFTLB-LSDHHAIUSA-N 0 3 331.416 3.518 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(C[C@@H](O)CCc2ccccc2)C2CC2)cc1 ZINC000543439704 1129490075 /nfs/dbraw/zinc/49/00/75/1129490075.db2.gz HHOAKQILQQZDBW-FQEVSTJZSA-N 0 3 340.423 3.553 20 5 EHBDHN Cc1c(CN(Cc2ccccc2)[C@@H](C)CCO)cccc1[N+](=O)[O-] ZINC000093303985 1129583721 /nfs/dbraw/zinc/58/37/21/1129583721.db2.gz QOCXCOAJOWXQBT-HNNXBMFYSA-N 0 3 328.412 3.676 20 5 EHBDHN COc1ccc(CNC(C)(C)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000390056858 1129601849 /nfs/dbraw/zinc/60/18/49/1129601849.db2.gz OQMWZGLERRWCQC-UHFFFAOYSA-N 0 3 344.411 3.688 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)NC(C)(C)c2cccs2)cccc1[N+](=O)[O-] ZINC000543506118 1129908616 /nfs/dbraw/zinc/90/86/16/1129908616.db2.gz ODUBJZFHYXZTGB-LBPRGKRZSA-N 0 3 347.440 3.817 20 5 EHBDHN C[C@@H]1CC(C)(C)C[C@@](CO)(NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000740008098 1131515855 /nfs/dbraw/zinc/51/58/55/1131515855.db2.gz WSJLIYZEHPRLSQ-PXAZEXFGSA-N 0 3 340.851 3.915 20 5 EHBDHN C[C@@H]1CN(Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])cc1F ZINC000740869884 1131551121 /nfs/dbraw/zinc/55/11/21/1131551121.db2.gz BQOLHSCBKGPEMM-OAHLLOKOSA-N 0 3 343.402 3.835 20 5 EHBDHN CCN(CC)[C@@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccco1 ZINC000742564853 1131747949 /nfs/dbraw/zinc/74/79/49/1131747949.db2.gz YBEBBWCLXJCHLD-HNNXBMFYSA-N 0 3 348.359 3.591 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2ccccc2F)c1F ZINC001173175010 1131991470 /nfs/dbraw/zinc/99/14/70/1131991470.db2.gz INHPEFRTOQAWPW-NSHDSACASA-N 0 3 336.338 3.602 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N(C)Cc2cccnc2C)c1F ZINC001173191218 1131995387 /nfs/dbraw/zinc/99/53/87/1131995387.db2.gz BBSXRBZUACGLJF-LBPRGKRZSA-N 0 3 347.390 3.509 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1nc(-c2ccccc2)cc1CN ZINC001173215660 1132002116 /nfs/dbraw/zinc/00/21/16/1132002116.db2.gz YCXLKZHJOJMJOE-AWEZNQCLSA-N 0 3 336.395 3.721 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@](CF)(C(F)(F)F)C1 ZINC001173221257 1132004791 /nfs/dbraw/zinc/00/47/91/1132004791.db2.gz GSEJDXUPRPRGAE-BXUZGUMPSA-N 0 3 334.313 3.750 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179348064 1133243852 /nfs/dbraw/zinc/24/38/52/1133243852.db2.gz NFFKLIRTWXZGTI-WLHTULFXSA-N 0 3 330.384 3.756 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@@H](O)c1c(F)cccc1F)CCC2 ZINC000774249556 1133643234 /nfs/dbraw/zinc/64/32/34/1133643234.db2.gz BUIJDVPDHDRKSJ-IAGOWNOFSA-N 0 3 348.349 3.574 20 5 EHBDHN C[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1cccc(-n2cccn2)c1 ZINC000788488841 1134131192 /nfs/dbraw/zinc/13/11/92/1134131192.db2.gz MFSGZZLCFXHSQD-CYBMUJFWSA-N 0 3 340.358 3.770 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC(F)(c3ccccc3)CC2)cc1 ZINC000789311713 1134252011 /nfs/dbraw/zinc/25/20/11/1134252011.db2.gz UAJQAIRKZVAPKX-GOSISDBHSA-N 0 3 344.386 3.589 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCc3cc(C)ccc3C2)c([N+](=O)[O-])c1 ZINC001170354171 1134753692 /nfs/dbraw/zinc/75/36/92/1134753692.db2.gz HVZXSTBDMZJNNF-OAHLLOKOSA-N 0 3 340.423 3.901 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCC[C@@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC001170345841 1134759727 /nfs/dbraw/zinc/75/97/27/1134759727.db2.gz MXANIWHQPWSNIJ-KBXCAEBGSA-N 0 3 341.411 3.767 20 5 EHBDHN C[C@@]1(NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@@H]1C1CC1 ZINC000809975085 1135908269 /nfs/dbraw/zinc/90/82/69/1135908269.db2.gz WBLBBOCRVJDJNN-HUUCEWRRSA-N 0 3 345.226 3.949 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC[C@@H]1CCCCO1 ZINC000811488838 1136092795 /nfs/dbraw/zinc/09/27/95/1136092795.db2.gz NEKWEQZQAXJEEO-LBPRGKRZSA-N 0 3 333.215 3.950 20 5 EHBDHN Cc1ccc(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])cn1 ZINC000811479664 1136097328 /nfs/dbraw/zinc/09/73/28/1136097328.db2.gz LEOXGUXTVYRZBY-UHFFFAOYSA-N 0 3 340.210 3.937 20 5 EHBDHN CC(C)(NC[C@@H]1CCC[C@@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC001170650852 1136162070 /nfs/dbraw/zinc/16/20/70/1136162070.db2.gz QGPDLTATISZBJF-FZMZJTMJSA-N 0 3 346.349 3.920 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]23)c1 ZINC000850409482 1136252035 /nfs/dbraw/zinc/25/20/35/1136252035.db2.gz VSTOMTRHXYCQSA-USXIJHARSA-N 0 3 332.762 3.815 20 5 EHBDHN CCN(Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812849006 1136260414 /nfs/dbraw/zinc/26/04/14/1136260414.db2.gz NSPWHADXAJSQLL-IFXJQAMLSA-N 0 3 344.411 3.547 20 5 EHBDHN CN1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)c2ccccc2C1 ZINC000816618384 1136742477 /nfs/dbraw/zinc/74/24/77/1136742477.db2.gz WKLBAXZKLCKJIM-UHFFFAOYSA-N 0 3 331.803 3.700 20 5 EHBDHN CC([C@@H](OC(=O)C[C@@H](C)n1cccc1)c1ccccc1F)[N+](=O)[O-] ZINC000845877416 1137316400 /nfs/dbraw/zinc/31/64/00/1137316400.db2.gz PPOQHDBYIGLQMX-PBFPGSCMSA-N 0 3 334.347 3.528 20 5 EHBDHN CC([C@H](OC(=O)c1ccoc1C1CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845882989 1137317175 /nfs/dbraw/zinc/31/71/75/1137317175.db2.gz QQGQHAZTJWZXBG-BMIGLBTASA-N 0 3 333.315 3.859 20 5 EHBDHN CCC(=O)c1ccc(N2CCCN(C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000795094485 1137464762 /nfs/dbraw/zinc/46/47/62/1137464762.db2.gz ISXWUBWTUUYBNA-UHFFFAOYSA-N 0 3 345.443 3.642 20 5 EHBDHN C[C@H](N[C@H]1CCC[C@@H]1Cc1cnn(C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086090 1137570419 /nfs/dbraw/zinc/57/04/19/1137570419.db2.gz ROGMRUUJTJJONV-BJJXKVORSA-N 0 3 346.406 3.529 20 5 EHBDHN C[C@H](N[C@H]1CCC[C@H]1Cc1cnn(C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086095 1137570456 /nfs/dbraw/zinc/57/04/56/1137570456.db2.gz ROGMRUUJTJJONV-NOLJZWGESA-N 0 3 346.406 3.529 20 5 EHBDHN O=[N+]([O-])c1cccc(Br)c1CNCCC1CC(F)(F)C1 ZINC001202682444 1137925703 /nfs/dbraw/zinc/92/57/03/1137925703.db2.gz CNAWCDKEHBEFSV-UHFFFAOYSA-N 0 3 349.175 3.882 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000177347676 1139614665 /nfs/dbraw/zinc/61/46/65/1139614665.db2.gz KURLKBXLELHMLI-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN C[C@@H]1CCC[C@H](C)C1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000182946521 1140003322 /nfs/dbraw/zinc/00/33/22/1140003322.db2.gz QBFLQGLEWRYDBW-HBBFGDNQSA-N 0 3 330.388 3.559 20 5 EHBDHN COCc1ccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192636320 1140541319 /nfs/dbraw/zinc/54/13/19/1140541319.db2.gz LFTHQIDFRKTJLE-LJQANCHMSA-N 0 3 326.396 3.908 20 5 EHBDHN CCC1(O)CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000536663101 1032079685 /nfs/dbraw/zinc/07/96/85/1032079685.db2.gz WNNVEHFIYLULGX-UHFFFAOYSA-N 0 3 330.384 3.592 20 5 EHBDHN Cc1c(CNCc2c[nH]nc2-c2cccs2)cccc1[N+](=O)[O-] ZINC000336872831 1015873906 /nfs/dbraw/zinc/87/39/06/1015873906.db2.gz QFQZUNUJQWUFHS-UHFFFAOYSA-N 0 3 328.397 3.645 20 5 EHBDHN C[C@@H]1C[C@H](CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)O1 ZINC000414517056 1016949477 /nfs/dbraw/zinc/94/94/77/1016949477.db2.gz QCTAZMJFNZNBMN-MBNYWOFBSA-N 0 3 347.440 3.621 20 5 EHBDHN C[C@@H]1C[C@@H](CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)O1 ZINC000414517051 1016950012 /nfs/dbraw/zinc/95/00/12/1016950012.db2.gz QCTAZMJFNZNBMN-BZPMIXESSA-N 0 3 347.440 3.621 20 5 EHBDHN CC1(c2ccccc2)CC(NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000459498337 1032198690 /nfs/dbraw/zinc/19/86/90/1032198690.db2.gz AKXWTLIHMKPBTP-UHFFFAOYSA-N 0 3 336.395 3.681 20 5 EHBDHN CN(C)[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1ccsc1 ZINC000026719940 1032394905 /nfs/dbraw/zinc/39/49/05/1032394905.db2.gz GDYWCKPMMAWQAH-MRXNPFEDSA-N 0 3 342.424 3.919 20 5 EHBDHN Cc1c(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000593013120 1032640963 /nfs/dbraw/zinc/64/09/63/1032640963.db2.gz CWLHBEJIAMLPKN-QWRGUYRKSA-N 0 3 346.305 3.589 20 5 EHBDHN Cc1c(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000593013121 1032641037 /nfs/dbraw/zinc/64/10/37/1032641037.db2.gz CWLHBEJIAMLPKN-WDEREUQCSA-N 0 3 346.305 3.589 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548010023 1018197495 /nfs/dbraw/zinc/19/74/95/1018197495.db2.gz BSXIIFICMOXOGP-YOEHRIQHSA-N 0 3 340.427 3.678 20 5 EHBDHN COc1ccccc1CCN(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000513502739 1019760141 /nfs/dbraw/zinc/76/01/41/1019760141.db2.gz DZLFICHXTSJNPB-YFHOEESVSA-N 0 3 326.396 3.791 20 5 EHBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000610516019 1021172656 /nfs/dbraw/zinc/17/26/56/1021172656.db2.gz VJHPYSSOWHHLOI-HIFRSBDPSA-N 0 3 331.441 3.979 20 5 EHBDHN C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000090936239 1021949050 /nfs/dbraw/zinc/94/90/50/1021949050.db2.gz SGGMYLMGKVJXLQ-QFYYESIMSA-N 0 3 338.766 3.772 20 5 EHBDHN C[C@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000090936241 1021949575 /nfs/dbraw/zinc/94/95/75/1021949575.db2.gz SGGMYLMGKVJXLQ-MGPLVRAMSA-N 0 3 338.766 3.772 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCCC[C@@H]3CCOC3)cs2)c1 ZINC000449682492 1033034891 /nfs/dbraw/zinc/03/48/91/1033034891.db2.gz LPQFJPQQOBXAGE-CYBMUJFWSA-N 0 3 347.440 3.625 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCCN(C)[C@@H]2c2cccs2)n1 ZINC000178236931 1022249612 /nfs/dbraw/zinc/24/96/12/1022249612.db2.gz VPEOTBVGWDMZPF-CJNGLKHVSA-N 0 3 346.456 3.855 20 5 EHBDHN CSCC1CCC(NCc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000602677393 1033078986 /nfs/dbraw/zinc/07/89/86/1033078986.db2.gz GKPXPTWGRKRHPO-UHFFFAOYSA-N 0 3 335.429 3.747 20 5 EHBDHN CCOc1cc(CN(CC)CCc2nccs2)ccc1[N+](=O)[O-] ZINC000276931396 1023403560 /nfs/dbraw/zinc/40/35/60/1023403560.db2.gz QYYYZIQQPXWHJL-UHFFFAOYSA-N 0 3 335.429 3.515 20 5 EHBDHN CCS[C@@H]1CCCC[C@H]1NCc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000469780081 1024007653 /nfs/dbraw/zinc/00/76/53/1024007653.db2.gz MMRFSTUITBHBJC-CZUORRHYSA-N 0 3 342.436 3.896 20 5 EHBDHN CO[C@H](c1ccccc1F)[C@@H](C)NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000538488088 1024396799 /nfs/dbraw/zinc/39/67/99/1024396799.db2.gz OGJSXJXIYMCCTE-ACJLOTCBSA-N 0 3 332.375 3.908 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN(Cc2cccc(F)c2)C2CC2)cc1 ZINC000065535519 1024622839 /nfs/dbraw/zinc/62/28/39/1024622839.db2.gz JLWWGPYLSFEZRF-UHFFFAOYSA-N 0 3 330.359 3.777 20 5 EHBDHN COc1ccc([C@H]2CCCN2CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000515123761 1025035256 /nfs/dbraw/zinc/03/52/56/1025035256.db2.gz OLIVCRXKDJLMBK-LJQANCHMSA-N 0 3 342.395 3.819 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451412189 1025945721 /nfs/dbraw/zinc/94/57/21/1025945721.db2.gz FWFSNZZCDLBFFL-RCCFBDPRSA-N 0 3 348.443 3.507 20 5 EHBDHN CSc1ccc([C@H](CNc2ncc([N+](=O)[O-])cc2C)N(C)C)cc1 ZINC000338833953 1026215431 /nfs/dbraw/zinc/21/54/31/1026215431.db2.gz CHOUUHFWYJUCGL-INIZCTEOSA-N 0 3 346.456 3.735 20 5 EHBDHN Cc1nn(C(C)(C)C)c(C)c1CN(C)CCc1cccc([N+](=O)[O-])c1 ZINC000338957093 1026301717 /nfs/dbraw/zinc/30/17/17/1026301717.db2.gz YBCHHLMQRYUCPE-UHFFFAOYSA-N 0 3 344.459 3.838 20 5 EHBDHN Cc1cccc([C@H](C)N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000452090383 1026484915 /nfs/dbraw/zinc/48/49/15/1026484915.db2.gz QTZMHRINOQBAJZ-KBPBESRZSA-N 0 3 327.384 3.581 20 5 EHBDHN CCOc1ccc([C@@H](C)NCCOc2ccccc2F)cc1[N+](=O)[O-] ZINC000504906034 1029050137 /nfs/dbraw/zinc/05/01/37/1029050137.db2.gz RRQHKZPMPPCUKC-CYBMUJFWSA-N 0 3 348.374 3.862 20 5 EHBDHN CC(C)(C)OC(=O)CCNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000525697333 1030029091 /nfs/dbraw/zinc/02/90/91/1030029091.db2.gz LNPRTAKOQFTKMI-UHFFFAOYSA-N 0 3 346.383 3.676 20 5 EHBDHN CN(C)c1ccccc1CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447589619 1030326014 /nfs/dbraw/zinc/32/60/14/1030326014.db2.gz YOKRNECKCDHKOX-SFHVURJKSA-N 0 3 325.412 3.828 20 5 EHBDHN CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCC(C)(C)C1 ZINC000483097482 1030949848 /nfs/dbraw/zinc/94/98/48/1030949848.db2.gz MNSQXKFZQVDAMP-LBPRGKRZSA-N 0 3 339.823 3.697 20 5 EHBDHN C[C@@H]1CC[C@@H](NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000248548758 1031938337 /nfs/dbraw/zinc/93/83/37/1031938337.db2.gz GXQJTLBXQIGZSW-TYNCELHUSA-N 0 3 330.388 3.559 20 5 EHBDHN O=[N+]([O-])c1cccc(CNC[C@@H](c2ccco2)N2CCCCC2)c1 ZINC000061013459 1033436744 /nfs/dbraw/zinc/43/67/44/1033436744.db2.gz GGJZMWXXDLVTLV-KRWDZBQOSA-N 0 3 329.400 3.505 20 5 EHBDHN Cc1nn(CN2CC[C@@H](c3ccccc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761290388 1033487602 /nfs/dbraw/zinc/48/76/02/1033487602.db2.gz OTJAYRXUUVAXDJ-MRXNPFEDSA-N 0 3 336.395 3.700 20 5 EHBDHN C[C@@H](c1ccccc1)[C@H](O)CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000595000226 1033626263 /nfs/dbraw/zinc/62/62/63/1033626263.db2.gz HWDXZNAIIIXRLV-YVEFUNNKSA-N 0 3 334.803 3.502 20 5 EHBDHN Cc1cc(NCC(C)(C)C(F)(F)F)c2cc([N+](=O)[O-])ccc2n1 ZINC000515313446 1033650613 /nfs/dbraw/zinc/65/06/13/1033650613.db2.gz GKYQRFRSRFCVSM-UHFFFAOYSA-N 0 3 327.306 3.874 20 5 EHBDHN COc1ccc([C@@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])C2CC2)cn1 ZINC000599095554 1033730598 /nfs/dbraw/zinc/73/05/98/1033730598.db2.gz GXGZCFZBSHKVNZ-LPHOPBHVSA-N 0 3 339.395 3.727 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F ZINC000593013360 1033806474 /nfs/dbraw/zinc/80/64/74/1033806474.db2.gz IAVWYLSAJOYQOK-NWDGAFQWSA-N 0 3 346.305 3.589 20 5 EHBDHN CC(C)OCCOC1CCN([C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000451955080 1034439057 /nfs/dbraw/zinc/43/90/57/1034439057.db2.gz ZDSBMXLMGAWUKL-OAHLLOKOSA-N 0 3 336.432 3.562 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000177721446 1035348868 /nfs/dbraw/zinc/34/88/68/1035348868.db2.gz LFWLZWNMLSVYNN-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN CC(=O)c1cc(N[C@H](C)CN(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000588012563 1035681155 /nfs/dbraw/zinc/68/11/55/1035681155.db2.gz BACYFZZUNVODCF-CQSZACIVSA-N 0 3 341.411 3.730 20 5 EHBDHN C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1nccn1-c1ccccc1 ZINC000588311570 1035899739 /nfs/dbraw/zinc/89/97/39/1035899739.db2.gz BFMAXWCDNYGRRB-HNNXBMFYSA-N 0 3 336.395 3.674 20 5 EHBDHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000535418012 1036455478 /nfs/dbraw/zinc/45/54/78/1036455478.db2.gz JAVREYBZCZNIHQ-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595748159 1036553824 /nfs/dbraw/zinc/55/38/24/1036553824.db2.gz QDVUYDDMEIMJJK-VDZJLULYSA-N 0 3 340.423 3.754 20 5 EHBDHN CC(C)[C@H](O)CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000493050288 1036580537 /nfs/dbraw/zinc/58/05/37/1036580537.db2.gz BKIQFWBDZJERCU-RTBURBONSA-N 0 3 328.412 3.681 20 5 EHBDHN O=[N+]([O-])c1cccc(CNC2(c3ccc(F)cc3)CCOCC2)c1 ZINC000237744857 1036902979 /nfs/dbraw/zinc/90/29/79/1036902979.db2.gz CQYAZMMIRSHYOP-UHFFFAOYSA-N 0 3 330.359 3.529 20 5 EHBDHN CC[C@H](O)CCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494004000 1037763591 /nfs/dbraw/zinc/76/35/91/1037763591.db2.gz NJAOAEYCPAZWEV-OALUTQOASA-N 0 3 328.412 3.825 20 5 EHBDHN COc1cc(CN(C)Cc2cccc3[nH]ccc32)ccc1[N+](=O)[O-] ZINC000494005866 1037768066 /nfs/dbraw/zinc/76/80/66/1037768066.db2.gz DKYNNDDRAZRCDN-UHFFFAOYSA-N 0 3 325.368 3.717 20 5 EHBDHN CN(C)c1ccc(CN[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)cn1 ZINC000417309899 1039663492 /nfs/dbraw/zinc/66/34/92/1039663492.db2.gz GMMTXTPSLHTSBR-SFHVURJKSA-N 0 3 340.427 3.613 20 5 EHBDHN CC[C@H](N[C@H](C)c1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000192848844 1040593788 /nfs/dbraw/zinc/59/37/88/1040593788.db2.gz JRULVDWBAONMII-PXAZEXFGSA-N 0 3 342.399 3.887 20 5 EHBDHN COC(=O)c1cc([C@@H](C)N(C)CCc2ccccc2[N+](=O)[O-])oc1C ZINC000433178859 1041009463 /nfs/dbraw/zinc/00/94/63/1041009463.db2.gz CQORMHLEDGYOHQ-GFCCVEGCSA-N 0 3 346.383 3.518 20 5 EHBDHN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(CN(C)C)c2)c1 ZINC000047453752 1041643476 /nfs/dbraw/zinc/64/34/76/1041643476.db2.gz WSYNRJXQJVSADZ-UHFFFAOYSA-N 0 3 345.424 3.631 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2nnc(CN3CCC[C@@H]4CCCC[C@@H]43)o2)cc1 ZINC000072971115 1043374046 /nfs/dbraw/zinc/37/40/46/1043374046.db2.gz VNLBGXLWBNUKIC-BBRMVZONSA-N 0 3 342.399 3.799 20 5 EHBDHN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(CN(C)C)c1 ZINC000072840236 1126901782 /nfs/dbraw/zinc/90/17/82/1126901782.db2.gz YSIJYXCKUJTPTP-UHFFFAOYSA-N 0 3 347.802 3.871 20 5 EHBDHN CC[C@@H](C)CN(CC)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283262 1127473604 /nfs/dbraw/zinc/47/36/04/1127473604.db2.gz PFKBJQOHBYXWMX-VXGBXAGGSA-N 0 3 341.839 3.943 20 5 EHBDHN O=[N+]([O-])c1cnc(N[C@H](CN2CCCC2)c2ccccc2)c(Cl)c1 ZINC000301285505 1127731811 /nfs/dbraw/zinc/73/18/11/1127731811.db2.gz QKIMPSGCYLJJEO-MRXNPFEDSA-N 0 3 346.818 3.892 20 5 EHBDHN COc1cc(CN2CC[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000552488448 1127758230 /nfs/dbraw/zinc/75/82/30/1127758230.db2.gz BUHOVWSTAQUONE-LLVKDONJSA-N 0 3 344.358 3.683 20 5 EHBDHN Cc1nc(NCC(C)(C)N2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000301613892 1128745828 /nfs/dbraw/zinc/74/58/28/1128745828.db2.gz AKMHIKSRPXCANT-UHFFFAOYSA-N 0 3 340.427 3.547 20 5 EHBDHN C[C@@H]1CCCC[C@H]1N(C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143306 1121784351 /nfs/dbraw/zinc/78/43/51/1121784351.db2.gz OXLCSTUULHJZSO-IUODEOHRSA-N 0 3 330.388 3.655 20 5 EHBDHN COC(=O)Nc1cccc(CN[C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000496676989 1122152909 /nfs/dbraw/zinc/15/29/09/1122152909.db2.gz FIXJDTTWGGCZDR-INIZCTEOSA-N 0 3 341.367 3.550 20 5 EHBDHN Cc1c(NC(=O)[C@H](C)N2CC[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247734 1129371611 /nfs/dbraw/zinc/37/16/11/1129371611.db2.gz HYTRUVCPMJZSAN-KBPBESRZSA-N 0 3 333.432 3.598 20 5 EHBDHN O=[N+]([O-])c1ccc(CCNCc2nc3ccc(F)cc3s2)cc1 ZINC000428847564 1129524343 /nfs/dbraw/zinc/52/43/43/1129524343.db2.gz GPNQLFQGGAULSL-UHFFFAOYSA-N 0 3 331.372 3.676 20 5 EHBDHN CCOCOc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000922538337 1129565446 /nfs/dbraw/zinc/56/54/46/1129565446.db2.gz PUKLWGQLPKQTOY-CQSZACIVSA-N 0 3 330.384 3.818 20 5 EHBDHN CCN(CC)C(=O)C1CCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000330734600 1129644162 /nfs/dbraw/zinc/64/41/62/1129644162.db2.gz VBUYTQSTMMEWEY-HNNXBMFYSA-N 0 3 347.459 3.545 20 5 EHBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032644 1129764550 /nfs/dbraw/zinc/76/45/50/1129764550.db2.gz SPQUPQLHOYTZMS-UKRRQHHQSA-N 0 3 331.441 3.979 20 5 EHBDHN O=[N+]([O-])c1ccccc1CNCCc1nc2ccccc2n1C(F)F ZINC000347832278 1129901049 /nfs/dbraw/zinc/90/10/49/1129901049.db2.gz AKIKBHJPJDCRTJ-UHFFFAOYSA-N 0 3 346.337 3.672 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@@H](C)c2cccc(C)n2)c1F ZINC001173188041 1131993632 /nfs/dbraw/zinc/99/36/32/1131993632.db2.gz HYLOYPCRNVIIBO-STQMWFEESA-N 0 3 347.390 3.728 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@H]3CCC[C@H]32)c1F ZINC001173196493 1131996316 /nfs/dbraw/zinc/99/63/16/1131996316.db2.gz NAAHBAXLNOBTRT-GZBFAFLISA-N 0 3 336.407 3.938 20 5 EHBDHN COC(=O)[C@H]1CCCC[C@@H]1CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860262 1132582606 /nfs/dbraw/zinc/58/26/06/1132582606.db2.gz VYKFJNJSGUQUPC-QAPCUYQASA-N 0 3 346.427 3.539 20 5 EHBDHN O=[N+]([O-])c1cc(CN[C@H](CN2CCCCC2)c2ccccc2)cs1 ZINC001169188539 1132687156 /nfs/dbraw/zinc/68/71/56/1132687156.db2.gz XYXHBAFGAPDNTI-QGZVFWFLSA-N 0 3 345.468 3.973 20 5 EHBDHN C[C@@H](NCCC(=O)Nc1ccccc1Cl)c1ccccc1[N+](=O)[O-] ZINC001175890841 1132782375 /nfs/dbraw/zinc/78/23/75/1132782375.db2.gz VJGXXNFUAKUTIA-GFCCVEGCSA-N 0 3 347.802 3.928 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN(C)CCOc1ccccc1F ZINC001180445087 1133370427 /nfs/dbraw/zinc/37/04/27/1133370427.db2.gz JTXIXGFWFBLYKN-UHFFFAOYSA-N 0 3 332.375 3.862 20 5 EHBDHN C[C@H]1C[C@H](c2ccccc2)CN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886593 1134100148 /nfs/dbraw/zinc/10/01/48/1134100148.db2.gz WGAZCGAXJHFDSH-BBRMVZONSA-N 0 3 341.367 3.881 20 5 EHBDHN CC(C)[C@H](NCc1ccc([N+](=O)[O-])cc1F)[C@H](O)c1ccccc1 ZINC000788537328 1134139206 /nfs/dbraw/zinc/13/92/06/1134139206.db2.gz JHXSKLJVBLQITR-ZWKOTPCHSA-N 0 3 332.375 3.582 20 5 EHBDHN CC(C)Oc1ccccc1[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000774982216 1134177034 /nfs/dbraw/zinc/17/70/34/1134177034.db2.gz RASXMRULHYRVOE-KSSFIOAISA-N 0 3 344.411 3.766 20 5 EHBDHN CCCC1CCC(N(C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC1 ZINC000790480174 1134423081 /nfs/dbraw/zinc/42/30/81/1134423081.db2.gz QUWBWECERCORGY-UHFFFAOYSA-N 0 3 345.447 3.896 20 5 EHBDHN CSc1ccccc1CN(C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001193974275 1135208473 /nfs/dbraw/zinc/20/84/73/1135208473.db2.gz APAJNQASCLCGNO-UHFFFAOYSA-N 0 3 332.425 3.828 20 5 EHBDHN O=[N+]([O-])c1cc(F)ccc1CN1C[C@H]2[C@H](C[C@@H]2c2ccccc2)C1 ZINC001196898876 1135628371 /nfs/dbraw/zinc/62/83/71/1135628371.db2.gz IEHHQLWWTQOMQR-NXHRZFHOSA-N 0 3 326.371 3.969 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H](CO)C1CCCC1 ZINC000810116150 1135928125 /nfs/dbraw/zinc/92/81/25/1135928125.db2.gz VCHGTXTXCHKCEB-CYBMUJFWSA-N 0 3 333.215 3.542 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCc1cccnc1 ZINC000811473851 1136095630 /nfs/dbraw/zinc/09/56/30/1136095630.db2.gz OLEGLLQDXAXQAY-UHFFFAOYSA-N 0 3 326.183 3.629 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC(c3ccccc3F)CC2)cc1 ZINC000776278058 1136130741 /nfs/dbraw/zinc/13/07/41/1136130741.db2.gz RCBKGGAINOKBGT-IBGZPJMESA-N 0 3 344.386 3.647 20 5 EHBDHN C[C@H](N)c1ncc(-c2ccccc2)n1-c1cc(F)cc(F)c1[N+](=O)[O-] ZINC001170682284 1136227503 /nfs/dbraw/zinc/22/75/03/1136227503.db2.gz PJNKCNOIBPTZTF-JTQLQIEISA-N 0 3 344.321 3.745 20 5 EHBDHN CCN(Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812851550 1136261328 /nfs/dbraw/zinc/26/13/28/1136261328.db2.gz SMMDYKIBYGWRCN-FZKQIMNGSA-N 0 3 332.375 3.678 20 5 EHBDHN CC(COC(=O)[C@@H](Oc1ccc(Cl)cc1)c1ccccc1)[N+](=O)[O-] ZINC000813102527 1136288205 /nfs/dbraw/zinc/28/82/05/1136288205.db2.gz HQZDZEGUAXTKGC-WBMJQRKESA-N 0 3 349.770 3.669 20 5 EHBDHN Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813103833 1136288373 /nfs/dbraw/zinc/28/83/73/1136288373.db2.gz UWXUWODVUPOFDN-LLVKDONJSA-N 0 3 348.424 3.599 20 5 EHBDHN CC(COC(=O)c1ccc(-c2ccc(Cl)cc2)cc1F)[N+](=O)[O-] ZINC000813102916 1136288528 /nfs/dbraw/zinc/28/85/28/1136288528.db2.gz LOJIDKQIDNTART-SNVBAGLBSA-N 0 3 337.734 3.968 20 5 EHBDHN CC(COC(=O)c1ccc2c(ccn2Cc2ccccc2)c1)[N+](=O)[O-] ZINC000813113709 1136294773 /nfs/dbraw/zinc/29/47/73/1136294773.db2.gz TVGZHCGKGUKCOU-CQSZACIVSA-N 0 3 338.363 3.512 20 5 EHBDHN CC(C)(C)CCN1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000111190617 1136520313 /nfs/dbraw/zinc/52/03/13/1136520313.db2.gz GQRVBDVOMHDFTB-UHFFFAOYSA-N 0 3 348.472 3.763 20 5 EHBDHN CC(C)c1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845873285 1137316195 /nfs/dbraw/zinc/31/61/95/1137316195.db2.gz CFSOPPDSJDQGHU-SJCJKPOMSA-N 0 3 346.358 3.907 20 5 EHBDHN CSCC1(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])CC1 ZINC000845875802 1137316230 /nfs/dbraw/zinc/31/62/30/1137316230.db2.gz CLFDFLNLEZHRIH-IAQYHMDHSA-N 0 3 341.404 3.609 20 5 EHBDHN CC([C@H](OC(=O)CC1CC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845878655 1137316387 /nfs/dbraw/zinc/31/63/87/1137316387.db2.gz IASKAGDJRAWQBB-XPTSAGLGSA-N 0 3 331.290 3.511 20 5 EHBDHN CC([C@H](OC(=O)C1(F)CCCCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845877761 1137316481 /nfs/dbraw/zinc/31/64/81/1137316481.db2.gz GTXUYQYAPFWLRJ-RISCZKNCSA-N 0 3 327.327 3.748 20 5 EHBDHN CC[C@H](CC(F)F)C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845878645 1137316592 /nfs/dbraw/zinc/31/65/92/1137316592.db2.gz HYBKQJAWRUHAPY-IMSIIYSGSA-N 0 3 333.306 3.757 20 5 EHBDHN CSc1cc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])co1 ZINC000870454915 1137493376 /nfs/dbraw/zinc/49/33/76/1137493376.db2.gz RGKPUVSTARCBHX-XPTSAGLGSA-N 0 3 339.344 3.704 20 5 EHBDHN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCCC2(CCCC2)CC1 ZINC001171911648 1137518151 /nfs/dbraw/zinc/51/81/51/1137518151.db2.gz TWRAJFFSTYZJCP-HNNXBMFYSA-N 0 3 345.443 3.968 20 5 EHBDHN Cc1ccccc1NC(=O)C[C@@H](C)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129605 1137573108 /nfs/dbraw/zinc/57/31/08/1137573108.db2.gz RXBVVVFJLLTSGN-CABCVRRESA-N 0 3 341.411 3.971 20 5 EHBDHN C[C@@H]1CC(C)(C)CC[C@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447926 1137716477 /nfs/dbraw/zinc/71/64/77/1137716477.db2.gz OVZLGIYKROZIIL-TZMCWYRMSA-N 0 3 344.415 3.949 20 5 EHBDHN C[C@@H]1CCC[C@@H]1NCc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878507753 1137718380 /nfs/dbraw/zinc/71/83/80/1137718380.db2.gz JPBFLDWDBDHSSH-SKDRFNHKSA-N 0 3 336.779 3.576 20 5 EHBDHN COc1cccc([C@@H]2CCN(Cc3cccnc3[N+](=O)[O-])C2(C)C)c1 ZINC000886316743 1138066704 /nfs/dbraw/zinc/06/67/04/1138066704.db2.gz LJMLYIXJHGKRCJ-KRWDZBQOSA-N 0 3 341.411 3.767 20 5 EHBDHN CCOc1ccc([C@H](C)NC[C@@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000153256716 1139129061 /nfs/dbraw/zinc/12/90/61/1139129061.db2.gz FOXYEKUQOTVUPI-YVEFUNNKSA-N 0 3 348.374 3.517 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ccc(-n3cccn3)cc1)CCC2 ZINC000192675995 1140543160 /nfs/dbraw/zinc/54/31/60/1140543160.db2.gz MODXAWYDCSWBQF-FQEVSTJZSA-N 0 3 348.406 3.948 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCCc4cn[nH]c43)o2)cc1 ZINC000268883850 1141017889 /nfs/dbraw/zinc/01/78/89/1141017889.db2.gz YMBNAKKVYCNFFY-MRXNPFEDSA-N 0 3 338.367 3.745 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C)cc(CN(C)C)c2)c1 ZINC000270409284 1141219093 /nfs/dbraw/zinc/21/90/93/1141219093.db2.gz ZEWBSSNHPHNITJ-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN COc1ccc([C@@H](NCc2ccc([N+](=O)[O-])c(F)c2)C2CC2)cc1 ZINC000283074745 1141547691 /nfs/dbraw/zinc/54/76/91/1141547691.db2.gz KIDNLCPHMPFKIR-SFHVURJKSA-N 0 3 330.359 3.983 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)c1 ZINC000004315214 210167635 /nfs/dbraw/zinc/16/76/35/210167635.db2.gz UGUBSHDHXRPBIJ-UHFFFAOYSA-N 0 3 336.395 3.851 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1cccc(Cn2cccn2)c1 ZINC000579732244 1014312681 /nfs/dbraw/zinc/31/26/81/1014312681.db2.gz SNMFAQBCFFAPGA-IBGZPJMESA-N 0 3 348.406 3.617 20 5 EHBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])CCOCc1ccccc1 ZINC000535820335 1015017854 /nfs/dbraw/zinc/01/78/54/1015017854.db2.gz QEQGBOHBUQOJKT-XFFZJAGNSA-N 0 3 326.396 3.757 20 5 EHBDHN CC(C)(C)[C@H](N)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000430384332 1016583691 /nfs/dbraw/zinc/58/36/91/1016583691.db2.gz KMPDGHACDVJGCZ-MRXNPFEDSA-N 0 3 343.383 3.699 20 5 EHBDHN O=[N+]([O-])c1cc(CNC2(CCOCc3ccccc3)CC2)cs1 ZINC000340595588 1032520973 /nfs/dbraw/zinc/52/09/73/1032520973.db2.gz JWOOZSGDDFUPQI-UHFFFAOYSA-N 0 3 332.425 3.885 20 5 EHBDHN CC(C)n1ccc(C[C@H](C)NCc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000468033499 1017527697 /nfs/dbraw/zinc/52/76/97/1017527697.db2.gz LFRLHAYFFYHUJE-LBPRGKRZSA-N 0 3 336.823 3.746 20 5 EHBDHN CC[C@H]1C[C@@H](C)CN1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000610410598 1018933269 /nfs/dbraw/zinc/93/32/69/1018933269.db2.gz VJCAACNBIZWXAK-PWSUYJOCSA-N 0 3 344.358 3.825 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(OC[C@H]2CCCO2)CC1 ZINC000182836767 1019768123 /nfs/dbraw/zinc/76/81/23/1019768123.db2.gz KXJFCBPAKCLCPR-MAUKXSAKSA-N 0 3 348.443 3.624 20 5 EHBDHN CC[C@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341221648 1021123080 /nfs/dbraw/zinc/12/30/80/1021123080.db2.gz QVBHBQJKBYYJCC-DYVFJYSZSA-N 0 3 327.384 3.663 20 5 EHBDHN CO[C@H]([C@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000449633531 1032967754 /nfs/dbraw/zinc/96/77/54/1032967754.db2.gz ULVVFSATIJVLKE-KPZWWZAWSA-N 0 3 330.384 3.758 20 5 EHBDHN COc1ccccc1[C@@H]1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000157895723 1021513658 /nfs/dbraw/zinc/51/36/58/1021513658.db2.gz HUKSTPBGYFEXHJ-OAHLLOKOSA-N 0 3 342.395 3.602 20 5 EHBDHN Cc1cnccc1CCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602583815 1033003797 /nfs/dbraw/zinc/00/37/97/1033003797.db2.gz YUQNSHSJIAIBQX-UHFFFAOYSA-N 0 3 339.317 3.649 20 5 EHBDHN COc1ccc([C@@H](CNc2ccccc2[N+](=O)[O-])N2CCCC2)cc1 ZINC000025777468 1022144709 /nfs/dbraw/zinc/14/47/09/1022144709.db2.gz OXFDXKIPERVXHZ-LJQANCHMSA-N 0 3 341.411 3.852 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC[C@]1(CO)C[C@@H]1c1ccccc1 ZINC000894535301 1022498424 /nfs/dbraw/zinc/49/84/24/1022498424.db2.gz BNKCJQKMKZIDHH-AEFFLSMTSA-N 0 3 346.814 3.504 20 5 EHBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3cc4cc(F)ccc4o3)CC2)n1 ZINC000425974581 1022530400 /nfs/dbraw/zinc/53/04/00/1022530400.db2.gz DMPVZCXIOKOLIW-UHFFFAOYSA-N 0 3 344.346 3.514 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@H]2c2ccccn2)cc1 ZINC000610582241 1022796595 /nfs/dbraw/zinc/79/65/95/1022796595.db2.gz PQYHFEPPXLQIFY-SFHVURJKSA-N 0 3 327.384 3.596 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(Cc3cn4ccnc4s3)C2)cc1 ZINC000894722121 1022818158 /nfs/dbraw/zinc/81/81/58/1022818158.db2.gz ILSODVDMWCWXSL-AWEZNQCLSA-N 0 3 342.424 3.684 20 5 EHBDHN Cc1ncc([C@H](C)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684817 1033085793 /nfs/dbraw/zinc/08/57/93/1033085793.db2.gz IQIBPTJSJWHWRW-YOEHRIQHSA-N 0 3 340.427 3.942 20 5 EHBDHN C[C@@H](Cc1ccccn1)NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602705606 1033092331 /nfs/dbraw/zinc/09/23/31/1033092331.db2.gz NOCHQDPTUQDILF-NSHDSACASA-N 0 3 339.317 3.729 20 5 EHBDHN Cc1c(CN[C@H](C)c2ccc(-n3ccnc3)cc2)cccc1[N+](=O)[O-] ZINC000327712687 1023106657 /nfs/dbraw/zinc/10/66/57/1023106657.db2.gz ZUPBHXYEWCOAQH-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN C[C@@H](C[C@@H]1CCOC1)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610740642 1023403177 /nfs/dbraw/zinc/40/31/77/1023403177.db2.gz XERKNQOIYCNJKG-STQMWFEESA-N 0 3 347.440 3.623 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000610818797 1023782464 /nfs/dbraw/zinc/78/24/64/1023782464.db2.gz SJTBIYJDLPQPAP-NEPJUHHUSA-N 0 3 340.383 3.897 20 5 EHBDHN COc1cccc([C@H]2CCCN2CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000065532615 1024658392 /nfs/dbraw/zinc/65/83/92/1024658392.db2.gz QCWVQGOVDWEYIO-LJQANCHMSA-N 0 3 342.395 3.819 20 5 EHBDHN C[C@@H](c1ccc(F)c(F)c1)N(C)CCOc1cccc([N+](=O)[O-])c1 ZINC000515123993 1025035349 /nfs/dbraw/zinc/03/53/49/1025035349.db2.gz SHVSOWIRZUZHPQ-LBPRGKRZSA-N 0 3 336.338 3.945 20 5 EHBDHN O=[N+]([O-])c1sc(CN[C@@H]2C[C@@H]3CCC[C@@H]23)cc1Br ZINC000897958705 1033259703 /nfs/dbraw/zinc/25/97/03/1033259703.db2.gz MHSGWLQUHKNQQL-JVUFJMBOSA-N 0 3 331.235 3.697 20 5 EHBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1ccccc1OC(F)F ZINC000511065717 1025174800 /nfs/dbraw/zinc/17/48/00/1025174800.db2.gz PDJNHLJZANFVSB-UHFFFAOYSA-N 0 3 336.338 3.871 20 5 EHBDHN CC(C)c1ccc(CN2CCC[C@H](c3cc[nH]n3)C2)cc1[N+](=O)[O-] ZINC000121234582 1025934732 /nfs/dbraw/zinc/93/47/32/1025934732.db2.gz SRWZPNABAVQJCL-HNNXBMFYSA-N 0 3 328.416 3.821 20 5 EHBDHN CCN(CCCN[C@H](C)c1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000475132454 1026236134 /nfs/dbraw/zinc/23/61/34/1026236134.db2.gz XRXCLZVTDICZMW-GFCCVEGCSA-N 0 3 333.354 3.520 20 5 EHBDHN COCCNc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000127184419 1027409766 /nfs/dbraw/zinc/40/97/66/1027409766.db2.gz PQFAGUJBIFAYQB-AWEZNQCLSA-N 0 3 329.400 3.504 20 5 EHBDHN O=[N+]([O-])c1ccccc1CNCCOc1ccccc1C(F)(F)F ZINC000237810127 1027765704 /nfs/dbraw/zinc/76/57/04/1027765704.db2.gz MTKDJWLYKGTFGB-UHFFFAOYSA-N 0 3 340.301 3.782 20 5 EHBDHN CC(C)C[C@@H]1CCCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533391410 1027796382 /nfs/dbraw/zinc/79/63/82/1027796382.db2.gz XQEKOAKWZBNORR-INIZCTEOSA-N 0 3 334.416 3.862 20 5 EHBDHN Cc1cnc(NC[C@@H]2CCCN(Cc3cccs3)C2)c([N+](=O)[O-])c1 ZINC000078656081 1028046241 /nfs/dbraw/zinc/04/62/41/1028046241.db2.gz ORPDITTUJGKMLN-AWEZNQCLSA-N 0 3 346.456 3.684 20 5 EHBDHN CCS[C@H]1CCCC[C@H]1NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444685663 1028131685 /nfs/dbraw/zinc/13/16/85/1028131685.db2.gz PAIQAFHEMYBTQK-HIFRSBDPSA-N 0 3 334.445 3.625 20 5 EHBDHN CC[C@H]1CCCC[C@H]1N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681887 1028151957 /nfs/dbraw/zinc/15/19/57/1028151957.db2.gz RULKDUNXTZRSIV-WMLDXEAASA-N 0 3 333.432 3.742 20 5 EHBDHN COc1ccc(OCCN(C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000016419802 1028435665 /nfs/dbraw/zinc/43/56/65/1028435665.db2.gz JKZDDISUZZNVNM-AWEZNQCLSA-N 0 3 330.384 3.675 20 5 EHBDHN CC(C)c1ccc(CN[C@@H]2CCCc3[nH]c(=O)ccc32)cc1[N+](=O)[O-] ZINC000343088966 1029094789 /nfs/dbraw/zinc/09/47/89/1029094789.db2.gz ATGLIKXOCOFPJU-MRXNPFEDSA-N 0 3 341.411 3.986 20 5 EHBDHN CC[C@H](C)N[C@@H](CNc1nc(C)cc(C)c1[N+](=O)[O-])c1ccco1 ZINC000343258795 1029961212 /nfs/dbraw/zinc/96/12/12/1029961212.db2.gz WDZPYGKJWYWTFV-JSGCOSHPSA-N 0 3 332.404 3.741 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000245515288 1030109504 /nfs/dbraw/zinc/10/95/04/1030109504.db2.gz DJQBSAGIKSFGQZ-RVKKMQEKSA-N 0 3 328.416 3.744 20 5 EHBDHN CN(C)C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000583574591 1030168982 /nfs/dbraw/zinc/16/89/82/1030168982.db2.gz DPBUGARPYHYUIA-ROUUACIJSA-N 0 3 343.402 3.614 20 5 EHBDHN CCN(CC)[C@@H](CNc1ccc([N+](=O)[O-])c(OC)c1)c1ccco1 ZINC000174704855 1031247621 /nfs/dbraw/zinc/24/76/21/1031247621.db2.gz ZOPRYEDBJLFYGY-HNNXBMFYSA-N 0 3 333.388 3.691 20 5 EHBDHN COc1ccc(CN[C@H]2CCCc3c(OC)cccc32)cc1[N+](=O)[O-] ZINC000584032319 1031504759 /nfs/dbraw/zinc/50/47/59/1031504759.db2.gz HHEHDWZNIFIMQQ-INIZCTEOSA-N 0 3 342.395 3.779 20 5 EHBDHN C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000594489941 1033394395 /nfs/dbraw/zinc/39/43/95/1033394395.db2.gz IDRAROJLZIBBQO-LRDDRELGSA-N 0 3 340.379 3.704 20 5 EHBDHN C[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000594490670 1033394812 /nfs/dbraw/zinc/39/48/12/1033394812.db2.gz PFCFJCIYYQESEE-FZKQIMNGSA-N 0 3 349.394 3.514 20 5 EHBDHN C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2[nH]c(=O)[nH]c2c1 ZINC000594494522 1033397431 /nfs/dbraw/zinc/39/74/31/1033397431.db2.gz CAMYCALXMKLKBS-IINYFYTJSA-N 0 3 338.367 3.515 20 5 EHBDHN COc1cc(CN2CCC[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000063618735 1033521319 /nfs/dbraw/zinc/52/13/19/1033521319.db2.gz DXPFMKTYUFRFKS-GFCCVEGCSA-N 0 3 344.358 3.825 20 5 EHBDHN COC1CC(CCNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000594965145 1033602209 /nfs/dbraw/zinc/60/22/09/1033602209.db2.gz QGQQZHMWKGJKII-UHFFFAOYSA-N 0 3 347.440 3.623 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCc1nc(C)c(C)s1 ZINC000595021077 1033614352 /nfs/dbraw/zinc/61/43/52/1033614352.db2.gz OYIZFEOHHHSZIC-LLVKDONJSA-N 0 3 335.429 3.570 20 5 EHBDHN C[C@H](COc1c(F)cccc1F)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000595072777 1033646498 /nfs/dbraw/zinc/64/64/98/1033646498.db2.gz QOPVEJWVYZVXLI-VXGBXAGGSA-N 0 3 336.338 3.991 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F ZINC000593013361 1033806980 /nfs/dbraw/zinc/80/69/80/1033806980.db2.gz IAVWYLSAJOYQOK-RYUDHWBXSA-N 0 3 346.305 3.589 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN(Cc1ccc(F)cc1)C1CC1 ZINC000603836687 1033961731 /nfs/dbraw/zinc/96/17/31/1033961731.db2.gz ALICYFQZFVOBPC-UHFFFAOYSA-N 0 3 330.359 3.777 20 5 EHBDHN Cc1cc(NCC2CCN(Cc3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000596443509 1034246628 /nfs/dbraw/zinc/24/66/28/1034246628.db2.gz YPMFSTJPBVGRIP-UHFFFAOYSA-N 0 3 340.427 3.622 20 5 EHBDHN COCC1(C2CCC2)CN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000597195507 1034579979 /nfs/dbraw/zinc/57/99/79/1034579979.db2.gz JLGOTOMXYXMYAQ-OQLLNIDSSA-N 0 3 330.428 3.747 20 5 EHBDHN CCc1nnc(CN[C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000290146949 1034753504 /nfs/dbraw/zinc/75/35/04/1034753504.db2.gz LAWHCQLDBXUCMU-OCCSQVGLSA-N 0 3 346.456 3.510 20 5 EHBDHN CCCO[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000365191458 1034956238 /nfs/dbraw/zinc/95/62/38/1034956238.db2.gz SEDBGUAMKFEAHG-MRXNPFEDSA-N 0 3 336.432 3.775 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCCn2cccn2)c2ccccc2)c1 ZINC000180053460 1035301199 /nfs/dbraw/zinc/30/11/99/1035301199.db2.gz IPHHFAPVTKPNPV-LJQANCHMSA-N 0 3 336.395 3.561 20 5 EHBDHN CN1CC[C@@H](NCc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000589284650 1036340865 /nfs/dbraw/zinc/34/08/65/1036340865.db2.gz NZQLJZIQCOKGDL-SJLPKXTDSA-N 0 3 345.830 3.783 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[C@H]2c2ccc(F)cc2)c1 ZINC000269687383 1036728504 /nfs/dbraw/zinc/72/85/04/1036728504.db2.gz TVZMAYBXGOUAOA-ROUUACIJSA-N 0 3 330.359 3.604 20 5 EHBDHN C[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[C@@H](C)C1 ZINC000452066900 1036973717 /nfs/dbraw/zinc/97/37/17/1036973717.db2.gz LTMLYUNZGAWWTE-IPYPFGDCSA-N 0 3 344.415 3.949 20 5 EHBDHN CC[C@@H](CCO)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180738911 1037133580 /nfs/dbraw/zinc/13/35/80/1037133580.db2.gz MHZBLGFFSLEZNF-HNAYVOBHSA-N 0 3 328.412 3.682 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](C)Oc1ccc(C)cc1 ZINC000462733792 1037335628 /nfs/dbraw/zinc/33/56/28/1037335628.db2.gz KLNYEVJAVQIMNF-HNNXBMFYSA-N 0 3 344.411 3.859 20 5 EHBDHN C[C@@H]1C[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)CN1C1CC1 ZINC000177185147 1037409006 /nfs/dbraw/zinc/40/90/06/1037409006.db2.gz CRTWYUFDTRZXTO-GDBMZVCRSA-N 0 3 345.446 3.743 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN(CC1=CCCC1)[C@H]1CC[C@H](O)CC1 ZINC000592132495 1037842458 /nfs/dbraw/zinc/84/24/58/1037842458.db2.gz HJXMKKLGNDAFIE-IYARVYRRSA-N 0 3 330.428 3.811 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCOc1ncccc1Cl ZINC000539059970 1038659735 /nfs/dbraw/zinc/65/97/35/1038659735.db2.gz FNZAJBJVXHJERB-GFCCVEGCSA-N 0 3 335.791 3.681 20 5 EHBDHN Cc1ccc([C@H](C)NC(=O)[C@H](C(C)C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000488052309 1038809048 /nfs/dbraw/zinc/80/90/48/1038809048.db2.gz CAAVDNCDDZIRIV-YJBOKZPZSA-N 0 3 347.459 3.591 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1 ZINC000552272570 1039145017 /nfs/dbraw/zinc/14/50/17/1039145017.db2.gz VDYROCQIQBRKST-FUHWJXTLSA-N 0 3 348.349 3.963 20 5 EHBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1F)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000478209354 1039290464 /nfs/dbraw/zinc/29/04/64/1039290464.db2.gz QJXRUOQAJHUSFM-OAVHHTNSSA-N 0 3 330.359 3.777 20 5 EHBDHN O=[N+]([O-])c1ccccc1CNCCn1ccc2cc(Cl)ccc21 ZINC000512575220 1040178102 /nfs/dbraw/zinc/17/81/02/1040178102.db2.gz WMIXXDSOVJEDMI-UHFFFAOYSA-N 0 3 329.787 3.993 20 5 EHBDHN CN(C)[C@@H]1CCOc2c(Nc3ccc([N+](=O)[O-])cc3F)cccc21 ZINC000432925143 1040189476 /nfs/dbraw/zinc/18/94/76/1040189476.db2.gz BAQPPHJKHLTHGN-MRXNPFEDSA-N 0 3 331.347 3.863 20 5 EHBDHN CC(C)(CNCc1ccccc1[N+](=O)[O-])Oc1cc(F)cc(F)c1 ZINC000512580199 1040190091 /nfs/dbraw/zinc/19/00/91/1040190091.db2.gz ABLTYUDJMSNKHH-UHFFFAOYSA-N 0 3 336.338 3.820 20 5 EHBDHN COc1cccc(C2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000512589799 1040216896 /nfs/dbraw/zinc/21/68/96/1040216896.db2.gz BUJRJHKYKWVGTK-UHFFFAOYSA-N 0 3 326.396 3.983 20 5 EHBDHN CC(C)(C)Oc1ccc(CNC/C=C/c2ccccc2[N+](=O)[O-])cn1 ZINC000486566415 1040252397 /nfs/dbraw/zinc/25/23/97/1040252397.db2.gz NTDGWSOYQMPOFA-SOFGYWHQSA-N 0 3 341.411 3.970 20 5 EHBDHN CC[C@@H]1[C@H](C)CCN1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371483 1040791159 /nfs/dbraw/zinc/79/11/59/1040791159.db2.gz MXYURLXIVJSOIU-ZYHUDNBSSA-N 0 3 344.358 3.825 20 5 EHBDHN Cc1c(CN2CCC[C@@]3(C2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000481699341 1041265119 /nfs/dbraw/zinc/26/51/19/1041265119.db2.gz VHYOQSVHSWWMPK-FQEVSTJZSA-N 0 3 338.407 3.925 20 5 EHBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)CCCNC(=O)OC(C)(C)C ZINC000125250715 1041926580 /nfs/dbraw/zinc/92/65/80/1041926580.db2.gz SDXROIZQEORKOM-ZDUSSCGKSA-N 0 3 337.420 3.502 20 5 EHBDHN COC(=O)C(C)(C)[C@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000093283788 1042134550 /nfs/dbraw/zinc/13/45/50/1042134550.db2.gz IQTARADSKNIRTJ-ZFWWWQNUSA-N 0 3 334.416 3.567 20 5 EHBDHN CC(C)(C)[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000054396901 1042475789 /nfs/dbraw/zinc/47/57/89/1042475789.db2.gz PTZOHVLZOMVLQY-GOSISDBHSA-N 0 3 341.411 3.910 20 5 EHBDHN CN(CCCc1ccc2c(c1)CCO2)Cc1ccccc1[N+](=O)[O-] ZINC000482074468 1042913233 /nfs/dbraw/zinc/91/32/33/1042913233.db2.gz AOCUQQUFJLHNNZ-UHFFFAOYSA-N 0 3 326.396 3.594 20 5 EHBDHN O=[N+]([O-])c1cnc(NC2CCN(Cc3ccccc3)CC2)c(Cl)c1 ZINC000301280885 1127729870 /nfs/dbraw/zinc/72/98/70/1127729870.db2.gz OGCWSOSPICSNGC-UHFFFAOYSA-N 0 3 346.818 3.720 20 5 EHBDHN C[C@@H](N[C@@H](C)C1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172171392 1127798660 /nfs/dbraw/zinc/79/86/60/1127798660.db2.gz UHIUAKVAROPBOS-NWDGAFQWSA-N 0 3 330.388 3.874 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC(Cc2cccnc2)CC1 ZINC000542693634 1128542009 /nfs/dbraw/zinc/54/20/09/1128542009.db2.gz NNJULUQITNOYII-DAXSKMNVSA-N 0 3 337.423 3.958 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC(Cc2cccnc2)CC1 ZINC000542693635 1128542098 /nfs/dbraw/zinc/54/20/98/1128542098.db2.gz NNJULUQITNOYII-QPJJXVBHSA-N 0 3 337.423 3.958 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@@H]2/C=C/c2ccccc2)cc1 ZINC000780400261 1121575145 /nfs/dbraw/zinc/57/51/45/1121575145.db2.gz UQZPVQNKRTVKJO-FFQNAWCLSA-N 0 3 338.407 3.806 20 5 EHBDHN CC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(C)cc1 ZINC000194014255 1121752891 /nfs/dbraw/zinc/75/28/91/1121752891.db2.gz KIBOOLYXMFIDPW-QGZVFWFLSA-N 0 3 341.411 3.891 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCC1(c2cccc(F)c2)CC1 ZINC000610089146 1123729066 /nfs/dbraw/zinc/72/90/66/1123729066.db2.gz DCQGNMNTJQCTPL-UHFFFAOYSA-N 0 3 344.386 3.954 20 5 EHBDHN C[C@@]1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO[C@H]1C1CC1 ZINC000543242502 1129366587 /nfs/dbraw/zinc/36/65/87/1129366587.db2.gz QWYHRVXJECBNQF-RBUKOAKNSA-N 0 3 342.395 3.902 20 5 EHBDHN CC(C)(C)[C@@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000543247690 1129371506 /nfs/dbraw/zinc/37/15/06/1129371506.db2.gz VPOOKZFNUWFWFB-CYBMUJFWSA-N 0 3 330.388 3.513 20 5 EHBDHN COC[C@H](N[C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000156533881 1129723046 /nfs/dbraw/zinc/72/30/46/1129723046.db2.gz YBPJBHAWOHZKHF-BBRMVZONSA-N 0 3 332.400 3.795 20 5 EHBDHN C[C@@H](N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000701880045 1130178138 /nfs/dbraw/zinc/17/81/38/1130178138.db2.gz UYPJRTDGDDNNFP-QWHCGFSZSA-N 0 3 337.420 3.501 20 5 EHBDHN CC[C@H](C)[C@H](O)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000245976137 1130335857 /nfs/dbraw/zinc/33/58/57/1130335857.db2.gz OSXQVIVIVROWSG-GDIGMMSISA-N 0 3 328.412 3.681 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H](C)[C@H](C)C1 ZINC000246055903 1130339225 /nfs/dbraw/zinc/33/92/25/1130339225.db2.gz XWJJRVJVCAPJGK-UPJWGTAASA-N 0 3 330.388 3.684 20 5 EHBDHN C[C@H]1CN(Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])cc1F ZINC000740869883 1131550764 /nfs/dbraw/zinc/55/07/64/1131550764.db2.gz BQOLHSCBKGPEMM-HNNXBMFYSA-N 0 3 343.402 3.835 20 5 EHBDHN Cc1ccc(CN[C@H](C)c2cccc(-n3ccnc3)c2)cc1[N+](=O)[O-] ZINC000742391434 1131714902 /nfs/dbraw/zinc/71/49/02/1131714902.db2.gz HYVNGRXIUUBPQO-OAHLLOKOSA-N 0 3 336.395 3.940 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@H](NCc1ncc(Cl)s1)CC2 ZINC001172903746 1131886364 /nfs/dbraw/zinc/88/63/64/1131886364.db2.gz SXRXAKZGHBCERM-GFCCVEGCSA-N 0 3 337.832 3.742 20 5 EHBDHN Cc1noc(CN2CC[C@@H](c3ccc(C)cc3)C2(C)C)c1[N+](=O)[O-] ZINC001175714359 1132742155 /nfs/dbraw/zinc/74/21/55/1132742155.db2.gz HAEDTJJUXFPHAU-HNNXBMFYSA-N 0 3 329.400 3.968 20 5 EHBDHN Cc1nn(CN2CCC[C@@H]2CCC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000767766240 1133049782 /nfs/dbraw/zinc/04/97/82/1133049782.db2.gz RLKANKYCLLOLJY-CQSZACIVSA-N 0 3 331.420 3.506 20 5 EHBDHN Cc1ccccc1[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774873510 1134089755 /nfs/dbraw/zinc/08/97/55/1134089755.db2.gz JGAUFQWRAYTOEC-AWEZNQCLSA-N 0 3 341.367 3.801 20 5 EHBDHN COc1ccc(C[C@H](C)N2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170326628 1134748564 /nfs/dbraw/zinc/74/85/64/1134748564.db2.gz AVXJPVCKUHXAPD-AWEZNQCLSA-N 0 3 326.396 3.593 20 5 EHBDHN COc1ccc(C[C@@H](C)N(C)Cc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170347883 1134759524 /nfs/dbraw/zinc/75/95/24/1134759524.db2.gz SUJBEQDEYXABRP-CYBMUJFWSA-N 0 3 332.375 3.806 20 5 EHBDHN CN(C)[C@@H](CNc1ccc(N)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000804532135 1135109400 /nfs/dbraw/zinc/10/94/00/1135109400.db2.gz WWBRNOWNVLXNKD-INIZCTEOSA-N 0 3 334.807 3.545 20 5 EHBDHN CC(C)(C)N1CC[C@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC001131095625 1135591452 /nfs/dbraw/zinc/59/14/52/1135591452.db2.gz KYRMPSASJUIVAA-INIZCTEOSA-N 0 3 347.462 3.991 20 5 EHBDHN CN1CC[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1c1ccccc1 ZINC000776254066 1136104784 /nfs/dbraw/zinc/10/47/84/1136104784.db2.gz QYEVCQLEMUGIGX-ROUUACIJSA-N 0 3 345.830 3.783 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](Cn1ccnc1)C(C)(C)C ZINC000850424807 1136256324 /nfs/dbraw/zinc/25/63/24/1136256324.db2.gz HMQWRFRQCMUZLW-GUYCJALGSA-N 0 3 346.431 3.565 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C)[C@@H](O)c1ccc(F)cc1 ZINC000850437088 1136258577 /nfs/dbraw/zinc/25/85/77/1136258577.db2.gz ZCJWUWGRTRDVRM-VNBZBWLYSA-N 0 3 348.374 3.515 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C)[C@@](C)(O)c1ccccc1 ZINC000850477246 1136266806 /nfs/dbraw/zinc/26/68/06/1136266806.db2.gz RVHFBJJGKQXJLT-IQUTYRLHSA-N 0 3 344.411 3.550 20 5 EHBDHN CC(COC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)[N+](=O)[O-] ZINC000813106867 1136294250 /nfs/dbraw/zinc/29/42/50/1136294250.db2.gz IYBHUTMNGNKRBD-VIFPVBQESA-N 0 3 339.269 3.593 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CC[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666335 1136491779 /nfs/dbraw/zinc/49/17/79/1136491779.db2.gz GMGJIIKVNURMBM-CRAIPNDOSA-N 0 3 346.814 3.771 20 5 EHBDHN C[C@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc2c(c1)CCCO2 ZINC000853240425 1136521557 /nfs/dbraw/zinc/52/15/57/1136521557.db2.gz GZWASNNHGHUPCA-STQMWFEESA-N 0 3 341.411 3.914 20 5 EHBDHN Cc1nc2c(s1)[C@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815614992 1136618919 /nfs/dbraw/zinc/61/89/19/1136618919.db2.gz FZLIGKXWBWCEJI-TVQRCGJNSA-N 0 3 332.429 3.670 20 5 EHBDHN CCS(=O)(=O)C[C@@H](C)NCc1c2ccccc2cc2ccccc21 ZINC000113349621 1136697520 /nfs/dbraw/zinc/69/75/20/1136697520.db2.gz FUYIZILLNXIZRF-OAHLLOKOSA-N 0 3 341.476 3.906 20 5 EHBDHN CN1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2C1 ZINC000816617978 1136742651 /nfs/dbraw/zinc/74/26/51/1136742651.db2.gz MPMMCVNVZGIUHC-UHFFFAOYSA-N 0 3 331.803 3.700 20 5 EHBDHN COC1(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCC1 ZINC000816638119 1136743207 /nfs/dbraw/zinc/74/32/07/1136743207.db2.gz AOLIQLVFMWAWPT-UHFFFAOYSA-N 0 3 333.215 3.950 20 5 EHBDHN CC(C)C[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000776948688 1136883766 /nfs/dbraw/zinc/88/37/66/1136883766.db2.gz GMRINRDAIPFDSG-DZGCQCFKSA-N 0 3 326.824 3.932 20 5 EHBDHN CC([C@H](OC(=O)C[C@@H](C)c1ccco1)c1ccccc1F)[N+](=O)[O-] ZINC000860854565 1137081216 /nfs/dbraw/zinc/08/12/16/1137081216.db2.gz CUVQYCIIYGQGAY-PEBVRCNWSA-N 0 3 335.331 3.862 20 5 EHBDHN CC([C@@H](OC(=O)[C@@H]1C[C@H]1c1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000860855116 1137081322 /nfs/dbraw/zinc/08/13/22/1137081322.db2.gz RKZIDUDXHVRFPP-YZOIGVHSSA-N 0 3 349.383 3.940 20 5 EHBDHN CCOCOc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000824462814 1137140254 /nfs/dbraw/zinc/14/02/54/1137140254.db2.gz PUKLWGQLPKQTOY-AWEZNQCLSA-N 0 3 330.384 3.818 20 5 EHBDHN COC[C@H](C)Oc1ccc(CNCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000865787710 1137311860 /nfs/dbraw/zinc/31/18/60/1137311860.db2.gz RLQXSWOEUWGMFO-HNNXBMFYSA-N 0 3 344.411 3.607 20 5 EHBDHN CC([C@@H](OC(=O)CCc1cccs1)c1ccccc1F)[N+](=O)[O-] ZINC000845872278 1137316015 /nfs/dbraw/zinc/31/60/15/1137316015.db2.gz FWPYYYIQNXWHLP-BDJLRTHQSA-N 0 3 337.372 3.770 20 5 EHBDHN CC([C@H](OC(=O)CCc1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000845874295 1137316147 /nfs/dbraw/zinc/31/61/47/1137316147.db2.gz YSBVCYNRDAHMMI-ZBEGNZNMSA-N 0 3 337.372 3.770 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@]23CCC[C@H]2OCC3)o1 ZINC000865858832 1137317383 /nfs/dbraw/zinc/31/73/83/1137317383.db2.gz ILQSANPKSUVYRM-MSOLQXFVSA-N 0 3 328.368 3.656 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](O)c1ccccc1Cl ZINC000773011005 1137459232 /nfs/dbraw/zinc/45/92/32/1137459232.db2.gz QQJVHGFYNSZALU-SJKOYZFVSA-N 0 3 334.803 3.941 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC3CC3)o2)c(Br)c1 ZINC000036819301 1137474715 /nfs/dbraw/zinc/47/47/15/1137474715.db2.gz WOIQYIJWQAPJCL-UHFFFAOYSA-N 0 3 337.173 3.869 20 5 EHBDHN C[C@H](NC[C@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872038696 1137566898 /nfs/dbraw/zinc/56/68/98/1137566898.db2.gz OZMBRPKQGUDYRT-ZFWWWQNUSA-N 0 3 332.375 3.551 20 5 EHBDHN C[C@H](N[C@@H]1CCO[C@@H](c2ccccn2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077399 1137570004 /nfs/dbraw/zinc/57/00/04/1137570004.db2.gz HSFCXLKXBKJTLG-OGHNNQOOSA-N 0 3 345.374 3.700 20 5 EHBDHN CC[C@H]1CCCC[C@@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447451 1137716332 /nfs/dbraw/zinc/71/63/32/1137716332.db2.gz MUGSELXQRQAVPK-JSGCOSHPSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1ccc(CN(C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)o1 ZINC000104662179 1137878871 /nfs/dbraw/zinc/87/88/71/1137878871.db2.gz UILZWYMUQLDCAQ-UHFFFAOYSA-N 0 3 341.367 3.826 20 5 EHBDHN Cc1sc(C(=O)Nc2cc(CN(C)C)ccc2C)cc1[N+](=O)[O-] ZINC000177348231 1139614722 /nfs/dbraw/zinc/61/47/22/1139614722.db2.gz HMFKCEHNHXLFPA-UHFFFAOYSA-N 0 3 333.413 3.587 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ccccc1-n1ccnc1)CCC2 ZINC000192727146 1140548172 /nfs/dbraw/zinc/54/81/72/1140548172.db2.gz AYOCYGCCRLZCSX-LJQANCHMSA-N 0 3 348.406 3.948 20 5 EHBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CCCc2c[nH]nc21 ZINC000271558786 1141397482 /nfs/dbraw/zinc/39/74/82/1141397482.db2.gz WIBDAPHEKCVWEI-ZIAGYGMSSA-N 0 3 346.456 3.856 20 5 EHBDHN O=[N+]([O-])c1cc(CN2CCC[C@H]2C2CCCC2)c2c(c1)COCO2 ZINC000055927962 214348987 /nfs/dbraw/zinc/34/89/87/214348987.db2.gz UBOVJDFPKCQGGJ-KRWDZBQOSA-N 0 3 332.400 3.616 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN(C)[C@H]1CCc2ccccc2C1 ZINC000430196372 1014813602 /nfs/dbraw/zinc/81/36/02/1014813602.db2.gz QYRIGMRLVCSBNC-KRWDZBQOSA-N 0 3 326.396 3.593 20 5 EHBDHN COc1ccc(CCCN(C)Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430227362 1015121990 /nfs/dbraw/zinc/12/19/90/1015121990.db2.gz RATJITNYMCZEIB-UHFFFAOYSA-N 0 3 344.411 3.677 20 5 EHBDHN CCSc1cc(CNC/C=C/c2ccccc2[N+](=O)[O-])ccn1 ZINC000189584556 1016563709 /nfs/dbraw/zinc/56/37/09/1016563709.db2.gz SXVDIDBIFIUOLF-FNORWQNLSA-N 0 3 329.425 3.905 20 5 EHBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593526 1032315031 /nfs/dbraw/zinc/31/50/31/1032315031.db2.gz VOYBOPWMXNVOAE-UGSOOPFHSA-N 0 3 334.416 3.710 20 5 EHBDHN C[C@@H]1CCCC[C@@]1(C)NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000459615517 1032353088 /nfs/dbraw/zinc/35/30/88/1032353088.db2.gz PEABAZIOVPVEOP-SJKOYZFVSA-N 0 3 330.388 3.703 20 5 EHBDHN Cc1ccc([C@H](C)NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000182329529 1019065365 /nfs/dbraw/zinc/06/53/65/1019065365.db2.gz PFXCSDVMEBZKFF-AWEZNQCLSA-N 0 3 327.384 3.501 20 5 EHBDHN CCCCNC(=O)[C@@H]1CCCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182718412 1019738684 /nfs/dbraw/zinc/73/86/84/1019738684.db2.gz LAWUPBSGLNPYMT-JKSUJKDBSA-N 0 3 347.459 3.593 20 5 EHBDHN CCC(C)(C)[C@@H]1CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000156732586 1020295946 /nfs/dbraw/zinc/29/59/46/1020295946.db2.gz MLFOGKKNULEIAK-INIZCTEOSA-N 0 3 334.416 3.862 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN(CCC(F)(F)F)CC1CC1 ZINC000084137481 1021006027 /nfs/dbraw/zinc/00/60/27/1021006027.db2.gz QIEHXZZIWALVDS-UHFFFAOYSA-N 0 3 332.322 3.638 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN[C@@H]3CCOC4(CCCCC4)C3)nc2c1 ZINC000602569537 1032977418 /nfs/dbraw/zinc/97/74/18/1032977418.db2.gz SXMFKDWCVWNYFS-CYBMUJFWSA-N 0 3 345.399 3.708 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441295805 1022138921 /nfs/dbraw/zinc/13/89/21/1022138921.db2.gz UATQVSYPTUBEPB-HOTGVXAUSA-N 0 3 348.443 3.631 20 5 EHBDHN Cc1c([C@@H](C)N[C@H](C)c2ccc3[nH]c(=O)[nH]c3c2)cccc1[N+](=O)[O-] ZINC000610818772 1023782219 /nfs/dbraw/zinc/78/22/19/1023782219.db2.gz ANXJIQKRIDBXGR-VXGBXAGGSA-N 0 3 340.383 3.897 20 5 EHBDHN C[C@@H]1CC[C@@H](NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000119456431 1024260921 /nfs/dbraw/zinc/26/09/21/1024260921.db2.gz BKIHHQNVFDFWMQ-LALPHHSUSA-N 0 3 330.388 3.559 20 5 EHBDHN CN(C)[C@H](CNc1ccc([N+](=O)[O-])c2ncccc12)c1cccs1 ZINC000346695437 1025019083 /nfs/dbraw/zinc/01/90/83/1025019083.db2.gz BPNAAHQFPVMOMR-OAHLLOKOSA-N 0 3 342.424 3.919 20 5 EHBDHN O=[N+]([O-])c1cccc(F)c1CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000438996709 1025384645 /nfs/dbraw/zinc/38/46/45/1025384645.db2.gz PPOLSGIVJKGAMM-QBIMZIAESA-N 0 3 336.407 3.640 20 5 EHBDHN CCC[C@@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)(C)C ZINC000451414560 1025948540 /nfs/dbraw/zinc/94/85/40/1025948540.db2.gz DKUJGGWMKARFBU-CQSZACIVSA-N 0 3 332.404 3.949 20 5 EHBDHN CN(C)Cc1ccc(-c2noc(-c3cc(F)cc([N+](=O)[O-])c3)n2)cc1 ZINC000530632150 1026139467 /nfs/dbraw/zinc/13/94/67/1026139467.db2.gz HXMNGGDLAVPAEX-UHFFFAOYSA-N 0 3 342.330 3.513 20 5 EHBDHN Cc1cccc([C@H](C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000452089775 1026484477 /nfs/dbraw/zinc/48/44/77/1026484477.db2.gz QBIJSKQZSVVYNP-GJZGRUSLSA-N 0 3 341.411 3.889 20 5 EHBDHN COc1ccc(CN[C@H]2c3cc(C)ccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000503900631 1028193713 /nfs/dbraw/zinc/19/37/13/1028193713.db2.gz HPYCWOSYKKAOLL-ORAYPTAESA-N 0 3 326.396 3.935 20 5 EHBDHN COc1ccc(OCCN(C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000016419803 1028436614 /nfs/dbraw/zinc/43/66/14/1028436614.db2.gz JKZDDISUZZNVNM-CQSZACIVSA-N 0 3 330.384 3.675 20 5 EHBDHN CC[C@H](C)[C@@H](C)N(CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288259 1029578759 /nfs/dbraw/zinc/57/87/59/1029578759.db2.gz WUFPQVPSYZPABD-GXTWGEPZSA-N 0 3 333.432 3.741 20 5 EHBDHN Cc1cccc([C@@H](C)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000441207062 1029963304 /nfs/dbraw/zinc/96/33/04/1029963304.db2.gz XSTOQIZMMJLASI-MRXNPFEDSA-N 0 3 325.412 3.786 20 5 EHBDHN CCOc1ccc([C@H](C)N2CCC[C@@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000453365340 1030180092 /nfs/dbraw/zinc/18/00/92/1030180092.db2.gz LVARIAAIFKWXAN-KBXCAEBGSA-N 0 3 334.416 3.557 20 5 EHBDHN O=[N+]([O-])c1cccc(CN[C@H](c2ccccc2)C2(CO)CCCC2)c1 ZINC000453614345 1030405010 /nfs/dbraw/zinc/40/50/10/1030405010.db2.gz MCWGMGLOCQXJPQ-LJQANCHMSA-N 0 3 340.423 3.978 20 5 EHBDHN Cc1cnc(CCN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)c1 ZINC000583691012 1030462764 /nfs/dbraw/zinc/46/27/64/1030462764.db2.gz SFEJNNVQJMJCNH-UHFFFAOYSA-N 0 3 325.412 3.814 20 5 EHBDHN CC(C)(C)[C@@H]1CCCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000483251363 1031065292 /nfs/dbraw/zinc/06/52/92/1031065292.db2.gz CZBJTNZDQRDWAD-CQSZACIVSA-N 0 3 344.415 3.903 20 5 EHBDHN COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])cc2Cl)N(C)C)c1 ZINC000007979741 1031287653 /nfs/dbraw/zinc/28/76/53/1031287653.db2.gz WTNOZLCQAIKHAF-QGZVFWFLSA-N 0 3 349.818 3.972 20 5 EHBDHN C[C@@H]1CCC[C@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]1C ZINC000248544657 1031956395 /nfs/dbraw/zinc/95/63/95/1031956395.db2.gz DSWMIKYBYNOFEG-XUJVJEKNSA-N 0 3 330.388 3.559 20 5 EHBDHN CCS[C@H]1CC[C@@H](N(C)Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000173487880 1033369437 /nfs/dbraw/zinc/36/94/37/1033369437.db2.gz NYBDKGJUYQAWRW-HIFRSBDPSA-N 0 3 334.445 3.508 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H](CCCO)c1ccccc1 ZINC000594495265 1033396342 /nfs/dbraw/zinc/39/63/42/1033396342.db2.gz PGAZEJVJZSRJQS-ROUUACIJSA-N 0 3 326.396 3.686 20 5 EHBDHN Cc1ncccc1CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000898253408 1033409867 /nfs/dbraw/zinc/40/98/67/1033409867.db2.gz OCMOLRYNCCBHAK-UHFFFAOYSA-N 0 3 340.210 3.937 20 5 EHBDHN O=[N+]([O-])c1ccc(CNC[C@@H](c2ccco2)N2CCCCC2)cc1 ZINC000061013460 1033436094 /nfs/dbraw/zinc/43/60/94/1033436094.db2.gz IWMVHMXSUJCRHY-KRWDZBQOSA-N 0 3 329.400 3.505 20 5 EHBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)c(Cl)c1 ZINC000594996624 1033624278 /nfs/dbraw/zinc/62/42/78/1033624278.db2.gz UIAFHETXJPGVEM-HYVNUMGLSA-N 0 3 332.762 3.815 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc(CN(CCC3CC3)CC3CC3)n2)cc1 ZINC000595872359 1034031612 /nfs/dbraw/zinc/03/16/12/1034031612.db2.gz WLWYWDJWRCLTOI-UHFFFAOYSA-N 0 3 342.399 3.657 20 5 EHBDHN Cc1ccc([C@H](C)NCCC(=O)Nc2ccccc2F)cc1[N+](=O)[O-] ZINC000411477433 1034892197 /nfs/dbraw/zinc/89/21/97/1034892197.db2.gz RULJTKIWUUNNTE-ZDUSSCGKSA-N 0 3 345.374 3.722 20 5 EHBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC2(CCOCC2)[C@@H]1C ZINC000612540179 1035044082 /nfs/dbraw/zinc/04/40/82/1035044082.db2.gz CBNNNOBZJPTFAT-HNNXBMFYSA-N 0 3 348.443 3.773 20 5 EHBDHN CC(C)c1ccc([C@@H]2CCCN2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000535381397 1036423636 /nfs/dbraw/zinc/42/36/36/1036423636.db2.gz IHTRECUFMZVADI-SFHVURJKSA-N 0 3 328.416 3.752 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)c1ccc(NC(N)=O)cc1 ZINC000165434066 1036557903 /nfs/dbraw/zinc/55/79/03/1036557903.db2.gz PRTXGXBNCBKYFA-CHWSQXEVSA-N 0 3 342.399 3.806 20 5 EHBDHN C[C@@H](NCCC(=O)Nc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000180446348 1036839419 /nfs/dbraw/zinc/83/94/19/1036839419.db2.gz XCISZVNMBRDMSX-GFCCVEGCSA-N 0 3 347.802 3.928 20 5 EHBDHN CO[C@@H](CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000493308449 1037242708 /nfs/dbraw/zinc/24/27/08/1037242708.db2.gz YPFXHIWGHXBHSG-OALUTQOASA-N 0 3 328.412 3.945 20 5 EHBDHN COc1ccc(CN2CC[C@H](c3cccc(C)c3)C2)cc1[N+](=O)[O-] ZINC000542318603 1037285964 /nfs/dbraw/zinc/28/59/64/1037285964.db2.gz VGVLMWBJMVZROP-KRWDZBQOSA-N 0 3 326.396 3.901 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1C[C@H](OCC)C12CCCC2 ZINC000462756709 1037371926 /nfs/dbraw/zinc/37/19/26/1037371926.db2.gz OXUOOZRISIISOS-ROUUACIJSA-N 0 3 348.443 3.821 20 5 EHBDHN O=[N+]([O-])c1ccc(CCNCc2ccc(CSC(F)F)o2)cc1 ZINC000058093515 1037479730 /nfs/dbraw/zinc/47/97/30/1037479730.db2.gz ZJNQYSWIWPZEEN-UHFFFAOYSA-N 0 3 342.367 3.976 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)cc1CNCCSCC(F)(F)F ZINC000698970092 1037635114 /nfs/dbraw/zinc/63/51/14/1037635114.db2.gz ZSFXEKDLIFVDDE-UHFFFAOYSA-N 0 3 328.743 3.633 20 5 EHBDHN Cc1ccc([C@H](CNc2ncc(C)cc2[N+](=O)[O-])N2CCCC2)cc1 ZINC000463051291 1037701050 /nfs/dbraw/zinc/70/10/50/1037701050.db2.gz ALMWSRZQENBKGE-SFHVURJKSA-N 0 3 340.427 3.856 20 5 EHBDHN CCc1ccc([C@@H]2CCCCCN2CCn2cc([N+](=O)[O-])cn2)o1 ZINC000174871417 1041203766 /nfs/dbraw/zinc/20/37/66/1041203766.db2.gz BEAXNIJYHRQLGZ-INIZCTEOSA-N 0 3 332.404 3.564 20 5 EHBDHN C[C@H](O)CC(C)(C)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290779987 1041368699 /nfs/dbraw/zinc/36/86/99/1041368699.db2.gz CEWPQDMTNAYBNT-VIFPVBQESA-N 0 3 335.231 3.788 20 5 EHBDHN Cc1ccc([C@H](C)NCCC(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000164977477 1042580877 /nfs/dbraw/zinc/58/08/77/1042580877.db2.gz AMCNDAGWSQBHCU-AWEZNQCLSA-N 0 3 327.384 3.583 20 5 EHBDHN CCn1nccc1C1CCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000278901061 1042880898 /nfs/dbraw/zinc/88/08/98/1042880898.db2.gz PJLNVCIMARMSBV-AWEZNQCLSA-N 0 3 328.416 3.752 20 5 EHBDHN CN(Cc1ccc(F)c(Cl)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000763823646 1126877171 /nfs/dbraw/zinc/87/71/71/1126877171.db2.gz JHXJVZLJADNXEW-MRXNPFEDSA-N 0 3 338.766 3.553 20 5 EHBDHN CC[C@H](C)CN(CC)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000764283775 1127473553 /nfs/dbraw/zinc/47/35/53/1127473553.db2.gz SKDKRSHBQKCVCY-NSHDSACASA-N 0 3 327.812 3.555 20 5 EHBDHN CN(C)CCSc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000301607965 1128516389 /nfs/dbraw/zinc/51/63/89/1128516389.db2.gz OEZOREGADPFPRR-UHFFFAOYSA-N 0 3 328.743 3.921 20 5 EHBDHN Cc1ccc([C@H](CNCc2ccc(C)c([N+](=O)[O-])c2)N2CCCC2)o1 ZINC000237630782 1120314047 /nfs/dbraw/zinc/31/40/47/1120314047.db2.gz CCDRABYAWPKYKM-SFHVURJKSA-N 0 3 343.427 3.731 20 5 EHBDHN O=[N+]([O-])c1ccc(CNCCc2nc3c(s2)CCC3)c(Cl)c1 ZINC000922715058 1129638614 /nfs/dbraw/zinc/63/86/14/1129638614.db2.gz OZGYBSCLCCJIDG-UHFFFAOYSA-N 0 3 337.832 3.526 20 5 EHBDHN Cc1ncc([N+](=O)[O-])n1CCN[C@@H](C)c1oc2ccccc2c1C ZINC000602810629 1129904009 /nfs/dbraw/zinc/90/40/09/1129904009.db2.gz NELRYIGNPOPTOY-LBPRGKRZSA-N 0 3 328.372 3.505 20 5 EHBDHN CCCCNC(=O)[C@H]1CCCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245521614 1130230518 /nfs/dbraw/zinc/23/05/18/1130230518.db2.gz LAWUPBSGLNPYMT-CVEARBPZSA-N 0 3 347.459 3.593 20 5 EHBDHN CC(C)[C@H]1CCCN(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000738241924 1131465721 /nfs/dbraw/zinc/46/57/21/1131465721.db2.gz VASOVEKMWDWZRQ-HNNXBMFYSA-N 0 3 343.431 3.569 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCCC3(CCC3)C2)c1F ZINC001173191656 1131995495 /nfs/dbraw/zinc/99/54/95/1131995495.db2.gz FORQIYVTBWHAII-CYBMUJFWSA-N 0 3 336.407 3.940 20 5 EHBDHN COc1ccc(F)c(CN[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1F ZINC001173216003 1132001759 /nfs/dbraw/zinc/00/17/59/1132001759.db2.gz GYDMZIYPTRFSPW-NSHDSACASA-N 0 3 336.338 3.602 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCOc2cc(F)cc(F)c21 ZINC001173220255 1132004136 /nfs/dbraw/zinc/00/41/36/1132004136.db2.gz WSXKNVDYUIYDLT-BDJLRTHQSA-N 0 3 348.349 3.917 20 5 EHBDHN COc1cccnc1[C@@H](N[C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173228807 1132008307 /nfs/dbraw/zinc/00/83/07/1132008307.db2.gz KLGGMNMMAQCISX-UGSOOPFHSA-N 0 3 341.411 3.670 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC(C(=O)OC(C)(C)C)CC1 ZINC001173228605 1132008424 /nfs/dbraw/zinc/00/84/24/1132008424.db2.gz YFOYLIKIAVNTNB-CQSZACIVSA-N 0 3 348.443 3.580 20 5 EHBDHN COC(=O)[C@@H]1CCCC[C@@H]1CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860257 1132583197 /nfs/dbraw/zinc/58/31/97/1132583197.db2.gz VYKFJNJSGUQUPC-CRAIPNDOSA-N 0 3 346.427 3.539 20 5 EHBDHN CC(C)C[C@@H](N)c1nc2ccccc2n1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168990235 1132634977 /nfs/dbraw/zinc/63/49/77/1132634977.db2.gz YUOIIIBSAMEHOZ-QLFBSQMISA-N 0 3 330.432 3.700 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(C[C@H](O)c2cccc(Cl)c2)C2CC2)c1 ZINC000768544276 1133157959 /nfs/dbraw/zinc/15/79/59/1133157959.db2.gz KUXCNTBBHQELRU-SFHVURJKSA-N 0 3 346.814 3.946 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC[C@@H](C(=O)OC(C)(C)C)C1 ZINC001183397135 1133798917 /nfs/dbraw/zinc/79/89/17/1133798917.db2.gz ZYTXOZZTISBHGB-OAHLLOKOSA-N 0 3 348.443 3.765 20 5 EHBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1ccc([N+](=O)[O-])cc1 ZINC000786809874 1133909741 /nfs/dbraw/zinc/90/97/41/1133909741.db2.gz ADCCVCGNGUTZFX-UKTHLTGXSA-N 0 3 327.340 3.696 20 5 EHBDHN CCCOc1ccc(CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788543612 1134140350 /nfs/dbraw/zinc/14/03/50/1134140350.db2.gz XYHORRJSLUKCAF-ZDUSSCGKSA-N 0 3 329.400 3.817 20 5 EHBDHN COc1cccc2c1CC[C@H]2N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788631775 1134153579 /nfs/dbraw/zinc/15/35/79/1134153579.db2.gz MWZZSBBOSVDGHN-MEDUHNTESA-N 0 3 327.384 3.524 20 5 EHBDHN COc1cccc2c1CC[C@@H]2N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788631776 1134153812 /nfs/dbraw/zinc/15/38/12/1134153812.db2.gz MWZZSBBOSVDGHN-ZBEGNZNMSA-N 0 3 327.384 3.524 20 5 EHBDHN CC[C@@H](C)N1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])CC1 ZINC001186452188 1134214429 /nfs/dbraw/zinc/21/44/29/1134214429.db2.gz OLWIPPNXOMDCLS-GFCCVEGCSA-N 0 3 348.834 3.717 20 5 EHBDHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC001131095626 1135591682 /nfs/dbraw/zinc/59/16/82/1135591682.db2.gz KYRMPSASJUIVAA-MRXNPFEDSA-N 0 3 347.462 3.991 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC1(CO)CCCCC1 ZINC000809964026 1135904435 /nfs/dbraw/zinc/90/44/35/1135904435.db2.gz CVKGIVAUDPPKGV-UHFFFAOYSA-N 0 3 333.215 3.686 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H]1CCC[C@H](O)C1 ZINC000811481532 1136091384 /nfs/dbraw/zinc/09/13/84/1136091384.db2.gz FDWSICKOMNCOQE-CABZTGNLSA-N 0 3 333.215 3.542 20 5 EHBDHN CO[C@@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1(C)C ZINC000811483479 1136092108 /nfs/dbraw/zinc/09/21/08/1136092108.db2.gz JYKADJLSOLKYEW-VXGBXAGGSA-N 0 3 333.215 3.805 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCC3SCCS3)o2)c1 ZINC000850401476 1136249928 /nfs/dbraw/zinc/24/99/28/1136249928.db2.gz CZIGVZQTFPVNAL-UHFFFAOYSA-N 0 3 336.438 3.751 20 5 EHBDHN CC(COC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1)[N+](=O)[O-] ZINC000813107940 1136294015 /nfs/dbraw/zinc/29/40/15/1136294015.db2.gz RVRTUWSVYGMIEZ-MLGOLLRUSA-N 0 3 349.383 3.868 20 5 EHBDHN CC(COC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1)[N+](=O)[O-] ZINC000813107941 1136294187 /nfs/dbraw/zinc/29/41/87/1136294187.db2.gz RVRTUWSVYGMIEZ-WBMJQRKESA-N 0 3 349.383 3.868 20 5 EHBDHN CC(COC(=O)C[C@H](Cc1ccccc1)c1ccccc1)[N+](=O)[O-] ZINC000813106932 1136294221 /nfs/dbraw/zinc/29/42/21/1136294221.db2.gz ICWWVSUIAKLHDR-YJBOKZPZSA-N 0 3 327.380 3.611 20 5 EHBDHN CC(COC(=O)c1ccc2c(ccn2Cc2ccccc2)c1)[N+](=O)[O-] ZINC000813113706 1136294555 /nfs/dbraw/zinc/29/45/55/1136294555.db2.gz TVGZHCGKGUKCOU-AWEZNQCLSA-N 0 3 338.363 3.512 20 5 EHBDHN CC(COC(=O)c1ccc(O[C@@H](C)c2ccccc2)cc1)[N+](=O)[O-] ZINC000813111971 1136294695 /nfs/dbraw/zinc/29/46/95/1136294695.db2.gz YHKJIXOYPKQLQU-KGLIPLIRSA-N 0 3 329.352 3.649 20 5 EHBDHN CC([C@@H](OC(=O)[C@H](C)Cc1ccco1)c1ccccc1F)[N+](=O)[O-] ZINC000851109244 1136338443 /nfs/dbraw/zinc/33/84/43/1136338443.db2.gz WCJZKJIPLBSKPN-XHBSWPGZSA-N 0 3 335.331 3.547 20 5 EHBDHN CC([C@@H](OC(=O)C1CC2(CC2(F)F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000851109411 1136338456 /nfs/dbraw/zinc/33/84/56/1136338456.db2.gz XXMZUCFPZKFCNF-KTQYMABVSA-N 0 3 343.301 3.511 20 5 EHBDHN CC1(C)CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000776591392 1136450531 /nfs/dbraw/zinc/45/05/31/1136450531.db2.gz MECOHKIAHSLRCG-MSOLQXFVSA-N 0 3 326.396 3.711 20 5 EHBDHN CC([C@H](OC(=O)[C@@H]1C[C@H]1c1ccsc1)c1ccccc1F)[N+](=O)[O-] ZINC000860855115 1137081370 /nfs/dbraw/zinc/08/13/70/1137081370.db2.gz RKZIDUDXHVRFPP-FTOGJNOLSA-N 0 3 349.383 3.940 20 5 EHBDHN COCc1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccco1)N1CCCC1 ZINC000266029645 1137111769 /nfs/dbraw/zinc/11/17/69/1137111769.db2.gz RRGOJWLVGDKFQO-KRWDZBQOSA-N 0 3 345.399 3.583 20 5 EHBDHN CC(C)(C)[C@H]1CCCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000794706720 1137239705 /nfs/dbraw/zinc/23/97/05/1137239705.db2.gz WABVWJFZHJLYHW-HNNXBMFYSA-N 0 3 343.431 3.569 20 5 EHBDHN CC([C@@H](OC(=O)C1(F)CCCCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845877757 1137316368 /nfs/dbraw/zinc/31/63/68/1137316368.db2.gz GTXUYQYAPFWLRJ-BXUZGUMPSA-N 0 3 327.327 3.748 20 5 EHBDHN CS[C@H](C)CCC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874957 1137316515 /nfs/dbraw/zinc/31/65/15/1137316515.db2.gz JCEDMSBEIHTZQS-HFAKWTLXSA-N 0 3 329.393 3.607 20 5 EHBDHN CC([C@@H](OC(=O)c1coc(C2CCC2)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845879982 1137316752 /nfs/dbraw/zinc/31/67/52/1137316752.db2.gz JJUDXWKXMIJTRG-ZUZCIYMTSA-N 0 3 348.330 3.645 20 5 EHBDHN CC(=O)Oc1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000122902062 1137475638 /nfs/dbraw/zinc/47/56/38/1137475638.db2.gz OLGSEVATIVLFCI-UHFFFAOYSA-N 0 3 342.395 3.931 20 5 EHBDHN CSc1cc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])co1 ZINC000870454913 1137493219 /nfs/dbraw/zinc/49/32/19/1137493219.db2.gz RGKPUVSTARCBHX-LKFCYVNXSA-N 0 3 339.344 3.704 20 5 EHBDHN CCC(=O)c1ccc(N2CCC[C@@H]2CN2CCCCC2)c([N+](=O)[O-])c1 ZINC000795141459 1137507113 /nfs/dbraw/zinc/50/71/13/1137507113.db2.gz WQBREVWGYOURNY-MRXNPFEDSA-N 0 3 345.443 3.642 20 5 EHBDHN C[C@H](N[C@@H]1CCC[C@@H]1Cc1cnn(C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086094 1137570490 /nfs/dbraw/zinc/57/04/90/1137570490.db2.gz ROGMRUUJTJJONV-JGGQBBKZSA-N 0 3 346.406 3.529 20 5 EHBDHN C[C@H](c1ccncc1)N1CCC(Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000119263880 1137939695 /nfs/dbraw/zinc/93/96/95/1137939695.db2.gz TXQCNFDPAYHBMP-CYBMUJFWSA-N 0 3 344.390 3.766 20 5 EHBDHN C[C@H](c1ccncc1)N1CCC(Nc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000119294151 1137940239 /nfs/dbraw/zinc/94/02/39/1137940239.db2.gz BGBCEWOBSFEVDY-CYBMUJFWSA-N 0 3 344.390 3.766 20 5 EHBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000177307472 1139612328 /nfs/dbraw/zinc/61/23/28/1139612328.db2.gz CUUIFMKIRTYPLT-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCC[C@@H]3CCCCO3)cs2)c1 ZINC000181252312 1139896267 /nfs/dbraw/zinc/89/62/67/1139896267.db2.gz DGHLKXWIIJIZHT-INIZCTEOSA-N 0 3 347.440 3.767 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000192024849 1140497535 /nfs/dbraw/zinc/49/75/35/1140497535.db2.gz JPDQFSMCKZKDQM-RDJZCZTQSA-N 0 3 332.787 3.868 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C ZINC000267460863 1140794137 /nfs/dbraw/zinc/79/41/37/1140794137.db2.gz VBFIZNNVCDHYPJ-QWHCGFSZSA-N 0 3 339.395 3.526 20 5 EHBDHN CN(CC[C@H]1CCCO1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339116650 1141501447 /nfs/dbraw/zinc/50/14/47/1141501447.db2.gz UZYHIOCVNHUJJL-CYBMUJFWSA-N 0 3 332.322 3.615 20 5 EHBDHN C[C@@]1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCOC1 ZINC000120181387 1014570715 /nfs/dbraw/zinc/57/07/15/1014570715.db2.gz NHMDCPGZCXHYKK-MRXNPFEDSA-N 0 3 336.775 3.777 20 5 EHBDHN C[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000339503484 1014601511 /nfs/dbraw/zinc/60/15/11/1014601511.db2.gz BRMDSBXTLIXBTL-VTWSYHNCSA-N 0 3 344.436 3.696 20 5 EHBDHN COc1ccc([C@H]2CCN(Cc3ccc([N+](=O)[O-])cc3OC)C2)cc1 ZINC000430228995 1015128215 /nfs/dbraw/zinc/12/82/15/1015128215.db2.gz SOCLOLZJZBCBLB-HNNXBMFYSA-N 0 3 342.395 3.602 20 5 EHBDHN CC[C@H](C)[C@H](N)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000430383824 1016579787 /nfs/dbraw/zinc/57/97/87/1016579787.db2.gz JJRXJNYEOLBISG-SJCJKPOMSA-N 0 3 343.383 3.699 20 5 EHBDHN Cc1c([C@H](C)N[C@H](CN(C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368977 1032251859 /nfs/dbraw/zinc/25/18/59/1032251859.db2.gz PVQVZKDNOAOGGV-KBXCAEBGSA-N 0 3 345.418 3.996 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(CCc2noc3ccccc32)C2CC2)cc1 ZINC000593968926 1032662738 /nfs/dbraw/zinc/66/27/38/1032662738.db2.gz ODODDGOHTAYHCE-UHFFFAOYSA-N 0 3 337.379 3.943 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](N[C@@H]2C[C@H]3OCCC[C@H]23)c2ccccc2)c1 ZINC000187302018 1017873586 /nfs/dbraw/zinc/87/35/86/1017873586.db2.gz AVFBLVKAOMQSFP-UAFMIMERSA-N 0 3 338.407 3.841 20 5 EHBDHN O=[N+]([O-])c1cc(CNC[C@@H]2CCCO2)ccc1Oc1ccc(F)cc1 ZINC000119918916 1018208273 /nfs/dbraw/zinc/20/82/73/1018208273.db2.gz VVYIMGBAVXTSJB-INIZCTEOSA-N 0 3 346.358 3.795 20 5 EHBDHN Cc1ccccc1C1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000178861399 1019308055 /nfs/dbraw/zinc/30/80/55/1019308055.db2.gz VKFALJVRWIHKBN-HXUWFJFHSA-N 0 3 340.423 3.816 20 5 EHBDHN CCN(CC)[C@@H](CN[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000119109570 1019360423 /nfs/dbraw/zinc/36/04/23/1019360423.db2.gz BJBSHLLBVDYCGK-YOEHRIQHSA-N 0 3 331.416 3.922 20 5 EHBDHN Cc1nn(C(C)(C)C)c(C)c1CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000348676117 1021222987 /nfs/dbraw/zinc/22/29/87/1021222987.db2.gz ROLIVRXUSWOWPX-UHFFFAOYSA-N 0 3 344.459 3.838 20 5 EHBDHN C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000518562183 1021319887 /nfs/dbraw/zinc/31/98/87/1021319887.db2.gz BHSTZGIQJXBDNX-PCJQFBCGSA-N 0 3 344.436 3.670 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN[C@H]3CCOC4(CCCCC4)C3)nc2c1 ZINC000602569538 1032977958 /nfs/dbraw/zinc/97/79/58/1032977958.db2.gz SXMFKDWCVWNYFS-ZDUSSCGKSA-N 0 3 345.399 3.708 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCCc1nccs1 ZINC000602592371 1032991711 /nfs/dbraw/zinc/99/17/11/1032991711.db2.gz DJAVCLMTBPTEQF-UHFFFAOYSA-N 0 3 345.346 3.793 20 5 EHBDHN CCC(CC)CN(CC)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172895693 1033004504 /nfs/dbraw/zinc/00/45/04/1033004504.db2.gz ZARQDLAYEMHPCX-UHFFFAOYSA-N 0 3 331.420 3.569 20 5 EHBDHN O=[N+]([O-])c1sc(CNCC[C@H]2CC2(F)F)cc1Br ZINC000602714375 1033100032 /nfs/dbraw/zinc/10/00/32/1033100032.db2.gz HVIIPFDFIZDSAV-LURJTMIESA-N 0 3 341.177 3.554 20 5 EHBDHN C[C@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H](C)C1 ZINC000127388480 1023147796 /nfs/dbraw/zinc/14/77/96/1023147796.db2.gz ZFYSHGAABDHQLO-QWHCGFSZSA-N 0 3 330.388 3.513 20 5 EHBDHN C[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCCC[C@@H]12 ZINC000248417903 1023260828 /nfs/dbraw/zinc/26/08/28/1023260828.db2.gz JXUAFBHIIUQWAD-KCXAZCMYSA-N 0 3 342.399 3.655 20 5 EHBDHN Cc1c(CN2CCC3(CC2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000610738912 1023401549 /nfs/dbraw/zinc/40/15/49/1023401549.db2.gz ZPCFCYLPKZVIPG-UHFFFAOYSA-N 0 3 338.407 3.925 20 5 EHBDHN Cc1c([C@@H](C)N[C@@H](C)c2ccc3[nH]c(=O)[nH]c3c2)cccc1[N+](=O)[O-] ZINC000610818770 1023782858 /nfs/dbraw/zinc/78/28/58/1023782858.db2.gz ANXJIQKRIDBXGR-NWDGAFQWSA-N 0 3 340.383 3.897 20 5 EHBDHN CC[C@H](c1ccccc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000060876850 1033164184 /nfs/dbraw/zinc/16/41/84/1033164184.db2.gz RHDBXTSNFPZBNI-LJQANCHMSA-N 0 3 325.412 3.868 20 5 EHBDHN CCO[C@@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000610930480 1023877722 /nfs/dbraw/zinc/87/77/22/1023877722.db2.gz ROADPMCUZVXJHZ-CQSZACIVSA-N 0 3 330.384 3.856 20 5 EHBDHN CCS[C@H]1CCCC[C@@H]1NCc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000469780079 1024007034 /nfs/dbraw/zinc/00/70/34/1024007034.db2.gz MMRFSTUITBHBJC-BBRMVZONSA-N 0 3 342.436 3.896 20 5 EHBDHN Cc1cccc(NC2CCN([C@@H](C)c3ccncc3)CC2)c1[N+](=O)[O-] ZINC000425239293 1024496781 /nfs/dbraw/zinc/49/67/81/1024496781.db2.gz NSCOVPKNPXUDKD-HNNXBMFYSA-N 0 3 340.427 3.936 20 5 EHBDHN C[C@H](c1ccccc1)N1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957238 1024525302 /nfs/dbraw/zinc/52/53/02/1024525302.db2.gz ZMKBBUVSXQAOEL-IUODEOHRSA-N 0 3 346.818 3.891 20 5 EHBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000065532902 1024665099 /nfs/dbraw/zinc/66/50/99/1024665099.db2.gz BVPWMOUXGJTRJZ-GOSISDBHSA-N 0 3 330.359 3.950 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CC[C@H](c3ccc4cccnc4n3)C2)c1 ZINC000602883984 1033233346 /nfs/dbraw/zinc/23/33/46/1033233346.db2.gz AFVYLFHFBCOFBK-INIZCTEOSA-N 0 3 334.379 3.528 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN1CCC[C@H]1Cc1cccc(F)c1 ZINC000520785197 1024793638 /nfs/dbraw/zinc/79/36/38/1024793638.db2.gz BJMXUPVBGVEIJB-KRWDZBQOSA-N 0 3 344.386 3.820 20 5 EHBDHN CSC1(CNCc2nc3cc([N+](=O)[O-])ccc3o2)CCCCC1 ZINC000895812362 1024866066 /nfs/dbraw/zinc/86/60/66/1024866066.db2.gz OIMAFKKLKVBNPZ-UHFFFAOYSA-N 0 3 335.429 3.892 20 5 EHBDHN C[C@H](N[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000310435245 1027004726 /nfs/dbraw/zinc/00/47/26/1027004726.db2.gz OFOAGBQALWHMSP-AVGNSLFASA-N 0 3 337.420 3.547 20 5 EHBDHN CC[C@@H]1CCCC[C@H]1N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681886 1028151104 /nfs/dbraw/zinc/15/11/04/1028151104.db2.gz RULKDUNXTZRSIV-RHSMWYFYSA-N 0 3 333.432 3.742 20 5 EHBDHN CC[C@H]1CCCC[C@@H]1N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681888 1028151794 /nfs/dbraw/zinc/15/17/94/1028151794.db2.gz RULKDUNXTZRSIV-YOEHRIQHSA-N 0 3 333.432 3.742 20 5 EHBDHN CC(C)C[C@H]1OCCC[C@@H]1NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481756398 1029906046 /nfs/dbraw/zinc/90/60/46/1029906046.db2.gz NBDYRMSMXFYLAL-GOEBONIOSA-N 0 3 326.824 3.932 20 5 EHBDHN C[C@@H](CC(C)(C)O)N[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453325782 1030108544 /nfs/dbraw/zinc/10/85/44/1030108544.db2.gz RQJFXFMWAADXJG-KSSFIOAISA-N 0 3 328.412 3.823 20 5 EHBDHN CC(=O)Nc1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000531941471 1030108784 /nfs/dbraw/zinc/10/87/84/1030108784.db2.gz OPSREFARAYTPFC-ZDUSSCGKSA-N 0 3 327.384 3.712 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCc1ccc(F)c(F)c1 ZINC000526045653 1030367442 /nfs/dbraw/zinc/36/74/42/1030367442.db2.gz AXNYDCSVDTZXPA-UHFFFAOYSA-N 0 3 336.338 3.604 20 5 EHBDHN CN(C)C[C@@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776186 1030704365 /nfs/dbraw/zinc/70/43/65/1030704365.db2.gz TXLRGRAJRBHTFZ-LZCIBIBXSA-N 0 3 343.402 3.640 20 5 EHBDHN C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000594489936 1033394798 /nfs/dbraw/zinc/39/47/98/1033394798.db2.gz IDRAROJLZIBBQO-BLLLJJGKSA-N 0 3 340.379 3.704 20 5 EHBDHN COC(=O)c1ccc2c(c1)[C@H](NCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000594500734 1033401573 /nfs/dbraw/zinc/40/15/73/1033401573.db2.gz AUYBRKPVCFDWQP-GOSISDBHSA-N 0 3 340.379 3.549 20 5 EHBDHN CC1(C)OCC[C@H]1CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000594994080 1033623737 /nfs/dbraw/zinc/62/37/37/1033623737.db2.gz DWWAMJDYEGISJW-ZDUSSCGKSA-N 0 3 347.440 3.623 20 5 EHBDHN CC1(C)CCC[C@@](O)(CNCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000782534354 1033700101 /nfs/dbraw/zinc/70/01/01/1033700101.db2.gz AGWGSKCUUMRRKL-INIZCTEOSA-N 0 3 326.824 3.669 20 5 EHBDHN Cc1noc(CN2CCC[C@](C)(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595484684 1033809572 /nfs/dbraw/zinc/80/95/72/1033809572.db2.gz MVSZBDSABIJPGH-SFHVURJKSA-N 0 3 329.400 3.835 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCCC2(CO)CCC2)c2ccccc2)c1 ZINC000593719060 1033834955 /nfs/dbraw/zinc/83/49/55/1033834955.db2.gz UPQHFFXESWOYJL-LJQANCHMSA-N 0 3 340.423 3.827 20 5 EHBDHN C[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCC(F)CC1 ZINC000595819285 1033994227 /nfs/dbraw/zinc/99/42/27/1033994227.db2.gz NNZMFBZMRDLLKP-DCBWTQNWSA-N 0 3 348.378 3.651 20 5 EHBDHN CCOc1cc(CN2CCC[C@@H]([C@@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787960 1033999020 /nfs/dbraw/zinc/99/90/20/1033999020.db2.gz LAZXWPQISLFDEP-AEFFLSMTSA-N 0 3 348.443 3.775 20 5 EHBDHN C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000599625113 1034071583 /nfs/dbraw/zinc/07/15/83/1034071583.db2.gz FZZHRHYDQOAXFV-PUXPGTEJSA-N 0 3 332.322 3.515 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1NCC1CCN(Cc2ccncc2)CC1 ZINC000596441094 1034244580 /nfs/dbraw/zinc/24/45/80/1034244580.db2.gz NAGCOXCZNRWRFX-UHFFFAOYSA-N 0 3 340.427 3.622 20 5 EHBDHN C[C@H](NCC1(C)OCCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000179576487 1034505206 /nfs/dbraw/zinc/50/52/06/1034505206.db2.gz YJDPHEUASLOMKA-LBPRGKRZSA-N 0 3 348.424 3.737 20 5 EHBDHN CCC(=O)c1ccc(NC2CCN(C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC000450876003 1034901695 /nfs/dbraw/zinc/90/16/95/1034901695.db2.gz IMBSYIMOYSHDDI-UHFFFAOYSA-N 0 3 331.416 3.616 20 5 EHBDHN COc1ccc([C@@H](CN2CCCC2)Nc2ccc([N+](=O)[O-])s2)cc1 ZINC000612449919 1034946753 /nfs/dbraw/zinc/94/67/53/1034946753.db2.gz KDCKBWMICORTQN-OAHLLOKOSA-N 0 3 347.440 3.914 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1ccnc(OC(F)F)c1 ZINC000581503388 1035514470 /nfs/dbraw/zinc/51/44/70/1035514470.db2.gz HEBXGJWCJOXEKA-GHXNOFRVSA-N 0 3 349.337 3.784 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000164525878 1035652845 /nfs/dbraw/zinc/65/28/45/1035652845.db2.gz KHVVKDNCTPWAQD-UKRRQHHQSA-N 0 3 349.431 3.563 20 5 EHBDHN CC[C@@]1(CNCc2ccc([N+](=O)[O-])cc2F)OCCc2ccccc21 ZINC000589319282 1036358910 /nfs/dbraw/zinc/35/89/10/1036358910.db2.gz FOCYWCYYDGVRNS-IBGZPJMESA-N 0 3 344.386 3.702 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1ccc(NC(N)=O)cc1 ZINC000165434193 1036556702 /nfs/dbraw/zinc/55/67/02/1036556702.db2.gz PRTXGXBNCBKYFA-OLZOCXBDSA-N 0 3 342.399 3.806 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NC[C@H]2CCCC[C@@H]2O)c2ccccc2)c1 ZINC000180612823 1036996663 /nfs/dbraw/zinc/99/66/63/1036996663.db2.gz XMNBZJCSZPKVEB-YZGWKJHDSA-N 0 3 340.423 3.825 20 5 EHBDHN CC[C@H](O)CN(Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539850260 1037279918 /nfs/dbraw/zinc/27/99/18/1037279918.db2.gz LBHMWFDPMLXVSP-SFHVURJKSA-N 0 3 328.412 3.676 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](C)Oc1cccc(C)c1 ZINC000462730034 1037328376 /nfs/dbraw/zinc/32/83/76/1037328376.db2.gz FHFIESQXZSBNJT-HNNXBMFYSA-N 0 3 344.411 3.859 20 5 EHBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1C[C@H](OCC)C12CCCC2 ZINC000462756706 1037373330 /nfs/dbraw/zinc/37/33/30/1037373330.db2.gz OXUOOZRISIISOS-MSOLQXFVSA-N 0 3 348.443 3.821 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCNC(=O)CC1CCCCC1 ZINC000540186259 1037669205 /nfs/dbraw/zinc/66/92/05/1037669205.db2.gz PZECKFVFMDGLRQ-HNNXBMFYSA-N 0 3 347.459 3.640 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2noc(CN3CCCC[C@H]3C3CCC3)n2)c1 ZINC000592198798 1037943569 /nfs/dbraw/zinc/94/35/69/1037943569.db2.gz VNIWTCRFQSIQMN-INIZCTEOSA-N 0 3 342.399 3.799 20 5 EHBDHN Cc1cccc([C@@H](C)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000539290612 1038763125 /nfs/dbraw/zinc/76/31/25/1038763125.db2.gz ARCFYBURAKYVCX-HUUCEWRRSA-N 0 3 341.411 3.889 20 5 EHBDHN COc1cc(CNC2CC(c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000105492475 1040440271 /nfs/dbraw/zinc/44/02/71/1040440271.db2.gz KLKNCYJEOHXBKR-UHFFFAOYSA-N 0 3 342.395 3.648 20 5 EHBDHN O=[N+]([O-])c1cc(CNC/C=C\c2ccncc2)cc(C(F)(F)F)c1 ZINC000487182177 1040771383 /nfs/dbraw/zinc/77/13/83/1040771383.db2.gz ANSBIAUKUYWCLP-UPHRSURJSA-N 0 3 337.301 3.812 20 5 EHBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@H]1CCCC[C@@H]1n1cccn1 ZINC000128573561 1041153114 /nfs/dbraw/zinc/15/31/14/1041153114.db2.gz JNDSVNAWVBTNFR-GJZGRUSLSA-N 0 3 334.807 3.718 20 5 EHBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1cccc(Cn2ccnc2)c1 ZINC000570986056 1041158057 /nfs/dbraw/zinc/15/80/57/1041158057.db2.gz ZHXFJEFEDQBOHG-IBGZPJMESA-N 0 3 348.406 3.617 20 5 EHBDHN CC(=O)c1ccc(N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000511710999 1041473710 /nfs/dbraw/zinc/47/37/10/1041473710.db2.gz CHYNDCFCJONRGN-MGPQQGTHSA-N 0 3 333.432 3.576 20 5 EHBDHN COCc1ccccc1/C=C(\C)CNCc1ccc([N+](=O)[O-])cc1 ZINC000512050875 1043043965 /nfs/dbraw/zinc/04/39/65/1043043965.db2.gz FGBMPQNCMKFKQD-RVDMUPIBSA-N 0 3 326.396 3.934 20 5 EHBDHN CC(C)(C)[C@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000344213846 1043440887 /nfs/dbraw/zinc/44/08/87/1043440887.db2.gz NZXDTOSLAFSCEE-ZDUSSCGKSA-N 0 3 330.388 3.513 20 5 EHBDHN CN(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1Cc2ccccc2C1 ZINC000728899382 1043707772 /nfs/dbraw/zinc/70/77/72/1043707772.db2.gz SWIRQQJZUQKMOA-UHFFFAOYSA-N 0 3 348.406 3.515 20 5 EHBDHN Cc1ccnc(NC[C@H]2CCCN(C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000301415282 1127743074 /nfs/dbraw/zinc/74/30/74/1127743074.db2.gz LUXLRCNWWDHECX-CZUORRHYSA-N 0 3 346.456 3.855 20 5 EHBDHN Cc1cc(NC[C@@H](c2ccc(Cl)cc2)N(C)C)ncc1[N+](=O)[O-] ZINC000301470378 1128468113 /nfs/dbraw/zinc/46/81/13/1128468113.db2.gz IUNCBBYXONFTSU-HNNXBMFYSA-N 0 3 334.807 3.666 20 5 EHBDHN CC(C)[C@H](CO)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000554089110 1128613251 /nfs/dbraw/zinc/61/32/51/1128613251.db2.gz RNOIWMDGILABPR-HKUYNNGSSA-N 0 3 328.412 3.538 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCSc3c(F)cccc32)cc1 ZINC000765849490 1128570056 /nfs/dbraw/zinc/57/00/56/1128570056.db2.gz QLYHEOVJSSFVTD-HOTGVXAUSA-N 0 3 348.399 3.594 20 5 EHBDHN CCOc1cc(NC[C@H]2CCN2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000715698833 1128729971 /nfs/dbraw/zinc/72/99/71/1128729971.db2.gz UXRHJYUBBJYQNO-QGZVFWFLSA-N 0 3 341.411 3.680 20 5 EHBDHN CN(C(=O)c1cc2ccccc2c2cccnc12)[C@H]1CCCN(C)C1 ZINC000172659536 1128774993 /nfs/dbraw/zinc/77/49/93/1128774993.db2.gz YBEUWLSSRCQSOP-INIZCTEOSA-N 0 3 333.435 3.554 20 5 EHBDHN CCCC[C@H](COC)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494508911 1120583656 /nfs/dbraw/zinc/58/36/56/1120583656.db2.gz CKKGKPHEIQMHTL-CYBMUJFWSA-N 0 3 334.338 3.908 20 5 EHBDHN CC1(C)CC[C@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)O1 ZINC000495167820 1120976184 /nfs/dbraw/zinc/97/61/84/1120976184.db2.gz NTSGOUBOIUAGIW-MRXNPFEDSA-N 0 3 330.384 3.902 20 5 EHBDHN COCCCCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113330980 1129001409 /nfs/dbraw/zinc/00/14/09/1129001409.db2.gz YEDCVSBYTKHNSO-UHFFFAOYSA-N 0 3 335.429 3.625 20 5 EHBDHN CC[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000194014080 1121752148 /nfs/dbraw/zinc/75/21/48/1121752148.db2.gz FYTVYQZDXQHHIN-OAHLLOKOSA-N 0 3 327.384 3.583 20 5 EHBDHN CC(=O)c1ccc(NCC(C)(C)N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000301196421 1122456940 /nfs/dbraw/zinc/45/69/40/1122456940.db2.gz UJRMMZNPQIPSAW-CYBMUJFWSA-N 0 3 333.432 3.720 20 5 EHBDHN COCCOc1cccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000163007986 1125022296 /nfs/dbraw/zinc/02/22/96/1125022296.db2.gz DTCWBNVWFBVBQQ-HNNXBMFYSA-N 0 3 344.411 3.779 20 5 EHBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)CC1CCCC1 ZINC000069227692 1129433725 /nfs/dbraw/zinc/43/37/25/1129433725.db2.gz FDZYFZNTDBLJDT-LBPRGKRZSA-N 0 3 330.388 3.828 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@H]2C[C@H](O)c2cccs2)c1 ZINC000304785581 1129902164 /nfs/dbraw/zinc/90/21/64/1129902164.db2.gz OKOPZWXTGXKPDX-HOCLYGCPSA-N 0 3 332.425 3.744 20 5 EHBDHN CCCC(=O)NC[C@@H]1CCCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245538850 1130232939 /nfs/dbraw/zinc/23/29/39/1130232939.db2.gz ZFPVKUUNPBDOFW-CVEARBPZSA-N 0 3 347.459 3.593 20 5 EHBDHN CCCN(Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000740881780 1131553004 /nfs/dbraw/zinc/55/30/04/1131553004.db2.gz CWSQXBYFLXWXKI-UAGQMJEPSA-N 0 3 336.407 3.759 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@@H](NCc1nc3ccccc3o1)CC2 ZINC001172895688 1131901203 /nfs/dbraw/zinc/90/12/03/1131901203.db2.gz HLIRZFVUMWDJAC-HNNXBMFYSA-N 0 3 337.379 3.773 20 5 EHBDHN COc1c(F)ccc(CN[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1F ZINC001173217099 1132002040 /nfs/dbraw/zinc/00/20/40/1132002040.db2.gz LMVWJHNWMXQMPP-LLVKDONJSA-N 0 3 336.338 3.602 20 5 EHBDHN CCC[C@H](C)[C@@H]1CCCN1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765171 1133050188 /nfs/dbraw/zinc/05/01/88/1133050188.db2.gz KHOHLPBIUORPEB-HOCLYGCPSA-N 0 3 343.431 3.711 20 5 EHBDHN COc1ccc(CNCCc2ccc(Cl)cc2[N+](=O)[O-])c(F)c1 ZINC001178326844 1133160048 /nfs/dbraw/zinc/16/00/48/1133160048.db2.gz RGIKCHHJIOFYKH-UHFFFAOYSA-N 0 3 338.766 3.728 20 5 EHBDHN O=C(OCc1csc([N+](=O)[O-])c1)c1cccc(CN2CCCC2)c1 ZINC000785715782 1133746546 /nfs/dbraw/zinc/74/65/46/1133746546.db2.gz SPSBLIKBZYHYET-UHFFFAOYSA-N 0 3 346.408 3.609 20 5 EHBDHN CC[C@@H](Cc1ccccc1)N(C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774908571 1134116195 /nfs/dbraw/zinc/11/61/95/1134116195.db2.gz MEMMKLBYYVSNCK-INIZCTEOSA-N 0 3 343.383 3.956 20 5 EHBDHN COc1ccccc1C[C@H]1CCCN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788476062 1134129740 /nfs/dbraw/zinc/12/97/40/1134129740.db2.gz MULKWSVVIPFKMT-MRXNPFEDSA-N 0 3 344.386 3.950 20 5 EHBDHN COC[C@H](Cc1ccccc1)N(C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789455106 1134276968 /nfs/dbraw/zinc/27/69/68/1134276968.db2.gz IGJUKDHAXRUGEA-INIZCTEOSA-N 0 3 348.830 3.938 20 5 EHBDHN CC(C)C[C@@]1(CO)CCCN1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000789513474 1134289439 /nfs/dbraw/zinc/28/94/39/1134289439.db2.gz JZJGWRUGQURPFT-MRXNPFEDSA-N 0 3 326.824 3.621 20 5 EHBDHN CC(C)C[C@]1(CO)CCCN1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000789593102 1134302944 /nfs/dbraw/zinc/30/29/44/1134302944.db2.gz LYNGSLVEDKMEBX-INIZCTEOSA-N 0 3 326.824 3.621 20 5 EHBDHN CCC1CCC(N(CC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC001190399998 1134691769 /nfs/dbraw/zinc/69/17/69/1134691769.db2.gz TVNOEYTZTMXLMI-UHFFFAOYSA-N 0 3 345.443 3.967 20 5 EHBDHN COc1ccc(C[C@@H](C)N(C)Cc2ccccc2OC)c([N+](=O)[O-])c1 ZINC001170341444 1134758400 /nfs/dbraw/zinc/75/84/00/1134758400.db2.gz IXJKRIIOJRTVGU-CQSZACIVSA-N 0 3 344.411 3.675 20 5 EHBDHN CC[C@H]1Cc2ccccc2CN1CCOc1ccccc1[N+](=O)[O-] ZINC001193119684 1135104189 /nfs/dbraw/zinc/10/41/89/1135104189.db2.gz YZXXWWCYLAWKQK-KRWDZBQOSA-N 0 3 326.396 3.811 20 5 EHBDHN CC[C@H](CO)N(Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC001197114126 1135651528 /nfs/dbraw/zinc/65/15/28/1135651528.db2.gz FBRUKQFIZXNOIQ-GOSISDBHSA-N 0 3 328.412 3.676 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CNC[C@]2(CO)C[C@@H]2c2ccccc2)c1 ZINC000810165503 1135929627 /nfs/dbraw/zinc/92/96/27/1135929627.db2.gz URSKPJDDCSLDJD-AEFFLSMTSA-N 0 3 346.814 3.504 20 5 EHBDHN CN1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1c1ccccc1 ZINC000776254063 1136103955 /nfs/dbraw/zinc/10/39/55/1136103955.db2.gz QYEVCQLEMUGIGX-MSOLQXFVSA-N 0 3 345.830 3.783 20 5 EHBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)c1 ZINC000850409481 1136252228 /nfs/dbraw/zinc/25/22/28/1136252228.db2.gz VSTOMTRHXYCQSA-HYVNUMGLSA-N 0 3 332.762 3.815 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@]1(C)CC1(Cl)Cl ZINC000850472521 1136265666 /nfs/dbraw/zinc/26/56/66/1136265666.db2.gz JCLSFXVHPCWKSN-TVQRCGJNSA-N 0 3 333.215 3.838 20 5 EHBDHN CC(COC(=O)c1ccc(SCc2ccccc2)cc1)[N+](=O)[O-] ZINC000813103521 1136288119 /nfs/dbraw/zinc/28/81/19/1136288119.db2.gz CSLINWIHKGRIDZ-ZDUSSCGKSA-N 0 3 331.393 3.801 20 5 EHBDHN CC(C)[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000852446115 1136456579 /nfs/dbraw/zinc/45/65/79/1136456579.db2.gz DJTQCZWZZCYTOG-QZTJIDSGSA-N 0 3 332.375 3.754 20 5 EHBDHN O=[N+]([O-])c1ccc([C@H](O)CN(Cc2ccccc2F)CC2CC2)cc1 ZINC000852564661 1136467024 /nfs/dbraw/zinc/46/70/24/1136467024.db2.gz QKYAILTVSXPKSQ-LJQANCHMSA-N 0 3 344.386 3.680 20 5 EHBDHN C[C@@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc2c(c1)CCCO2 ZINC000853240420 1136521588 /nfs/dbraw/zinc/52/15/88/1136521588.db2.gz GZWASNNHGHUPCA-OLZOCXBDSA-N 0 3 341.411 3.914 20 5 EHBDHN C[C@@H](NCc1ccc(-c2cnn(C)c2)s1)c1cccc([N+](=O)[O-])c1 ZINC000509476909 1136625545 /nfs/dbraw/zinc/62/55/45/1136625545.db2.gz QKSSWMJEPNPKMX-GFCCVEGCSA-N 0 3 342.424 3.908 20 5 EHBDHN CN(Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@](C)(O)c1ccccc1 ZINC000822516309 1137064231 /nfs/dbraw/zinc/06/42/31/1137064231.db2.gz KGRXZPJUEDXXFO-KRWDZBQOSA-N 0 3 334.803 3.588 20 5 EHBDHN CC([C@H](OC(=O)c1coc(C(F)F)c1)c1ccccc1F)[N+](=O)[O-] ZINC000860854650 1137081245 /nfs/dbraw/zinc/08/12/45/1137081245.db2.gz FMSREQZVMVLMGU-SDBXPKJASA-N 0 3 343.257 3.920 20 5 EHBDHN COC(C)(C)CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000865756171 1137308738 /nfs/dbraw/zinc/30/87/38/1137308738.db2.gz YSCSZJXXIJYTPS-UHFFFAOYSA-N 0 3 335.429 3.623 20 5 EHBDHN CC([C@@H](OC(=O)C=C1CCSCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878772 1137316498 /nfs/dbraw/zinc/31/64/98/1137316498.db2.gz SRLHYSXXHNQDQO-BDJLRTHQSA-N 0 3 339.388 3.529 20 5 EHBDHN Cc1oc(C2CC2)nc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845883769 1137316966 /nfs/dbraw/zinc/31/69/66/1137316966.db2.gz VXEFJGPQQUKXHM-PSLIRLAXSA-N 0 3 348.330 3.563 20 5 EHBDHN CC(C)c1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])nc1 ZINC000845882683 1137317009 /nfs/dbraw/zinc/31/70/09/1137317009.db2.gz PQUUESMGLVHRMR-YVEFUNNKSA-N 0 3 346.358 3.907 20 5 EHBDHN CC([C@@H](OC(=O)C[C@@H]1CCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845882187 1137317061 /nfs/dbraw/zinc/31/70/61/1137317061.db2.gz NWGRLZFAAXCCQI-JRPNMDOOSA-N 0 3 345.317 3.901 20 5 EHBDHN CC([C@H](OC(=O)[C@H](C)CC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845883762 1137317086 /nfs/dbraw/zinc/31/70/86/1137317086.db2.gz VUFKYQPCMOTCJO-LNLATYFQSA-N 0 3 337.269 3.664 20 5 EHBDHN Cc1oc(C2CC2)nc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845883770 1137317182 /nfs/dbraw/zinc/31/71/82/1137317182.db2.gz VXEFJGPQQUKXHM-RFAUZJTJSA-N 0 3 348.330 3.563 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](c1ccco1)N(C)C ZINC000872018795 1137564858 /nfs/dbraw/zinc/56/48/58/1137564858.db2.gz PPHUCPMLPOTHPX-WFASDCNBSA-N 0 3 349.456 3.863 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCCc2cn[nH]c21 ZINC000872047682 1137567612 /nfs/dbraw/zinc/56/76/12/1137567612.db2.gz COJRLOYNOCUDQC-HZMBPMFUSA-N 0 3 332.429 3.768 20 5 EHBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCCC(F)(F)[C@H]1O ZINC000872080357 1137570172 /nfs/dbraw/zinc/57/01/72/1137570172.db2.gz PVTNVBWNTJZXOM-IUPBHXKESA-N 0 3 346.399 3.516 20 5 EHBDHN C[C@]1(CCNCc2nc3cc([N+](=O)[O-])ccc3o2)C[C@]1(F)Cl ZINC000877610954 1137682898 /nfs/dbraw/zinc/68/28/98/1137682898.db2.gz MRZOESBOUUGAMA-UONOGXRCSA-N 0 3 327.743 3.530 20 5 EHBDHN CC(C)N(Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCC1 ZINC000878232861 1137708159 /nfs/dbraw/zinc/70/81/59/1137708159.db2.gz CLFGVPRRBFBBMW-UHFFFAOYSA-N 0 3 330.388 3.798 20 5 EHBDHN CC[C@@H]1CCCC[C@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447455 1137716441 /nfs/dbraw/zinc/71/64/41/1137716441.db2.gz MUGSELXQRQAVPK-TZMCWYRMSA-N 0 3 330.388 3.703 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1nnc(CN2CCCCCCCC2)o1 ZINC000878682245 1137724738 /nfs/dbraw/zinc/72/47/38/1137724738.db2.gz LSGRTOPXCNIXFQ-UHFFFAOYSA-N 0 3 330.388 3.801 20 5 EHBDHN CC[C@H](C)N(CC)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878885154 1137730898 /nfs/dbraw/zinc/73/08/98/1137730898.db2.gz XYEURDQGVFLDIU-JTQLQIEISA-N 0 3 338.795 3.919 20 5 EHBDHN O=[N+]([O-])c1cc(Br)ccc1CNC1CC(CF)(CF)C1 ZINC000883295502 1137853507 /nfs/dbraw/zinc/85/35/07/1137853507.db2.gz KOVPOCQSDACFLH-UHFFFAOYSA-N 0 3 349.175 3.535 20 5 EHBDHN COCC[C@@H]1CCCCN(Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000332367252 1137941723 /nfs/dbraw/zinc/94/17/23/1137941723.db2.gz WCKCRHAAJZOUCW-ZDUSSCGKSA-N 0 3 326.824 3.887 20 5 EHBDHN CC[C@H](NC[C@@H](O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000124765954 1138294348 /nfs/dbraw/zinc/29/43/48/1138294348.db2.gz MJVFNPVQPBLENV-DLBZAZTESA-N 0 3 336.338 3.647 20 5 EHBDHN Cc1noc([C@H]2CCCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000182685685 1139986216 /nfs/dbraw/zinc/98/62/16/1139986216.db2.gz RLFWDKNBSQVDCM-JSGCOSHPSA-N 0 3 330.388 3.535 20 5 EHBDHN Cc1c(CN2CCC[C@H]2C[C@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000268309596 1140918871 /nfs/dbraw/zinc/91/88/71/1140918871.db2.gz XAKOPLIAXABHPX-RDJZCZTQSA-N 0 3 330.384 3.584 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCCc4cn[nH]c43)o2)cc1 ZINC000268883846 1141017336 /nfs/dbraw/zinc/01/73/36/1141017336.db2.gz YMBNAKKVYCNFFY-INIZCTEOSA-N 0 3 338.367 3.745 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCCCC[C@H]2c2ccco2)c1 ZINC000269633872 1141129769 /nfs/dbraw/zinc/12/97/69/1141129769.db2.gz GNBCBKDESGSINQ-IRXDYDNUSA-N 0 3 330.384 3.839 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C1CC1)C1CCCCC1 ZINC000048008822 1014314740 /nfs/dbraw/zinc/31/47/40/1014314740.db2.gz RZEREEBLASYJOC-UHFFFAOYSA-N 0 3 331.416 3.639 20 5 EHBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000359872826 1015883159 /nfs/dbraw/zinc/88/31/59/1015883159.db2.gz PRWIPTCMUMLVSI-PKOBYXMFSA-N 0 3 326.396 3.771 20 5 EHBDHN CC[C@@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H](O)C(C)C ZINC000414536824 1016963383 /nfs/dbraw/zinc/96/33/83/1016963383.db2.gz YHLZVAIECMNOHV-HZPDHXFCSA-N 0 3 349.456 3.603 20 5 EHBDHN C[C@@H]1CCN(c2ccsc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000610284382 1017657063 /nfs/dbraw/zinc/65/70/63/1017657063.db2.gz QGTQGPAUBOPQOQ-CQSZACIVSA-N 0 3 331.441 3.757 20 5 EHBDHN CCCN(CCC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000058723444 1032869240 /nfs/dbraw/zinc/86/92/40/1032869240.db2.gz YIKOYDPZILUOLF-UHFFFAOYSA-N 0 3 332.347 3.827 20 5 EHBDHN COc1cc(CN[C@H]2C[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000280615262 1020526227 /nfs/dbraw/zinc/52/62/27/1020526227.db2.gz KLKNCYJEOHXBKR-KOMQPUFPSA-N 0 3 342.395 3.648 20 5 EHBDHN C[C@H](NCCc1cccc([N+](=O)[O-])c1)c1nc2c(s1)CCCC2 ZINC000090909890 1021691409 /nfs/dbraw/zinc/69/14/09/1021691409.db2.gz SZIHIUOGQUYUAW-LBPRGKRZSA-N 0 3 331.441 3.823 20 5 EHBDHN CC[C@@H](CSC)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602580039 1032997840 /nfs/dbraw/zinc/99/78/40/1032997840.db2.gz CDRFCEKJRYCXIR-ZETCQYMHSA-N 0 3 339.280 3.650 20 5 EHBDHN C[C@@H](NC[C@H](c1c(F)cccc1F)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000120777473 1022148674 /nfs/dbraw/zinc/14/86/74/1022148674.db2.gz WGQQNTBSFAUFHA-SJKOYZFVSA-N 0 3 349.381 3.827 20 5 EHBDHN Cc1nccn1CCCCNc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000302153486 1022434437 /nfs/dbraw/zinc/43/44/37/1022434437.db2.gz IHVWHEVBNYPZAN-UHFFFAOYSA-N 0 3 339.399 3.849 20 5 EHBDHN COc1cccc([C@H]2CCCN2CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000058932543 1033086923 /nfs/dbraw/zinc/08/69/23/1033086923.db2.gz FDHXMDMTPRCGKJ-LJQANCHMSA-N 0 3 342.395 3.819 20 5 EHBDHN Cc1c(CN(CCCO)[C@@H]2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510686557 1022886268 /nfs/dbraw/zinc/88/62/68/1022886268.db2.gz QCWRQZGESOCVRQ-HXUWFJFHSA-N 0 3 340.423 3.775 20 5 EHBDHN C[C@]1(CNCc2cc(Br)c([N+](=O)[O-])s2)CC1(F)F ZINC000602712512 1033097347 /nfs/dbraw/zinc/09/73/47/1033097347.db2.gz YXGDMDAANYDXSI-SECBINFHSA-N 0 3 341.177 3.554 20 5 EHBDHN Cc1ccncc1CCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602709938 1033098052 /nfs/dbraw/zinc/09/80/52/1033098052.db2.gz KYTOZIBWXAGAHG-UHFFFAOYSA-N 0 3 339.317 3.649 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)CCO2 ZINC000507123284 1023141246 /nfs/dbraw/zinc/14/12/46/1023141246.db2.gz YMSOURFKRCQDLE-UHFFFAOYSA-N 0 3 326.396 3.940 20 5 EHBDHN O=[N+]([O-])c1ccc(CN(Cc2ccc(F)cc2)C2CCOCC2)cc1 ZINC000277024192 1023707205 /nfs/dbraw/zinc/70/72/05/1023707205.db2.gz LVLBBGPYKRLGQQ-UHFFFAOYSA-N 0 3 344.386 3.915 20 5 EHBDHN C[C@H]1CC2(CC(NCc3cc(Cl)cc(Cl)c3[N+](=O)[O-])C2)CO1 ZINC000897775358 1033163385 /nfs/dbraw/zinc/16/33/85/1033163385.db2.gz CFUPZDAHHRCIFZ-AAYUTKSQSA-N 0 3 345.226 3.949 20 5 EHBDHN CCO[C@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000610930448 1023878164 /nfs/dbraw/zinc/87/81/64/1023878164.db2.gz HRVWIZYAIPLIKF-INIZCTEOSA-N 0 3 330.384 3.856 20 5 EHBDHN Cc1ccc(Sc2ccc(CN[C@@H](C)CO)cc2[N+](=O)[O-])cc1 ZINC000121209769 1024275355 /nfs/dbraw/zinc/27/53/55/1024275355.db2.gz NLZVMKFOGVUPKV-ZDUSSCGKSA-N 0 3 332.425 3.525 20 5 EHBDHN CC(=O)c1cc(NC[C@H](C)N(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000342232315 1024498231 /nfs/dbraw/zinc/49/82/31/1024498231.db2.gz YCYNPBUTAGAKOU-AWEZNQCLSA-N 0 3 341.411 3.730 20 5 EHBDHN CCOC(=O)C[C@@H](C)N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000346319060 1024619383 /nfs/dbraw/zinc/61/93/83/1024619383.db2.gz DGJNAZASLOLAEC-CYBMUJFWSA-N 0 3 346.383 3.628 20 5 EHBDHN CCOC(=O)C[C@H](C)N(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346343884 1024666655 /nfs/dbraw/zinc/66/66/55/1024666655.db2.gz WDPPMVPAQJPMLM-ZDUSSCGKSA-N 0 3 346.383 3.628 20 5 EHBDHN COCCN(C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000505636406 1024713212 /nfs/dbraw/zinc/71/32/12/1024713212.db2.gz KQYHNEMBSYYBCF-YRNVUSSQSA-N 0 3 326.396 3.757 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000895844049 1024891887 /nfs/dbraw/zinc/89/18/87/1024891887.db2.gz LOBOKPPTPOVYLV-DOMZBBRYSA-N 0 3 344.333 3.615 20 5 EHBDHN Cc1c([C@H](C)NCc2ccccc2-n2cccn2)cccc1[N+](=O)[O-] ZINC000119648537 1025125617 /nfs/dbraw/zinc/12/56/17/1025125617.db2.gz LQTLSJLBKBSOCA-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN C[C@@H](c1ccccc1)[C@H](O)CNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000451057559 1025481407 /nfs/dbraw/zinc/48/14/07/1025481407.db2.gz UBQJIRRJWXGPFN-KBXCAEBGSA-N 0 3 328.412 3.584 20 5 EHBDHN COc1cc(C[NH2+]C[C@]2(C)C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1[O-] ZINC000339446276 1026565305 /nfs/dbraw/zinc/56/53/05/1026565305.db2.gz SOUWWHOEGVXOIB-KXBFYZLASA-N 0 3 342.395 3.592 20 5 EHBDHN O=[N+]([O-])c1cccc(CN(CCCO)[C@@H]2CCCc3ccccc32)c1 ZINC000531164427 1026638494 /nfs/dbraw/zinc/63/84/94/1026638494.db2.gz NZMKIVXXADUGGY-HXUWFJFHSA-N 0 3 340.423 3.857 20 5 EHBDHN CCC(=O)c1ccc(NC2CC(N3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000366521811 1027326713 /nfs/dbraw/zinc/32/67/13/1027326713.db2.gz BPMVKKYXKPSGJL-UHFFFAOYSA-N 0 3 331.416 3.616 20 5 EHBDHN O=[N+]([O-])c1ccccc1OCCN[C@H](CC(F)F)c1ccccc1 ZINC000420998108 1027976946 /nfs/dbraw/zinc/97/69/46/1027976946.db2.gz SXQDNABGEMLTDY-CQSZACIVSA-N 0 3 336.338 3.960 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCC(COc3ccccc3)CC2)cc1 ZINC000065612768 1028108874 /nfs/dbraw/zinc/10/88/74/1028108874.db2.gz YCMDBRGEUIZVGB-UHFFFAOYSA-N 0 3 326.396 3.886 20 5 EHBDHN C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])s2)CCN1Cc1ccccc1 ZINC000192480582 1029684671 /nfs/dbraw/zinc/68/46/71/1029684671.db2.gz HDPGSRLYTSFHNX-JSGCOSHPSA-N 0 3 332.429 3.516 20 5 EHBDHN CCOC(=O)[C@@]1(C(C)C)CCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000446890944 1029842568 /nfs/dbraw/zinc/84/25/68/1029842568.db2.gz RKEAYSJBNSWOIL-XSBJJCPUSA-N 0 3 346.427 3.519 20 5 EHBDHN O=[N+]([O-])c1ccccc1CN(CCc1ccc2c(c1)CCO2)C1CC1 ZINC000441248425 1030154775 /nfs/dbraw/zinc/15/47/75/1030154775.db2.gz AISPZZBLFROJPN-UHFFFAOYSA-N 0 3 338.407 3.737 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC3(CC2)OCCc2ccccc23)c1 ZINC000453570662 1030340435 /nfs/dbraw/zinc/34/04/35/1030340435.db2.gz DFLGXRGLUQHUNK-UHFFFAOYSA-N 0 3 338.407 3.659 20 5 EHBDHN Cc1c([C@@H](C)NCCOc2ccc([N+](=O)[O-])cc2)cnn1C(C)(C)C ZINC000526050468 1030372983 /nfs/dbraw/zinc/37/29/83/1030372983.db2.gz RARVCDLGMOQAJY-CYBMUJFWSA-N 0 3 346.431 3.584 20 5 EHBDHN COc1ccc(-c2ccc(CNC[C@@H]3CC[C@H](C)O3)o2)c([N+](=O)[O-])c1 ZINC000453631583 1030432583 /nfs/dbraw/zinc/43/25/83/1030432583.db2.gz OAMWBRBKAKUCFQ-JSGCOSHPSA-N 0 3 346.383 3.521 20 5 EHBDHN COc1ccc(CN2CCCC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000127932159 1031137858 /nfs/dbraw/zinc/13/78/58/1031137858.db2.gz RXYJMOFCMREMJL-UHFFFAOYSA-N 0 3 342.395 3.778 20 5 EHBDHN CCO[C@@H]1C[C@@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)C12CCC2 ZINC000595027127 1033648285 /nfs/dbraw/zinc/64/82/85/1033648285.db2.gz PZEJMXUMYVIQNR-JCURWCKSSA-N 0 3 334.416 3.602 20 5 EHBDHN CCOc1ccc([C@@H](C)NCc2ccc([C@@H](C)O)cc2)cc1[N+](=O)[O-] ZINC000179406792 1034279378 /nfs/dbraw/zinc/27/93/78/1034279378.db2.gz LUEIYBIKKWIFHM-ZIAGYGMSSA-N 0 3 344.411 3.898 20 5 EHBDHN O=[N+]([O-])c1cccc([C@@H](NCCCn2cccn2)c2ccccc2)c1 ZINC000180053439 1035300126 /nfs/dbraw/zinc/30/01/26/1035300126.db2.gz IPHHFAPVTKPNPV-IBGZPJMESA-N 0 3 336.395 3.561 20 5 EHBDHN O=[N+]([O-])c1ccc(NC2CCN(CCc3ccccc3)CC2)s1 ZINC000066410768 1035448016 /nfs/dbraw/zinc/44/80/16/1035448016.db2.gz HSTVGTQJYSGYJO-UHFFFAOYSA-N 0 3 331.441 3.775 20 5 EHBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCCN(c2ccccc2)CC1 ZINC000511460749 1035473047 /nfs/dbraw/zinc/47/30/47/1035473047.db2.gz MUDQTTOAUDYIRC-RMKNXTFCSA-N 0 3 337.423 3.820 20 5 EHBDHN CC(C)CC[C@H](O)CNCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000572632485 1036457896 /nfs/dbraw/zinc/45/78/96/1036457896.db2.gz HBRCAMYDLGJHNQ-AWEZNQCLSA-N 0 3 334.338 3.500 20 5 EHBDHN CC(C)[C@](C)(O)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180528183 1036918944 /nfs/dbraw/zinc/91/89/44/1036918944.db2.gz KDLNFJOAUYJPJO-RBUKOAKNSA-N 0 3 328.412 3.681 20 5 EHBDHN CC(C)C[C@H]1CCCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000130247309 1037219869 /nfs/dbraw/zinc/21/98/69/1037219869.db2.gz HSUGGOVKZYAFTP-CQSZACIVSA-N 0 3 330.388 3.655 20 5 EHBDHN Cc1ccc(Sc2ccc(CN(C)C[C@@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000462830259 1037433547 /nfs/dbraw/zinc/43/35/47/1037433547.db2.gz BMBLDALHLYUYJE-CQSZACIVSA-N 0 3 346.452 3.867 20 5 EHBDHN O=[N+]([O-])c1cccc(CN[C@H](c2ccccc2)C2(CO)CC=CC2)c1 ZINC000592175283 1037916722 /nfs/dbraw/zinc/91/67/22/1037916722.db2.gz JSJQRTIGKRVTGE-LJQANCHMSA-N 0 3 338.407 3.754 20 5 EHBDHN CC[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCCO1 ZINC000467553709 1038365631 /nfs/dbraw/zinc/36/56/31/1038365631.db2.gz KHEJSCKKFSNPGU-MRXNPFEDSA-N 0 3 330.384 3.856 20 5 EHBDHN COc1ccc(CNC[C@H]2CCC3(CCCCC3)O2)cc1[N+](=O)[O-] ZINC000480444408 1039564027 /nfs/dbraw/zinc/56/40/27/1039564027.db2.gz MCCFVGXAARMQOL-OAHLLOKOSA-N 0 3 334.416 3.575 20 5 EHBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2[nH]c(=O)[nH]c2c1 ZINC000893946298 1039869893 /nfs/dbraw/zinc/86/98/93/1039869893.db2.gz WISQTLCGCRTYSH-UHFFFAOYSA-N 0 3 340.383 3.587 20 5 EHBDHN COc1cc(CN2CC[C@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000490031074 1040298674 /nfs/dbraw/zinc/29/86/74/1040298674.db2.gz NKLOBAOYFVQVLA-HNNXBMFYSA-N 0 3 330.359 3.732 20 5 EHBDHN COC(=O)c1cc([C@@H](C)N(C)CCc2cccc([N+](=O)[O-])c2)oc1C ZINC000433202496 1041054240 /nfs/dbraw/zinc/05/42/40/1041054240.db2.gz RBTQPBKBJYBRJY-GFCCVEGCSA-N 0 3 346.383 3.518 20 5 EHBDHN CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCCOC1 ZINC000571448074 1041294947 /nfs/dbraw/zinc/29/49/47/1041294947.db2.gz QHPWVFHGWZYTHI-CYBMUJFWSA-N 0 3 332.425 3.934 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1F ZINC000291235464 1042789073 /nfs/dbraw/zinc/78/90/73/1042789073.db2.gz UMBLVXLIQURAOC-QGPMSJSTSA-N 0 3 336.407 3.640 20 5 EHBDHN Cc1cccc([C@H](C)NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000183725346 1125747506 /nfs/dbraw/zinc/74/75/06/1125747506.db2.gz TUPXOORHSIBRGD-HNNXBMFYSA-N 0 3 341.411 3.525 20 5 EHBDHN Cc1cc(CCN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)on1 ZINC000552099696 1127578246 /nfs/dbraw/zinc/57/82/46/1127578246.db2.gz QOORYYCOJBPGTJ-LJQANCHMSA-N 0 3 337.379 3.813 20 5 EHBDHN COCCC[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000282156301 1127892407 /nfs/dbraw/zinc/89/24/07/1127892407.db2.gz DCXUEZYZURNWSP-GOSISDBHSA-N 0 3 332.375 3.991 20 5 EHBDHN COc1cccc([C@@H](CNc2cc(C)ccc2[N+](=O)[O-])N(C)C)c1 ZINC000301586501 1128500560 /nfs/dbraw/zinc/50/05/60/1128500560.db2.gz VSNUGEPOUQCGCV-GOSISDBHSA-N 0 3 329.400 3.627 20 5 EHBDHN COCCN(Cc1cc([N+](=O)[O-])ccc1OC(C)C)C1CCCC1 ZINC000609193899 1120543076 /nfs/dbraw/zinc/54/30/76/1120543076.db2.gz AHNJTCXCJMAHRV-UHFFFAOYSA-N 0 3 336.432 3.773 20 5 EHBDHN Cc1nn(CN(CCc2ccccc2)CC(C)C)c(C)c1[N+](=O)[O-] ZINC000921056182 1123459631 /nfs/dbraw/zinc/45/96/31/1123459631.db2.gz CAEMYKHLYQAKEU-UHFFFAOYSA-N 0 3 330.432 3.566 20 5 EHBDHN COc1cccc([C@H](CNc2cc(C)c([N+](=O)[O-])cc2F)N(C)C)c1 ZINC000327847448 1129133786 /nfs/dbraw/zinc/13/37/86/1129133786.db2.gz QUUZFGVXJAOCFO-SFHVURJKSA-N 0 3 347.390 3.766 20 5 EHBDHN C[C@@H](NCC1(C)OCCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000179576498 1123803636 /nfs/dbraw/zinc/80/36/36/1123803636.db2.gz YJDPHEUASLOMKA-GFCCVEGCSA-N 0 3 348.424 3.737 20 5 EHBDHN Cc1cccc([C@H](C)N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000115602944 1129278086 /nfs/dbraw/zinc/27/80/86/1129278086.db2.gz OOZBPHORPQZRLD-LSDHHAIUSA-N 0 3 341.411 3.889 20 5 EHBDHN CC[C@H]1CCCC[C@@H]1N(C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304728 1129659888 /nfs/dbraw/zinc/65/98/88/1129659888.db2.gz UJLAKCPTEFGDAT-GJZGRUSLSA-N 0 3 333.432 3.742 20 5 EHBDHN C[C@@H]1CCC[C@@H](C)N(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000125434078 1129691854 /nfs/dbraw/zinc/69/18/54/1129691854.db2.gz FOXKSGOKCFWXCY-CHWSQXEVSA-N 0 3 330.388 3.655 20 5 EHBDHN COC[C@@H](N[C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000156534004 1129722935 /nfs/dbraw/zinc/72/29/35/1129722935.db2.gz YBPJBHAWOHZKHF-CZUORRHYSA-N 0 3 332.400 3.795 20 5 EHBDHN C[C@H](NC[C@H](c1c(F)cccc1F)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173419157 1130228123 /nfs/dbraw/zinc/22/81/23/1130228123.db2.gz SLTHKKUGMNNEBO-YVEFUNNKSA-N 0 3 349.381 3.827 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NC[C@@H]2CCC[C@@H](O)C2)c2ccccc2)c1 ZINC000245953405 1130334337 /nfs/dbraw/zinc/33/43/37/1130334337.db2.gz LMXDYXDCLQPVJV-CDHQVMDDSA-N 0 3 340.423 3.825 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CNCc2cc(Cl)cc(Cl)c2)cc1 ZINC000731677875 1130831935 /nfs/dbraw/zinc/83/19/35/1130831935.db2.gz ARUZMUDEFVKSSN-HNNXBMFYSA-N 0 3 341.194 3.725 20 5 EHBDHN C[C@@H](N[C@@H](C)c1cccc(-n2ccnn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000348082832 1131150226 /nfs/dbraw/zinc/15/02/26/1131150226.db2.gz TZTHCZVPPGSGMK-UONOGXRCSA-N 0 3 337.383 3.587 20 5 EHBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N[C@H](C)c2cc(C)ccn2)c1F ZINC001173179262 1131992615 /nfs/dbraw/zinc/99/26/15/1131992615.db2.gz OPKKVJXXZSMCEE-CHWSQXEVSA-N 0 3 347.390 3.728 20 5 EHBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@H]1COCc1ccccc1 ZINC001173225934 1132006457 /nfs/dbraw/zinc/00/64/57/1132006457.db2.gz GTJQWEGJIAHDJY-JXFKEZNVSA-N 0 3 340.423 3.817 20 5 EHBDHN COc1ccc(Cl)cc1CN(C)CCc1cccc([N+](=O)[O-])c1 ZINC001169666838 1132814087 /nfs/dbraw/zinc/81/40/87/1132814087.db2.gz PEQPLUXRJJWMQH-UHFFFAOYSA-N 0 3 334.803 3.931 20 5 EHBDHN O=[N+]([O-])c1cc2c(cc1N[C@@H]1CCO[C@@H](c3ccccc3)C1)CNC2 ZINC001169757250 1132847364 /nfs/dbraw/zinc/84/73/64/1132847364.db2.gz UXXRPYYCSVMWKF-VQIMIIECSA-N 0 3 339.395 3.530 20 5 EHBDHN COc1ccc(COCCNCc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC001178346747 1133158103 /nfs/dbraw/zinc/15/81/03/1133158103.db2.gz LOGTZNDSJNPWNR-UHFFFAOYSA-N 0 3 344.411 3.527 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@@H](O)c1c(F)cccc1F)CCC2 ZINC000774249542 1133643411 /nfs/dbraw/zinc/64/34/11/1133643411.db2.gz BUIJDVPDHDRKSJ-DLBZAZTESA-N 0 3 348.349 3.574 20 5 EHBDHN Cc1ccc(CNC[C@H](O)c2cc(F)cc(Cl)c2)cc1[N+](=O)[O-] ZINC000785608241 1133726603 /nfs/dbraw/zinc/72/66/03/1133726603.db2.gz FUJJEOMZLWVXMW-INIZCTEOSA-N 0 3 338.766 3.519 20 5 EHBDHN O=C(OCc1ccc([N+](=O)[O-])cc1)c1cccc(CN2CCCC2)c1 ZINC000785719063 1133746935 /nfs/dbraw/zinc/74/69/35/1133746935.db2.gz ZYAQLOFNXNZSBK-UHFFFAOYSA-N 0 3 340.379 3.548 20 5 EHBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1ccc([N+](=O)[O-])cc1 ZINC000786809872 1133909601 /nfs/dbraw/zinc/90/96/01/1133909601.db2.gz ADCCVCGNGUTZFX-LCYFTJDESA-N 0 3 327.340 3.696 20 5 EHBDHN COC[C@@H](Cc1ccccc1)N(C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789455109 1134276931 /nfs/dbraw/zinc/27/69/31/1134276931.db2.gz IGJUKDHAXRUGEA-MRXNPFEDSA-N 0 3 348.830 3.938 20 5 EHBDHN C[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CCN1C1CCCC1 ZINC001187624173 1134357436 /nfs/dbraw/zinc/35/74/36/1134357436.db2.gz ASYOSGKBFHFGSC-LBPRGKRZSA-N 0 3 346.456 3.658 20 5 EHBDHN COc1ccc(C[C@@H](C)N2CCc3ccsc3C2)c([N+](=O)[O-])c1 ZINC001170348450 1134759756 /nfs/dbraw/zinc/75/97/56/1134759756.db2.gz XBUUVKXJTJUNPW-GFCCVEGCSA-N 0 3 332.425 3.654 20 5 EHBDHN CC[C@H](NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCCO1 ZINC000809975718 1135907489 /nfs/dbraw/zinc/90/74/89/1135907489.db2.gz SIPIMPVNJOVDJP-QWHCGFSZSA-N 0 3 333.215 3.949 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC1(CCO)CCC1 ZINC000811484033 1136092038 /nfs/dbraw/zinc/09/20/38/1136092038.db2.gz OKWRVVFZTCOXOS-UHFFFAOYSA-N 0 3 333.215 3.544 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000776276942 1136130487 /nfs/dbraw/zinc/13/04/87/1136130487.db2.gz LXKCYTDSODXMBI-MSOLQXFVSA-N 0 3 330.359 3.604 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C)[C@H](O)c1cccc(F)c1 ZINC000850444406 1136259800 /nfs/dbraw/zinc/25/98/00/1136259800.db2.gz JFUZKKSGQMVWSO-IUUKEHGRSA-N 0 3 348.374 3.515 20 5 EHBDHN CCN(Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812849009 1136260223 /nfs/dbraw/zinc/26/02/23/1136260223.db2.gz NSPWHADXAJSQLL-LIRRHRJNSA-N 0 3 344.411 3.547 20 5 EHBDHN CC(C)[C@H](O)[C@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000850553737 1136284411 /nfs/dbraw/zinc/28/44/11/1136284411.db2.gz CACWDPNOHAMSAL-BKTGTZMESA-N 0 3 343.427 3.586 20 5 EHBDHN CC(COC(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1)[N+](=O)[O-] ZINC000813104310 1136288498 /nfs/dbraw/zinc/28/84/98/1136288498.db2.gz MEXHXBYMUMZHQV-NSHDSACASA-N 0 3 345.317 3.726 20 5 EHBDHN Cc1cc(/C=C\C(=O)OCC(C)[N+](=O)[O-])c(C)n1C1CCCCC1 ZINC000813110322 1136294505 /nfs/dbraw/zinc/29/45/05/1136294505.db2.gz XQLXUXBDQFFDSE-CFYYFVFUSA-N 0 3 334.416 3.832 20 5 EHBDHN CC(COC(=O)c1ccc(O[C@@H](C)c2ccccc2)cc1)[N+](=O)[O-] ZINC000813111969 1136294711 /nfs/dbraw/zinc/29/47/11/1136294711.db2.gz YHKJIXOYPKQLQU-KBPBESRZSA-N 0 3 329.352 3.649 20 5 EHBDHN O=[N+]([O-])c1cc(F)ccc1CN[C@@H](c1ccccc1)C1CCOCC1 ZINC000851901006 1136417820 /nfs/dbraw/zinc/41/78/20/1136417820.db2.gz BZCHTGNNYROCQO-IBGZPJMESA-N 0 3 344.386 3.991 20 5 EHBDHN C[C@@H](c1ccncc1)N1CCC(Nc2cccc(F)c2[N+](=O)[O-])CC1 ZINC000819922838 1136966551 /nfs/dbraw/zinc/96/65/51/1136966551.db2.gz MNFLSZODOXNIOC-ZDUSSCGKSA-N 0 3 344.390 3.766 20 5 EHBDHN CC(=O)N(C)c1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000858497594 1136973886 /nfs/dbraw/zinc/97/38/86/1136973886.db2.gz XHIIHVODBBTGQP-AWEZNQCLSA-N 0 3 341.411 3.737 20 5 EHBDHN CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@@](C)(O)c1ccccc1 ZINC000822516254 1137064089 /nfs/dbraw/zinc/06/40/89/1137064089.db2.gz JHXVENZBQQPACQ-QGZVFWFLSA-N 0 3 334.803 3.588 20 5 EHBDHN CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@](C)(O)c1ccccc1 ZINC000822516253 1137064129 /nfs/dbraw/zinc/06/41/29/1137064129.db2.gz JHXVENZBQQPACQ-KRWDZBQOSA-N 0 3 334.803 3.588 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1CN1CCc2ccccc2[C@@H](C)C1 ZINC001171740830 1137511130 /nfs/dbraw/zinc/51/11/30/1137511130.db2.gz IIMQJDBWPTYHSA-AWEZNQCLSA-N 0 3 326.396 3.765 20 5 EHBDHN C[C@@H](N[C@@H]1CCO[C@@H](c2ccccn2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077400 1137569991 /nfs/dbraw/zinc/56/99/91/1137569991.db2.gz HSFCXLKXBKJTLG-PBFPGSCMSA-N 0 3 345.374 3.700 20 5 EHBDHN C[C@@H](CC(=O)Nc1ccc(F)cc1)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129846 1137573058 /nfs/dbraw/zinc/57/30/58/1137573058.db2.gz YXPGREOAGBOLEB-STQMWFEESA-N 0 3 345.374 3.802 20 5 EHBDHN C[C@@H](CC(=O)Nc1ccccc1)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129589 1137573148 /nfs/dbraw/zinc/57/31/48/1137573148.db2.gz QLOMZECIFYVOHZ-KBPBESRZSA-N 0 3 327.384 3.663 20 5 EHBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)c1nccnc1C ZINC000872133456 1137573506 /nfs/dbraw/zinc/57/35/06/1137573506.db2.gz MUJNYDNKMCBGII-UONOGXRCSA-N 0 3 346.456 3.915 20 5 EHBDHN C[C@@H]1CC(C)(C)CC[C@@H]1NCc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447924 1137716533 /nfs/dbraw/zinc/71/65/33/1137716533.db2.gz OVZLGIYKROZIIL-OCCSQVGLSA-N 0 3 344.415 3.949 20 5 EHBDHN CC[C@@H](NCc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CC1(C)C ZINC000878717751 1137726188 /nfs/dbraw/zinc/72/61/88/1137726188.db2.gz HMOVDFAQZNHOBT-CHWSQXEVSA-N 0 3 330.388 3.559 20 5 EHBDHN O=[N+]([O-])c1ccccc1-c1nnc(CN2CCCC[C@@H]2C2CCC2)o1 ZINC000878771858 1137727808 /nfs/dbraw/zinc/72/78/08/1137727808.db2.gz XXADHGIQHSROFB-OAHLLOKOSA-N 0 3 342.399 3.799 20 5 EHBDHN C[C@@H]1c2sccc2CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000880376967 1137777131 /nfs/dbraw/zinc/77/71/31/1137777131.db2.gz NBDHJYBJCBLCOW-GFCCVEGCSA-N 0 3 345.424 3.604 20 5 EHBDHN C[C@H]1CC(C)(C)CC[C@@H]1NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120775275 1137952250 /nfs/dbraw/zinc/95/22/50/1137952250.db2.gz NBQBXQLKNNLRII-WFASDCNBSA-N 0 3 344.415 3.949 20 5 EHBDHN C[C@H](NCc1ccc(F)c(CN(C)C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000120958231 1137953955 /nfs/dbraw/zinc/95/39/55/1137953955.db2.gz CQKHGNGACFPSAH-ZDUSSCGKSA-N 0 3 331.391 3.646 20 5 EHBDHN O=[N+]([O-])c1cccc(CN2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c1 ZINC000134802680 1137960801 /nfs/dbraw/zinc/96/08/01/1137960801.db2.gz CWZZOVNBHGBCGR-MJGOQNOKSA-N 0 3 344.386 3.822 20 5 EHBDHN Cc1nc(C2CCN([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)[nH]c1C ZINC000886670042 1138112100 /nfs/dbraw/zinc/11/21/00/1138112100.db2.gz ILRUNIMYYMBUCQ-AWEZNQCLSA-N 0 3 328.416 3.875 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNCC[C@H]3CCCCO3)cs2)c1 ZINC000181252329 1139895427 /nfs/dbraw/zinc/89/54/27/1139895427.db2.gz DGHLKXWIIJIZHT-MRXNPFEDSA-N 0 3 347.440 3.767 20 5 EHBDHN Cc1ccc([C@H](C)NCCC(=O)N(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000268789373 1140992952 /nfs/dbraw/zinc/99/29/52/1140992952.db2.gz FLVRRTGMFBRZCF-HNNXBMFYSA-N 0 3 341.411 3.607 20 5 EHBDHN C[C@H](c1ccc(F)c(F)c1)N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269636330 1141129856 /nfs/dbraw/zinc/12/98/56/1141129856.db2.gz AOPCBQVRUAMYFF-PIGZYNQJSA-N 0 3 336.338 3.599 20 5 EHBDHN COc1ccc(CN[C@H](C)[C@@H](OC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271548315 1141394936 /nfs/dbraw/zinc/39/49/36/1141394936.db2.gz UEFSGFWVDMEDHW-KZULUSFZSA-N 0 3 348.374 3.608 20 5 EHBDHN COc1ccc(CN[C@@H](C)[C@@H](OC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271548311 1141394950 /nfs/dbraw/zinc/39/49/50/1141394950.db2.gz UEFSGFWVDMEDHW-KPZWWZAWSA-N 0 3 348.374 3.608 20 5 EHBDHN COc1cc(CN(C)[C@@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575520 1141521167 /nfs/dbraw/zinc/52/11/67/1141521167.db2.gz VOGCUFNGAHPJMZ-CMPLNLGQSA-N 0 3 344.358 3.825 20 5 EHBDHN CC[C@@H](C)[C@@H](N)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000430383825 1016579516 /nfs/dbraw/zinc/57/95/16/1016579516.db2.gz JJRXJNYEOLBISG-SJKOYZFVSA-N 0 3 343.383 3.699 20 5 EHBDHN CC1(C)CN(Cc2cc(=O)oc3ccc4ccccc4c23)CC[C@@H]1O ZINC000275435429 1016771653 /nfs/dbraw/zinc/77/16/53/1016771653.db2.gz JPPADSZWJPZAOK-SFHVURJKSA-N 0 3 337.419 3.539 20 5 EHBDHN CCC1(CC)CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000459593914 1032314964 /nfs/dbraw/zinc/31/49/64/1032314964.db2.gz JRFASCQUBTWJAX-UHFFFAOYSA-N 0 3 328.416 3.617 20 5 EHBDHN O=[N+]([O-])c1ccc2[nH]c(CNC3CC(c4cccc(F)c4)C3)nc2c1 ZINC000278753216 1032341805 /nfs/dbraw/zinc/34/18/05/1032341805.db2.gz SHMDAGWNDPVUAJ-UHFFFAOYSA-N 0 3 340.358 3.646 20 5 EHBDHN COc1ccc(C)cc1[C@H](C)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000536855656 1032352825 /nfs/dbraw/zinc/35/28/25/1032352825.db2.gz AVKDSFNBQKCLLU-AWEZNQCLSA-N 0 3 330.384 3.641 20 5 EHBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](C)c1nc2c(s1)CCC2 ZINC000459645384 1032366684 /nfs/dbraw/zinc/36/66/84/1032366684.db2.gz GKDWITWLUBHBKE-RYUDHWBXSA-N 0 3 331.441 3.822 20 5 EHBDHN COC[C@@H](CNCc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000449482434 1032629468 /nfs/dbraw/zinc/62/94/68/1032629468.db2.gz YMOALJRKUUUIJV-CYBMUJFWSA-N 0 3 340.832 3.830 20 5 EHBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(Cc3cccc4nccn43)C2)cc1 ZINC000449497632 1032668070 /nfs/dbraw/zinc/66/80/70/1032668070.db2.gz ISNPWGZRWUEOGL-MRXNPFEDSA-N 0 3 336.395 3.622 20 5 EHBDHN CCOc1ccc([C@@H](C)N[C@@H](C)c2cc[nH]c(=O)c2)cc1[N+](=O)[O-] ZINC000340448121 1017864007 /nfs/dbraw/zinc/86/40/07/1017864007.db2.gz GDUPUWUVPYTMNF-NEPJUHHUSA-N 0 3 331.372 3.506 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2noc([C@H]3CCCN3C3CCCC3)n2)cc1 ZINC000275643007 1017874573 /nfs/dbraw/zinc/87/45/73/1017874573.db2.gz ORTIKRVOXRALMZ-OAHLLOKOSA-N 0 3 328.372 3.724 20 5 EHBDHN Cc1ccccc1C1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000178861385 1019307620 /nfs/dbraw/zinc/30/76/20/1019307620.db2.gz VKFALJVRWIHKBN-FQEVSTJZSA-N 0 3 340.423 3.816 20 5 EHBDHN CC[C@@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)CC(F)(F)F ZINC000602692222 1033071034 /nfs/dbraw/zinc/07/10/34/1033071034.db2.gz WLCWDZCXZTYFKE-SECBINFHSA-N 0 3 331.294 3.804 20 5 EHBDHN C[C@H](N[C@@H](C)c1ccc(-n2cncn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178325483 1022667976 /nfs/dbraw/zinc/66/79/76/1022667976.db2.gz IVXIAYLPIPWLEZ-KBPBESRZSA-N 0 3 337.383 3.587 20 5 EHBDHN O=[N+]([O-])c1ccc2oc(CN(C[C@H]3CCCO3)C3CCCC3)nc2c1 ZINC000610582759 1022824621 /nfs/dbraw/zinc/82/46/21/1022824621.db2.gz VSTDMEQYGZDITG-OAHLLOKOSA-N 0 3 345.399 3.660 20 5 EHBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC34CC(O)C4)o2)c(Cl)c1 ZINC000897851103 1033209130 /nfs/dbraw/zinc/20/91/30/1033209130.db2.gz PHJMXVIIMUZYEX-BROWOHMESA-N 0 3 348.786 3.511 20 5 EHBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@H]1CCC2(CCC2)O1 ZINC000895677912 1024708656 /nfs/dbraw/zinc/70/86/56/1024708656.db2.gz TXEYKAFEIQFBTK-CYBMUJFWSA-N 0 3 344.333 3.805 20 5 EHBDHN Cc1nn(C(C)(C)C)cc1[C@@H](C)NCCOc1ccccc1[N+](=O)[O-] ZINC000157562357 1024954133 /nfs/dbraw/zinc/95/41/33/1024954133.db2.gz WZZGTGQNVNLTIW-CYBMUJFWSA-N 0 3 346.431 3.584 20 5 EHBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000523010914 1026357300 /nfs/dbraw/zinc/35/73/00/1026357300.db2.gz ZSNBQSLSJYTZNR-OAHLLOKOSA-N 0 3 344.386 3.807 20 5 EHBDHN O=[N+]([O-])c1ccccc1CNCCOc1cccc(C(F)(F)F)c1 ZINC000237850722 1029455858 /nfs/dbraw/zinc/45/58/58/1029455858.db2.gz UGVYUMUTBWAHGK-UHFFFAOYSA-N 0 3 340.301 3.782 20 5 EHBDHN CC[C@@H](C)N[C@H](CNc1nc(C)cc(C)c1[N+](=O)[O-])c1ccco1 ZINC000343258797 1029959397 /nfs/dbraw/zinc/95/93/97/1029959397.db2.gz WDZPYGKJWYWTFV-TZMCWYRMSA-N 0 3 332.404 3.741 20 5 EHBDHN C[C@H](CC(C)(C)O)N[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453325784 1030109505 /nfs/dbraw/zinc/10/95/05/1030109505.db2.gz RQJFXFMWAADXJG-RDTXWAMCSA-N 0 3 328.412 3.823 20 5 EHBDHN CCOc1ccc([C@H](C)N2CCC[C@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000453365345 1030180585 /nfs/dbraw/zinc/18/05/85/1030180585.db2.gz LVARIAAIFKWXAN-KSSFIOAISA-N 0 3 334.416 3.557 20 5 EHBDHN COc1ccc(OCCN(C)[C@@H](C)c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000441268173 1030211952 /nfs/dbraw/zinc/21/19/52/1030211952.db2.gz YADADBSJLUBKHC-ZDUSSCGKSA-N 0 3 348.374 3.814 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2noc(CN(CC3CC3)CC3CCC3)n2)c1 ZINC000483259469 1031070407 /nfs/dbraw/zinc/07/04/07/1031070407.db2.gz FGIIXGJZOLXWRN-UHFFFAOYSA-N 0 3 342.399 3.657 20 5 EHBDHN COc1ccc(CN[C@@H]2CCCc3c(OC)cccc32)cc1[N+](=O)[O-] ZINC000584032320 1031504875 /nfs/dbraw/zinc/50/48/75/1031504875.db2.gz HHEHDWZNIFIMQQ-MRXNPFEDSA-N 0 3 342.395 3.779 20 5 EHBDHN CCS[C@@H]1CC[C@@H](N(C)Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000173487868 1033369073 /nfs/dbraw/zinc/36/90/73/1033369073.db2.gz NYBDKGJUYQAWRW-UKRRQHHQSA-N 0 3 334.445 3.508 20 5 EHBDHN COC[C@H](C)Oc1ccc(CNCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000594939258 1033587827 /nfs/dbraw/zinc/58/78/27/1033587827.db2.gz UDEUNZKXHKIRDB-AWEZNQCLSA-N 0 3 344.411 3.607 20 5 EHBDHN COC[C@@H](Cc1ccccc1)N[C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595011467 1033604521 /nfs/dbraw/zinc/60/45/21/1033604521.db2.gz HOQPSTJSHXREKQ-GOEBONIOSA-N 0 3 344.411 3.512 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCCNc1ccccc1 ZINC000595011079 1033606651 /nfs/dbraw/zinc/60/66/51/1033606651.db2.gz WUZGMUPPLJYXKI-AWEZNQCLSA-N 0 3 329.400 3.756 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H](c1ccccc1)N(C)C ZINC000595003161 1033628792 /nfs/dbraw/zinc/62/87/92/1033628792.db2.gz FKWJXWFHEUCCAW-KDOFPFPSSA-N 0 3 343.427 3.557 20 5 EHBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](c1ccsc1)N(C)C ZINC000595002980 1033629106 /nfs/dbraw/zinc/62/91/06/1033629106.db2.gz AMTRFQWLQNIGDN-BLLLJJGKSA-N 0 3 349.456 3.618 20 5 EHBDHN COc1ccc([C@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000599093023 1033730630 /nfs/dbraw/zinc/73/06/30/1033730630.db2.gz MEDBTRPCEIIGQC-KPZWWZAWSA-N 0 3 327.384 3.800 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F ZINC000593013362 1033805766 /nfs/dbraw/zinc/80/57/66/1033805766.db2.gz IAVWYLSAJOYQOK-VXGBXAGGSA-N 0 3 346.305 3.589 20 5 EHBDHN C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCO1 ZINC000179397378 1034279271 /nfs/dbraw/zinc/27/92/71/1034279271.db2.gz IVNIQRFEIFZRBQ-CYBMUJFWSA-N 0 3 332.425 3.934 20 5 EHBDHN CCc1cc(CCCN(Cc2cccc([N+](=O)[O-])c2)C2CC2)on1 ZINC000450495940 1034429785 /nfs/dbraw/zinc/42/97/85/1034429785.db2.gz CGPBTFRIVZFCNC-UHFFFAOYSA-N 0 3 329.400 3.742 20 5 EHBDHN CCCO[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000365191457 1034956263 /nfs/dbraw/zinc/95/62/63/1034956263.db2.gz SEDBGUAMKFEAHG-INIZCTEOSA-N 0 3 336.432 3.775 20 5 EHBDHN Cc1ccc([C@@H](C)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000164526117 1035652639 /nfs/dbraw/zinc/65/26/39/1035652639.db2.gz KHVVKDNCTPWAQD-HIFRSBDPSA-N 0 3 349.431 3.563 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NC[C@@H]2CCC[C@H](O)C2)c2ccccc2)c1 ZINC000180621647 1037017307 /nfs/dbraw/zinc/01/73/07/1037017307.db2.gz LMXDYXDCLQPVJV-UIAACRFSSA-N 0 3 340.423 3.825 20 5 EHBDHN CC[C@H](CCO)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180738933 1037134629 /nfs/dbraw/zinc/13/46/29/1037134629.db2.gz MHZBLGFFSLEZNF-DNVCBOLYSA-N 0 3 328.412 3.682 20 5 EHBDHN COc1ccc(-c2ccc(CN[C@]3(C)CCO[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000542316625 1037281886 /nfs/dbraw/zinc/28/18/86/1037281886.db2.gz WUQDVDGPPMAKMV-KZULUSFZSA-N 0 3 346.383 3.521 20 5 EHBDHN COc1cc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)c([N+](=O)[O-])cc1[O-] ZINC000491599203 1037578511 /nfs/dbraw/zinc/57/85/11/1037578511.db2.gz PAPHHIBAQDNBLO-LLVKDONJSA-N 0 3 344.358 3.614 20 5 EHBDHN CC[C@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341220568 1037781728 /nfs/dbraw/zinc/78/17/28/1037781728.db2.gz NVGNGAFCBIGPCG-GUYCJALGSA-N 0 3 327.384 3.663 20 5 EHBDHN O=[N+]([O-])c1ccccc1CNCC[C@@H]1CSc2ccccc2O1 ZINC000592373104 1037922726 /nfs/dbraw/zinc/92/27/26/1037922726.db2.gz UIUMLNCGYLQPNO-CQSZACIVSA-N 0 3 330.409 3.628 20 5 EHBDHN Cc1cccc([C@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000539290611 1038763100 /nfs/dbraw/zinc/76/31/00/1038763100.db2.gz ARCFYBURAKYVCX-GJZGRUSLSA-N 0 3 341.411 3.889 20 5 EHBDHN CC[C@@]1(CO)CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000190224129 1038772953 /nfs/dbraw/zinc/77/29/53/1038772953.db2.gz FYSLLEUGKPXIDC-LJQANCHMSA-N 0 3 344.411 3.839 20 5 EHBDHN CC(C)(CNc1ccccc1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000026725626 1038818402 /nfs/dbraw/zinc/81/84/02/1038818402.db2.gz PYOLEDQSUJJXDV-UHFFFAOYSA-N 0 3 325.412 3.844 20 5 EHBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@H]3CCSC3)cs2)c1 ZINC000279941933 1039592293 /nfs/dbraw/zinc/59/22/93/1039592293.db2.gz JKGBXMGACQUEAW-LLVKDONJSA-N 0 3 335.454 3.561 20 5 EHBDHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000480687271 1039885234 /nfs/dbraw/zinc/88/52/34/1039885234.db2.gz WZTXKDBPBSPSDU-UHFFFAOYSA-N 0 3 348.447 3.633 20 5 EHBDHN CC(C)c1ccc(CNC[C@@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000072726100 1040318733 /nfs/dbraw/zinc/31/87/33/1040318733.db2.gz HLGLUPZHSVRCRQ-KRWDZBQOSA-N 0 3 331.416 3.704 20 5 EHBDHN CC(C)c1ccc(CNC[C@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000072726101 1040319417 /nfs/dbraw/zinc/31/94/17/1040319417.db2.gz HLGLUPZHSVRCRQ-QGZVFWFLSA-N 0 3 331.416 3.704 20 5 EHBDHN O=[N+]([O-])c1cccc([C@H](NCC2(O)CCCCC2)c2ccccc2)c1 ZINC000490179015 1040369365 /nfs/dbraw/zinc/36/93/65/1040369365.db2.gz UNICNKXETQBXPZ-LJQANCHMSA-N 0 3 340.423 3.969 20 5 EHBDHN CC[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CC1(C)C ZINC000419314210 1041253483 /nfs/dbraw/zinc/25/34/83/1041253483.db2.gz HOLVBZFZVWIMCZ-KGLIPLIRSA-N 0 3 330.388 3.559 20 5 EHBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@H]1CC=CCC1 ZINC000344030521 1043125331 /nfs/dbraw/zinc/12/53/31/1043125331.db2.gz BUJRFLLTAWBUPM-KGLIPLIRSA-N 0 3 342.399 3.994 20 5 EHBDHN Cc1c(CN[C@@H](C)c2cccc(-n3cccn3)c2)cccc1[N+](=O)[O-] ZINC000183592710 1125608366 /nfs/dbraw/zinc/60/83/66/1125608366.db2.gz MWNGFIGFWKGOOZ-HNNXBMFYSA-N 0 3 336.395 3.940 20 5 EHBDHN Cc1nn(CN2CC[C@@H](c3ccccc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764946921 1127558195 /nfs/dbraw/zinc/55/81/95/1127558195.db2.gz YVCKSHGHAKJKHG-MRXNPFEDSA-N 0 3 336.395 3.700 20 5 EHBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)[C@H](C)C1CCCCC1 ZINC000554839629 1128712643 /nfs/dbraw/zinc/71/26/43/1128712643.db2.gz KHKKFINUKZPARO-CQSZACIVSA-N 0 3 333.432 3.742 20 5 EHBDHN Cc1cc(NCCCCn2ccnc2)c2cc([N+](=O)[O-])ccc2n1 ZINC000326217833 1121150626 /nfs/dbraw/zinc/15/06/26/1121150626.db2.gz ZHWUOMVKPNSCSU-UHFFFAOYSA-N 0 3 325.372 3.540 20 5 EHBDHN CCC[C@H](NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000193630399 1121514754 /nfs/dbraw/zinc/51/47/54/1121514754.db2.gz XAYUXTXJKAYUDV-KRWDZBQOSA-N 0 3 341.411 3.973 20 5 EHBDHN C[C@H](C[C@@H]1CCCO1)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113333106 1129002565 /nfs/dbraw/zinc/00/25/65/1129002565.db2.gz WGRUHMROZABVMO-WBMJQRKESA-N 0 3 347.440 3.766 20 5 EHBDHN CCC1(CC)[C@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H](C)[C@H]1OC ZINC000617549837 1124648566 /nfs/dbraw/zinc/64/85/66/1124648566.db2.gz NKVAACKMBDSRIP-SSKCKEOISA-N 0 3 347.415 3.665 20 5 EHBDHN O=[N+]([O-])c1ccc(F)cc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000281116675 1129703545 /nfs/dbraw/zinc/70/35/45/1129703545.db2.gz XFGUYLVWYCAWSQ-JQHSSLGASA-N 0 3 336.407 3.640 20 5 EHBDHN O=[N+]([O-])c1ccc(F)cc1CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000281116678 1129703574 /nfs/dbraw/zinc/70/35/74/1129703574.db2.gz XFGUYLVWYCAWSQ-KBAYOESNSA-N 0 3 336.407 3.640 20 5 EHBDHN COCc1cc([C@@H](C)NCc2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000126054869 1129733643 /nfs/dbraw/zinc/73/36/43/1129733643.db2.gz GTPIXTQKTBFPFP-CYBMUJFWSA-N 0 3 330.384 3.601 20 5 EHBDHN CC[C@@H]1CCCCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000157327483 1129758179 /nfs/dbraw/zinc/75/81/79/1129758179.db2.gz PLUVQNUSPDYSNX-CQSZACIVSA-N 0 3 330.388 3.799 20 5 EHBDHN CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCCC1 ZINC000039536604 1130139713 /nfs/dbraw/zinc/13/97/13/1130139713.db2.gz RWXBYVLXUSYLOY-UHFFFAOYSA-N 0 3 339.823 3.841 20 5 EHBDHN CCCN(Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000740881777 1131552574 /nfs/dbraw/zinc/55/25/74/1131552574.db2.gz CWSQXBYFLXWXKI-DJIMGWMZSA-N 0 3 336.407 3.759 20 5 EHBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@H](N1CCCC(F)(F)[C@@H](F)C1)CC2 ZINC001172905336 1131886755 /nfs/dbraw/zinc/88/67/55/1131886755.db2.gz RFKALELCSMBZLM-ZBFHGGJFSA-N 0 3 342.361 3.911 20 5 EHBDHN O=C1CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H]2CCCC[C@H]12 ZINC001172908402 1131888155 /nfs/dbraw/zinc/88/81/55/1131888155.db2.gz MDOITLZGSHBJDY-NEWSRXKRSA-N 0 3 342.439 3.676 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(C(F)(F)F)o1 ZINC001173227531 1132007615 /nfs/dbraw/zinc/00/76/15/1132007615.db2.gz GSWSFFZSVHEIKV-SNVBAGLBSA-N 0 3 328.290 3.927 20 5 EHBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H](c1ncccc1F)C1CC1 ZINC001173230555 1132008266 /nfs/dbraw/zinc/00/82/66/1132008266.db2.gz RXMFQNAMAZRWFE-PXAZEXFGSA-N 0 3 329.375 3.801 20 5 EHBDHN C[C@H](c1ccccc1)[C@H](CO)NCc1ccc([N+](=O)[O-])cc1Cl ZINC001168991818 1132626230 /nfs/dbraw/zinc/62/62/30/1132626230.db2.gz CERNDIOBGIMJKF-PXAZEXFGSA-N 0 3 334.803 3.502 20 5 EHBDHN C[C@H](N)c1ccn(-c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC001169232671 1132703114 /nfs/dbraw/zinc/70/31/14/1132703114.db2.gz ICCXLGOMIFCFDK-LBPRGKRZSA-N 0 3 340.408 3.951 20 5 EHBDHN CC1(C)C[C@H](NC[C@@H](O)c2ccccc2F)c2cc([N+](=O)[O-])ccc21 ZINC000788580596 1134148229 /nfs/dbraw/zinc/14/82/29/1134148229.db2.gz NRNJOBPQKMEBDJ-ZWKOTPCHSA-N 0 3 344.386 3.780 20 5 EHBDHN COc1ccc(C[C@H](C)N[C@H](C)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC001170297601 1134737365 /nfs/dbraw/zinc/73/73/65/1134737365.db2.gz QPHNAKGPHUIHCJ-CMPLNLGQSA-N 0 3 335.429 3.650 20 5 EHBDHN CC[C@@H](c1ccccc1OC)N(C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834346 1135332394 /nfs/dbraw/zinc/33/23/94/1135332394.db2.gz FWOAMEDKWYVDSD-ZWKOTPCHSA-N 0 3 344.411 3.720 20 5 EHBDHN CC[C@@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC001195623308 1135444302 /nfs/dbraw/zinc/44/43/02/1135444302.db2.gz ZLLOOJKJLYHRCU-QGZVFWFLSA-N 0 3 345.374 3.803 20 5 EHBDHN O=[N+]([O-])c1cc(CN2CCCC[C@@H]([C@H]3CCOC3)C2)ccc1Cl ZINC001198563865 1135831201 /nfs/dbraw/zinc/83/12/01/1135831201.db2.gz TXPOPYPMTOLTCL-CABCVRRESA-N 0 3 338.835 3.887 20 5 EHBDHN CO[C@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1(C)C ZINC000811483476 1136091749 /nfs/dbraw/zinc/09/17/49/1136091749.db2.gz JYKADJLSOLKYEW-NEPJUHHUSA-N 0 3 333.215 3.805 20 5 EHBDHN CCC(CC)(CO)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811485184 1136091963 /nfs/dbraw/zinc/09/19/63/1136091963.db2.gz BRJRJSPTFABRER-UHFFFAOYSA-N 0 3 335.231 3.790 20 5 EHBDHN Cc1cccc(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])n1 ZINC000811498184 1136094309 /nfs/dbraw/zinc/09/43/09/1136094309.db2.gz NOBQLFWKEFAERU-UHFFFAOYSA-N 0 3 340.210 3.937 20 5 EHBDHN C[C@H](N)c1ncc(-c2ccccc2)n1-c1cc2cc[nH]c2c([N+](=O)[O-])c1 ZINC001170682204 1136230648 /nfs/dbraw/zinc/23/06/48/1136230648.db2.gz MUZTYODSCZYHGX-LBPRGKRZSA-N 0 3 347.378 3.949 20 5 EHBDHN CCc1ccc([C@H](O)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850470243 1136265291 /nfs/dbraw/zinc/26/52/91/1136265291.db2.gz ZVKFZCPSWDFQDQ-SCLBCKFNSA-N 0 3 344.411 3.550 20 5 EHBDHN CC(COC(=O)CSc1cccc2cccc(Cl)c21)[N+](=O)[O-] ZINC000813105654 1136288723 /nfs/dbraw/zinc/28/87/23/1136288723.db2.gz RGWGULGEFPKIJH-JTQLQIEISA-N 0 3 339.800 3.794 20 5 EHBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC1(CCO)CCCC1 ZINC000852120634 1136435530 /nfs/dbraw/zinc/43/55/30/1136435530.db2.gz VJTHZJPSUGTKTO-UHFFFAOYSA-N 0 3 333.215 3.686 20 5 EHBDHN CN(Cc1cc2ccccc2o1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776590375 1136453176 /nfs/dbraw/zinc/45/31/76/1136453176.db2.gz DCCSQKBBFMACOP-QGZVFWFLSA-N 0 3 326.352 3.506 20 5 EHBDHN CC(C)Oc1cccc(CN(C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776592920 1136453622 /nfs/dbraw/zinc/45/36/22/1136453622.db2.gz CTCZAAZTWCOHGM-LJQANCHMSA-N 0 3 344.411 3.547 20 5 EHBDHN CC(C)(CO)[C@@H](NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000815247637 1136572905 /nfs/dbraw/zinc/57/29/05/1136572905.db2.gz FASYSCSIQFTMDR-AWEZNQCLSA-N 0 3 347.242 3.788 20 5 EHBDHN Cc1c(CNC[C@@H](O)c2ccc(F)cc2Cl)cccc1[N+](=O)[O-] ZINC000819261321 1136929616 /nfs/dbraw/zinc/92/96/16/1136929616.db2.gz JIIQRLNMUITVNP-MRXNPFEDSA-N 0 3 338.766 3.519 20 5 EHBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1Cl ZINC000824696980 1137147225 /nfs/dbraw/zinc/14/72/25/1137147225.db2.gz WUUHAZPOHMBJTC-YSVLISHTSA-N 0 3 338.835 3.764 20 5 EHBDHN C[C@H](CSc1ccccc1)N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362094 1137215284 /nfs/dbraw/zinc/21/52/84/1137215284.db2.gz XSEZFLYHLCEVTM-RDTXWAMCSA-N 0 3 346.452 3.741 20 5 EHBDHN CC([C@@H](OC(=O)C=C1CCSCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878778 1137316566 /nfs/dbraw/zinc/31/65/66/1137316566.db2.gz SRLHYSXXHNQDQO-MEDUHNTESA-N 0 3 339.388 3.529 20 5 EHBDHN CC([C@H](OC(=O)[C@@H]1CCCC(F)(F)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845883731 1137316990 /nfs/dbraw/zinc/31/69/90/1137316990.db2.gz VHQATZLYHNBWLQ-GYSYKLTISA-N 0 3 345.317 3.901 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000873097791 1137590117 /nfs/dbraw/zinc/59/01/17/1137590117.db2.gz FZHGVGQKFVNBHC-JBEBIEQOSA-N 0 3 346.452 3.800 20 5 EHBDHN C[C@@H]1CCC[C@@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966238 1137697427 /nfs/dbraw/zinc/69/74/27/1137697427.db2.gz DXQYDBVYFMXNAO-CHWSQXEVSA-N 0 3 330.388 3.655 20 5 EHBDHN CCOc1cc(CN[C@@H]2CC=CC[C@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000879672188 1137754778 /nfs/dbraw/zinc/75/47/78/1137754778.db2.gz PFLVSPWOKCBLII-CHWSQXEVSA-N 0 3 344.333 3.980 20 5 EHBDHN Cc1nc(C2C[C@H]3CC[C@@H](C2)N3Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000879681590 1137755267 /nfs/dbraw/zinc/75/52/67/1137755267.db2.gz YDHYRZFSZVQUKM-MQVJKMGUSA-N 0 3 342.399 3.505 20 5 EHBDHN Cc1occc1CN(C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104676531 1137879130 /nfs/dbraw/zinc/87/91/30/1137879130.db2.gz BJMNGDJDCJOEHF-UHFFFAOYSA-N 0 3 341.367 3.826 20 5 EHBDHN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c(CN(C)C)c1 ZINC000072840948 1138108135 /nfs/dbraw/zinc/10/81/35/1138108135.db2.gz OUWQOUAKCKWOKR-UHFFFAOYSA-N 0 3 327.384 3.526 20 5 EHBDHN CC(=O)Nc1ccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000182004573 1139944690 /nfs/dbraw/zinc/94/46/90/1139944690.db2.gz LVMMPFBQSBWWDZ-OLZOCXBDSA-N 0 3 327.384 3.965 20 5 EHBDHN CCC1(O)CCN(Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000266719926 1140718581 /nfs/dbraw/zinc/71/85/81/1140718581.db2.gz HEKYHAIZDBFPCB-UHFFFAOYSA-N 0 3 337.419 3.683 20 5 EHBDHN Cc1c(CN2CCC[C@H]2C[C@@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000268309592 1140918919 /nfs/dbraw/zinc/91/89/19/1140918919.db2.gz XAKOPLIAXABHPX-DOTOQJQBSA-N 0 3 330.384 3.584 20 5 EHBDHN Cc1ccc([N+](=O)[O-])c(NC2CCN([C@H](C)c3ccncc3)CC2)c1 ZINC000269750577 1141141732 /nfs/dbraw/zinc/14/17/32/1141141732.db2.gz ZUBVKXUTIWMZMJ-OAHLLOKOSA-N 0 3 340.427 3.936 20 5 EHBDHN Cc1c(NC(=O)CCN2CC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000348526348 1141545241 /nfs/dbraw/zinc/54/52/41/1141545241.db2.gz UTVBSTPPPOPEMM-GOSISDBHSA-N 0 3 339.395 3.679 20 5 EHBDHN