smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[N@@H+]1CCCC[C@H]1c1ccc(N2CCn3c(C[NH+](C)C(C)C)cnc3[C@@H]2C)nc1 ZINC001164862352 721016752 /nfs/dbraw/zinc/01/67/52/721016752.db2.gz PYPZLRHDGZCSAG-UGKGYDQZSA-N 2 0 410.610 4.246 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3CCC[C@@]4(C[C@H](c5ccccc5)CO4)C3)c2)CC1 ZINC001164774583 721061138 /nfs/dbraw/zinc/06/11/38/721061138.db2.gz WSTZWXGNOSHWLE-SQJMNOBHSA-N 2 0 407.558 4.098 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cc(Cl)cc(C(F)(F)F)c3)cn2)CC1 ZINC000436274639 861583148 /nfs/dbraw/zinc/58/31/48/861583148.db2.gz ZHGPQWCGXNBDCX-UHFFFAOYSA-N 2 0 412.887 4.186 20 0 HIADRP O=C([C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1)N1CCCCC1 ZINC000436281191 861590090 /nfs/dbraw/zinc/59/00/90/861590090.db2.gz FXTZHIXROSYBIG-WJGLBBAVSA-N 2 0 409.618 4.058 20 0 HIADRP Cc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000030907262 847796371 /nfs/dbraw/zinc/79/63/71/847796371.db2.gz BFKFXCRDMOCLTN-JOCHJYFZSA-N 2 0 400.570 4.481 20 0 HIADRP COc1cccc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)c1 ZINC000030913870 847797401 /nfs/dbraw/zinc/79/74/01/847797401.db2.gz ZMOJRIOVXMCPDU-UHFFFAOYSA-N 2 0 401.554 4.307 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000038830378 848180826 /nfs/dbraw/zinc/18/08/26/848180826.db2.gz PMXSLYDPMMFCES-VWLOTQADSA-N 2 0 405.586 4.201 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCC1)N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000045192021 848645442 /nfs/dbraw/zinc/64/54/42/848645442.db2.gz WVAJVYRCJAHVLU-UHFFFAOYSA-N 2 0 412.622 4.080 20 0 HIADRP CC(C)[NH+]1CCC(NC(=O)NCc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000057286379 850601630 /nfs/dbraw/zinc/60/16/30/850601630.db2.gz BOGKXRAZRIIFTG-UHFFFAOYSA-N 2 0 400.611 4.123 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000059037899 850982717 /nfs/dbraw/zinc/98/27/17/850982717.db2.gz NBSOHNVDEWVBCW-NRFANRHFSA-N 2 0 414.619 4.226 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)c1cccc(OC)c1 ZINC000059951591 851027541 /nfs/dbraw/zinc/02/75/41/851027541.db2.gz KWYJMWWQPWPGTK-XMMPIXPASA-N 2 0 409.574 4.104 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC[NH+](C(C)(C)C)CC1 ZINC000060545075 851141532 /nfs/dbraw/zinc/14/15/32/851141532.db2.gz GMXAMUQVAULADL-HXUWFJFHSA-N 2 0 400.611 4.077 20 0 HIADRP CC[NH+](CC)CCNC(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000060894329 851243284 /nfs/dbraw/zinc/24/32/84/851243284.db2.gz CEONIYWJKOLIFH-UHFFFAOYSA-N 2 0 408.590 4.090 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000061142378 851304416 /nfs/dbraw/zinc/30/44/16/851304416.db2.gz KTZUWKZDRCCERQ-OFNKIYASSA-N 2 0 424.589 4.290 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCC2)cc1)NCc1ccccc1C[NH+]1CCCCC1 ZINC000061521237 851394751 /nfs/dbraw/zinc/39/47/51/851394751.db2.gz XWTCWWIAMKHAKU-UHFFFAOYSA-N 2 0 420.601 4.268 20 0 HIADRP COc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1Br ZINC000063551821 851713278 /nfs/dbraw/zinc/71/32/78/851713278.db2.gz ZZKBODMWMRFAHR-UHFFFAOYSA-N 2 0 403.364 4.460 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000065933873 852323721 /nfs/dbraw/zinc/32/37/21/852323721.db2.gz COPVHGYDHZCOHQ-UHFFFAOYSA-N 2 0 424.495 4.194 20 0 HIADRP CN(c1ccc(NC(=O)C2CC[NH+](Cc3ccccc3)CC2)cc1)C1CC[NH+](C)CC1 ZINC000065992141 852344267 /nfs/dbraw/zinc/34/42/67/852344267.db2.gz OGBXQVHDKIUEEN-UHFFFAOYSA-N 2 0 420.601 4.068 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC[NH+](Cc3cccc(OC)c3)CC2)cc1)C(C)C ZINC000110169917 853068860 /nfs/dbraw/zinc/06/88/60/853068860.db2.gz NFZZQPNTISHIAP-UHFFFAOYSA-N 2 0 423.601 4.320 20 0 HIADRP Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000147365341 853586374 /nfs/dbraw/zinc/58/63/74/853586374.db2.gz QNWAVGPPNZSPPI-HSZRJFAPSA-N 2 0 409.599 4.147 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc(OCC(F)F)c2)CC1 ZINC000236803314 853924740 /nfs/dbraw/zinc/92/47/40/853924740.db2.gz SDMINSQNFDGRRQ-UHFFFAOYSA-N 2 0 403.517 4.152 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cc(Br)cs2)CC1 ZINC000236802107 853924823 /nfs/dbraw/zinc/92/48/23/853924823.db2.gz BJVDWRHUPYDGJV-UHFFFAOYSA-N 2 0 408.409 4.332 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000237167819 853975474 /nfs/dbraw/zinc/97/54/74/853975474.db2.gz DKAKHDBTDHVJRK-UHFFFAOYSA-N 2 0 401.982 4.035 20 0 HIADRP C[NH+]1CCN(CCC[NH2+]Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)CC1 ZINC000237207360 853982143 /nfs/dbraw/zinc/98/21/43/853982143.db2.gz HKKDZCQNIRIFFQ-UHFFFAOYSA-N 2 0 422.400 4.300 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)ccc1OC(F)F ZINC000237216036 853984693 /nfs/dbraw/zinc/98/46/93/853984693.db2.gz BCUMESJZDUVYPD-IRXDYDNUSA-N 2 0 420.500 4.196 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(F)c(Br)c2)C[C@@H](C)O1 ZINC000237412148 854026906 /nfs/dbraw/zinc/02/69/06/854026906.db2.gz MFWOKCQZTOGXCT-HZPDHXFCSA-N 2 0 421.354 4.487 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000237425200 854030762 /nfs/dbraw/zinc/03/07/62/854030762.db2.gz BSFJIHCNKAZGSR-OAHLLOKOSA-N 2 0 404.352 4.018 20 0 HIADRP Fc1ccc(Br)cc1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000237728080 854084854 /nfs/dbraw/zinc/08/48/54/854084854.db2.gz ARXSOGAAZCVHPU-UHFFFAOYSA-N 2 0 407.327 4.353 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000303159099 854792342 /nfs/dbraw/zinc/79/23/42/854792342.db2.gz PAUCCEUKMUTNEB-HSALFYBXSA-N 2 0 420.667 4.016 20 0 HIADRP CC(C)[NH+]1CCN(c2ccc(C(=O)NCC(C)(C)[NH2+][C@H](C)c3ccccc3)cc2)CC1 ZINC000303432534 854933772 /nfs/dbraw/zinc/93/37/72/854933772.db2.gz XEQFEDLWBIIGBJ-OAQYLSRUSA-N 2 0 422.617 4.076 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NC2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)c1 ZINC000303512685 855000194 /nfs/dbraw/zinc/00/01/94/855000194.db2.gz XFNQDINJPUCXMK-QILAJZQNSA-N 2 0 420.601 4.133 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000303639311 855095830 /nfs/dbraw/zinc/09/58/30/855095830.db2.gz HNHZOHDECYHWLK-BDTNDASRSA-N 2 0 414.638 4.269 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000303804799 855208993 /nfs/dbraw/zinc/20/89/93/855208993.db2.gz XQLJXQRVRWACML-ZSQFBXSQSA-N 2 0 419.613 4.410 20 0 HIADRP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CN1C(=O)OC(C)(C)C ZINC000399026194 855477630 /nfs/dbraw/zinc/47/76/30/855477630.db2.gz JIPKRDBNTGUUMI-BAGYTPMASA-N 2 0 401.595 4.276 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)cc1 ZINC000410342751 855939128 /nfs/dbraw/zinc/93/91/28/855939128.db2.gz BBTUKEYTSUUZGI-NZQKXSOJSA-N 2 0 424.589 4.290 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000410363444 855951632 /nfs/dbraw/zinc/95/16/32/855951632.db2.gz FZPBELJEJIDWEL-HYBUGGRVSA-N 2 0 408.590 4.163 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NCc2ccccc2C[NH+]2CCC[C@H](C)C2)C1 ZINC000410362897 855951954 /nfs/dbraw/zinc/95/19/54/855951954.db2.gz ZFJAHKNTPVDQDW-YADHBBJMSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)C1 ZINC000410364276 855952490 /nfs/dbraw/zinc/95/24/90/855952490.db2.gz LMQVXZOZNRNIJV-RXVVDRJESA-N 2 0 414.619 4.082 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@@H](c1ccsc1)[NH+](C)C ZINC000410372413 855957959 /nfs/dbraw/zinc/95/79/59/855957959.db2.gz VTPCWOMWMCNEHS-AVRDEDQJSA-N 2 0 414.619 4.225 20 0 HIADRP Cc1ccc2cc([C@@H](C)[NH2+]Cc3cccc(C[N@@H+]4CCC[C@H](C(N)=O)C4)c3)oc2c1 ZINC000426029710 856056572 /nfs/dbraw/zinc/05/65/72/856056572.db2.gz LKOPHAZPHHNUEC-GCJKJVERSA-N 2 0 405.542 4.289 20 0 HIADRP Cn1c2ccccc2cc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1=O ZINC000426317235 856242488 /nfs/dbraw/zinc/24/24/88/856242488.db2.gz LWXUBOLLZRMRJZ-ICDZXHCJSA-N 2 0 415.581 4.319 20 0 HIADRP Cc1oc(-c2ccsc2)nc1C[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000426789715 856479177 /nfs/dbraw/zinc/47/91/77/856479177.db2.gz XDCKJDOHWPNCAX-CALCHBBNSA-N 2 0 403.592 4.423 20 0 HIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)CCC[NH+]1CCN(c2ccccc2)CC1 ZINC000427494373 856841158 /nfs/dbraw/zinc/84/11/58/856841158.db2.gz GCYOQCFYQUMKIP-UHFFFAOYSA-N 2 0 420.601 4.132 20 0 HIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c1)CCS2 ZINC000427693756 856911196 /nfs/dbraw/zinc/91/11/96/856911196.db2.gz GTOHOGAYHCNSFD-GGAORHGYSA-N 2 0 423.626 4.327 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCCc4ncc(C(F)(F)F)cc43)cc2)CC1 ZINC000427710271 856918015 /nfs/dbraw/zinc/91/80/15/856918015.db2.gz NTDKTCGDHKRGNF-OAQYLSRUSA-N 2 0 419.491 4.224 20 0 HIADRP O=C(c1ccco1)N1CCC([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000428239070 857123051 /nfs/dbraw/zinc/12/30/51/857123051.db2.gz MWFSIDBIZPZRHZ-OEMFJLHTSA-N 2 0 421.585 4.165 20 0 HIADRP c1cc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)ccc1C[NH+]1CCOC[C@H](C2CCC2)C1 ZINC000429030745 857465487 /nfs/dbraw/zinc/46/54/87/857465487.db2.gz SOEYEAZYQQHYLT-CLJLJLNGSA-N 2 0 412.618 4.184 20 0 HIADRP C[C@@H]([NH2+]CCC[NH2+][C@@H](C)[C@@H]1OCCc2sccc21)[C@@H]1OCCc2sccc21 ZINC000429119980 857518526 /nfs/dbraw/zinc/51/85/26/857518526.db2.gz BFVOZXFLXQDLHZ-YQMDMEMYSA-N 2 0 406.617 4.084 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H]2c3cc(Br)ccc3CC2(C)C)CC1 ZINC000429287680 857591319 /nfs/dbraw/zinc/59/13/19/857591319.db2.gz AKVDEOAQYSIUGD-FQEVSTJZSA-N 2 0 408.428 4.078 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCOc4c(C(C)C)cccc43)cn2)CC1 ZINC000431326089 858566188 /nfs/dbraw/zinc/56/61/88/858566188.db2.gz ABQSFZKGYNDRCA-HSZRJFAPSA-N 2 0 408.590 4.350 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@H]2CCCOc3cc4c(cc32)CCC4)c1 ZINC000431352021 858575596 /nfs/dbraw/zinc/57/55/96/858575596.db2.gz RPKJIASOJGSQJF-VWLOTQADSA-N 2 0 424.585 4.136 20 0 HIADRP C[C@H](CCN1CC[NH+](CC2CCCCC2)CC1)N1CC[NH+](CC2CCCCC2)CC1 ZINC000431595125 858681122 /nfs/dbraw/zinc/68/11/22/858681122.db2.gz IFDAJWQRRHIAIF-XMMPIXPASA-N 2 0 418.714 4.161 20 0 HIADRP C[C@@H](CC[N@@H+]1CCCN(c2ccccc2)CC1)[NH+]1CCCN(c2ccccc2)CC1 ZINC000431617036 858691739 /nfs/dbraw/zinc/69/17/39/858691739.db2.gz LJKXVEGGRSPRJT-DEOSSOPVSA-N 2 0 406.618 4.190 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)CC1 ZINC000431622791 858694946 /nfs/dbraw/zinc/69/49/46/858694946.db2.gz QCVUTKPPCKHTHK-NRFANRHFSA-N 2 0 414.638 4.269 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000431642832 858707688 /nfs/dbraw/zinc/70/76/88/858707688.db2.gz IKRWNUXYTFPRHR-NRFANRHFSA-N 2 0 420.667 4.017 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)NCC2CC[NH+](Cc3cccs3)CC2)CC1 ZINC000431652333 858713715 /nfs/dbraw/zinc/71/37/15/858713715.db2.gz UNGZZHPFOZWONA-UHFFFAOYSA-N 2 0 420.667 4.017 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)NC2CC[NH+](C3CCCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000431667320 858726157 /nfs/dbraw/zinc/72/61/57/858726157.db2.gz YMWDMUWKAKRDQN-OFNKIYASSA-N 2 0 412.622 4.136 20 0 HIADRP Cc1cccc(CN(CC[NH+](C)C)C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000431673774 858729615 /nfs/dbraw/zinc/72/96/15/858729615.db2.gz POKCJQMLMORXMO-RCZVLFRGSA-N 2 0 422.617 4.121 20 0 HIADRP C[C@@H](C(=O)N(C)Cc1ccccc1)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433052841 859501525 /nfs/dbraw/zinc/50/15/25/859501525.db2.gz MUPYNNNGGLGVGS-QFIPXVFZSA-N 2 0 405.586 4.022 20 0 HIADRP COc1ccc(C)cc1NC(=O)[C@@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433178141 859556817 /nfs/dbraw/zinc/55/68/17/859556817.db2.gz RRNOPDBYUXYIJX-OAQYLSRUSA-N 2 0 421.585 4.319 20 0 HIADRP C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000434897597 860542111 /nfs/dbraw/zinc/54/21/11/860542111.db2.gz XAFHRNJJXBRJNR-CVDCTZTESA-N 2 0 409.599 4.052 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)c1 ZINC000467748235 881552828 /nfs/dbraw/zinc/55/28/28/881552828.db2.gz VIBHSDQSHSULBP-DNQXCXABSA-N 2 0 416.009 4.342 20 0 HIADRP Cc1ccc(NC(=O)N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)c(OCC[NH+](C)C)c1 ZINC000438305716 863786712 /nfs/dbraw/zinc/78/67/12/863786712.db2.gz MOFFNGSXMZTJIZ-OAQYLSRUSA-N 2 0 424.589 4.064 20 0 HIADRP CN(C(=O)NC[C@@H]1CCC[N@@H+]1C1CCCCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000438324714 863803419 /nfs/dbraw/zinc/80/34/19/863803419.db2.gz FQZASAVYJURLEF-DEOSSOPVSA-N 2 0 412.622 4.090 20 0 HIADRP C[NH+](C)[C@H](CNc1cncc(NC[C@@H](c2cccs2)[NH+](C)C)n1)c1cccs1 ZINC000439132537 864566941 /nfs/dbraw/zinc/56/69/41/864566941.db2.gz OYQIGZSGJPFBRZ-IYBDPMFKSA-N 2 0 416.620 4.029 20 0 HIADRP CSc1ccc([C@@H](C)[NH2+]CC(=O)Nc2cccc(C[NH+]3CCSCC3)c2)cc1 ZINC000439483535 864847821 /nfs/dbraw/zinc/84/78/21/864847821.db2.gz LBCBGISRXNSSOP-QGZVFWFLSA-N 2 0 415.628 4.247 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCCN(c2cccc(F)c2)C1=O ZINC000439599149 864919677 /nfs/dbraw/zinc/91/96/77/864919677.db2.gz ROFJLVWSAFXBML-XMMPIXPASA-N 2 0 421.516 4.336 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)Nc1c(F)cccc1F ZINC000439597276 864921309 /nfs/dbraw/zinc/92/13/09/864921309.db2.gz NRKBGHHMIJULRY-INIZCTEOSA-N 2 0 413.468 4.307 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N1CCc2sccc2C1 ZINC000439600190 864923812 /nfs/dbraw/zinc/92/38/12/864923812.db2.gz YAMRNSDSAPXXTN-GOSISDBHSA-N 2 0 423.582 4.036 20 0 HIADRP Cc1ccc(F)cc1NC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000439608688 864930184 /nfs/dbraw/zinc/93/01/84/864930184.db2.gz BABPMSYVXKQKFH-GOSISDBHSA-N 2 0 409.505 4.476 20 0 HIADRP CC(C)C[C@@H](CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)[NH2+][C@H](C)c1ccccc1 ZINC000468023420 881858037 /nfs/dbraw/zinc/85/80/37/881858037.db2.gz AYZQBBGSFORPGM-CMTKHCJTSA-N 2 0 400.611 4.066 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+]CC2(N(C)C)CCOCC2)c2ccc(F)cc2)CC1 ZINC000468053767 881878188 /nfs/dbraw/zinc/87/81/88/881878188.db2.gz VVFDQPLQOFMPID-QHCPKHFHSA-N 2 0 405.602 4.079 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[NH+]1Cc1ccccc1 ZINC000440528059 865804844 /nfs/dbraw/zinc/80/48/44/865804844.db2.gz ATZBWVVLYCNPQD-LOSJGSFVSA-N 2 0 405.586 4.022 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)[C@@H](C)C1 ZINC000440688524 865867042 /nfs/dbraw/zinc/86/70/42/865867042.db2.gz AGAJNZKMZCMLRI-WVADOKLZSA-N 2 0 410.602 4.124 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2CCCCOc1cccc(C(F)(F)F)c1 ZINC000441267001 866342217 /nfs/dbraw/zinc/34/22/17/866342217.db2.gz OQWCXGSBISFRCC-RLLQIKCJSA-N 2 0 400.485 4.048 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NCc1cccc(C[NH+](C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000468175694 882053833 /nfs/dbraw/zinc/05/38/33/882053833.db2.gz XRKZOZMFZRPFQS-OAQYLSRUSA-N 2 0 421.507 4.466 20 0 HIADRP C[C@@H](c1nc(-c2ccc(N3CCC[NH+](C)CC3)c(Cl)c2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000443199356 867871104 /nfs/dbraw/zinc/87/11/04/867871104.db2.gz DHVXCVCHGNLUKW-BBWFWOEESA-N 2 0 417.985 4.466 20 0 HIADRP C[C@@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)NCCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000443693039 868293556 /nfs/dbraw/zinc/29/35/56/868293556.db2.gz LLTCJDVIYLBTRS-RCZVLFRGSA-N 2 0 422.617 4.061 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2ccc(-c3ccsc3)cc2)CC1 ZINC000444598954 868896880 /nfs/dbraw/zinc/89/68/80/868896880.db2.gz RKIGCDYWZTXSNB-UHFFFAOYSA-N 2 0 413.631 4.475 20 0 HIADRP O=C(C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000445987012 869951430 /nfs/dbraw/zinc/95/14/30/869951430.db2.gz AIQOVFVSMBGHAR-DHIUTWEWSA-N 2 0 409.599 4.100 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000446756277 870667898 /nfs/dbraw/zinc/66/78/98/870667898.db2.gz GKHDNOGEHIKTKU-LIRRHRJNSA-N 2 0 414.819 4.169 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccc(Br)cc1Cl)C1CC1 ZINC000446820312 870734700 /nfs/dbraw/zinc/73/47/00/870734700.db2.gz BGLCYVLGKDTURV-QFBILLFUSA-N 2 0 415.803 4.380 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(Br)cc1F ZINC000446832146 870747724 /nfs/dbraw/zinc/74/77/24/870747724.db2.gz MNTCVRCEPOYVPP-OAHLLOKOSA-N 2 0 421.354 4.396 20 0 HIADRP Brc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1Br ZINC000446882575 870803737 /nfs/dbraw/zinc/80/37/37/870803737.db2.gz ANCBWUDKUDJTBA-UHFFFAOYSA-N 2 0 402.174 4.176 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)N(CC[NH+](C)C)Cc2ccco2)CCCC1)c1ccccc1 ZINC000447414666 871321469 /nfs/dbraw/zinc/32/14/69/871321469.db2.gz WACHEFYZUFAPEG-FQEVSTJZSA-N 2 0 412.578 4.016 20 0 HIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](NC[C@@H]2C[NH+](Cc4ccccc4)CCCO2)C3)cc1 ZINC000447595500 871499606 /nfs/dbraw/zinc/49/96/06/871499606.db2.gz NYNXLSNGXVXRKC-HVWQDESWSA-N 2 0 419.613 4.063 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)N3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2)C1 ZINC000448216633 872121806 /nfs/dbraw/zinc/12/18/06/872121806.db2.gz FFCBSIORTQXZRF-JHMXWDHMSA-N 2 0 424.633 4.077 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@H](C)C3)cc2)[C@@H](C)C1 ZINC000448462625 872427991 /nfs/dbraw/zinc/42/79/91/872427991.db2.gz VPJOABIXFURGEH-XARGGIHNSA-N 2 0 414.638 4.036 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)[C@@H](C)C1 ZINC000448464029 872431770 /nfs/dbraw/zinc/43/17/70/872431770.db2.gz BZFHXKKQSRSFQX-NBGIEHNGSA-N 2 0 422.617 4.287 20 0 HIADRP C[NH+](C)CC1(C(=O)NC[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)c(F)c2)CCCCC1 ZINC000460110384 872575734 /nfs/dbraw/zinc/57/57/34/872575734.db2.gz DQDLIFQNQCTVMX-XLIONFOSSA-N 2 0 409.977 4.100 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2Cc3ccc(Cl)cc3C2)c1)C1CCOCC1 ZINC000462031118 875146882 /nfs/dbraw/zinc/14/68/82/875146882.db2.gz CUEWHMXNXLVWDU-QFIPXVFZSA-N 2 0 414.977 4.087 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000462166207 875263475 /nfs/dbraw/zinc/26/34/75/875263475.db2.gz FAYRDBDQJNPWIQ-TYBLODHISA-N 2 0 420.601 4.032 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2ccc(C3CCCC3)cc2)cc1 ZINC000462798982 875847066 /nfs/dbraw/zinc/84/70/66/875847066.db2.gz UXIYZOBOOXBHSK-UHFFFAOYSA-N 2 0 405.586 4.460 20 0 HIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000462895296 875921003 /nfs/dbraw/zinc/92/10/03/875921003.db2.gz LHOQJCPOWOZCKC-IBGZPJMESA-N 2 0 405.590 4.161 20 0 HIADRP Clc1ccc(CN2CCC([NH2+]C[C@@H]3CC[N@H+](CCc4ccccc4)C3)CC2)cc1 ZINC000463113398 876153413 /nfs/dbraw/zinc/15/34/13/876153413.db2.gz CFRSEJDHPRGDOS-QHCPKHFHSA-N 2 0 412.021 4.459 20 0 HIADRP COc1ccccc1[C@H](CN[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[NH+]1CCCC1 ZINC000463136382 876184705 /nfs/dbraw/zinc/18/47/05/876184705.db2.gz DJMDGDSBGUFQEW-VTZPFEBOSA-N 2 0 407.602 4.475 20 0 HIADRP COc1cccc([C@@H](CNC2CC[NH+](CCc3ccccc3)CC2)[NH+]2CCCC2)c1 ZINC000463140578 876191934 /nfs/dbraw/zinc/19/19/34/876191934.db2.gz LOXCOOHPMXZQJE-AREMUKBSSA-N 2 0 407.602 4.129 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[C@@H]1CCCC[NH+]1C/C=C/C[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000463190377 876249565 /nfs/dbraw/zinc/24/95/65/876249565.db2.gz CUDPAKWBTVRFOH-YYHRIEBCSA-N 2 0 418.666 4.354 20 0 HIADRP O=C(c1ccccc1Cl)N1CCC([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000463242349 876298242 /nfs/dbraw/zinc/29/82/42/876298242.db2.gz HHOJLIUBPWRXQA-FQEVSTJZSA-N 2 0 411.977 4.056 20 0 HIADRP O=C(C[N@H+](C1CC1)[C@H]1CCCC[C@@H]1C1CCCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000464735493 877971491 /nfs/dbraw/zinc/97/14/91/877971491.db2.gz UBCWHLJZFAFDCU-RPWUZVMVSA-N 2 0 401.639 4.333 20 0 HIADRP O=C(C[N@H+](C1CC1)[C@@H]1CCCC[C@@H]1C1CCCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000464735492 877972316 /nfs/dbraw/zinc/97/23/16/877972316.db2.gz UBCWHLJZFAFDCU-DNQXCXABSA-N 2 0 401.639 4.333 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCC[NH+](C)C1CCCCC1 ZINC000465541042 879001965 /nfs/dbraw/zinc/00/19/65/879001965.db2.gz IYQIXDXTJMUBLM-QHCPKHFHSA-N 2 0 414.638 4.195 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N(C)CC[C@@H]2CCCC[NH+]2C)cc1 ZINC000465557860 879027196 /nfs/dbraw/zinc/02/71/96/879027196.db2.gz KDLIOMVNAYQEMC-REWPJTCUSA-N 2 0 400.611 4.077 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N(C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000465573000 879049061 /nfs/dbraw/zinc/04/90/61/879049061.db2.gz NWMZLJYVPDEHNH-HSZRJFAPSA-N 2 0 422.617 4.190 20 0 HIADRP C[NH+](C)C1(CNC(=O)NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)CCCCCC1 ZINC000465622996 879129252 /nfs/dbraw/zinc/12/92/52/879129252.db2.gz CGXHJVRVHTYFPL-UYAOXDASSA-N 2 0 406.640 4.085 20 0 HIADRP CC[NH+]1CCC(CCNC(=O)NCc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000465706658 879271458 /nfs/dbraw/zinc/27/14/58/879271458.db2.gz BWHNESXXUOKWHZ-UHFFFAOYSA-N 2 0 414.638 4.372 20 0 HIADRP CN(C)[C@@H](CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccccc1Cl ZINC000503437327 912446760 /nfs/dbraw/zinc/44/67/60/912446760.db2.gz PVASSMBMBXKZES-KNQAVFIVSA-N 2 0 421.029 4.240 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)[NH+](C)C)cc1 ZINC000465811485 879430911 /nfs/dbraw/zinc/43/09/11/879430911.db2.gz JNMUTRLJBFCCOS-RZUBCFFCSA-N 2 0 414.619 4.042 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H](C)c2cc3ccccc3o2)CC1 ZINC000467279583 881025667 /nfs/dbraw/zinc/02/56/67/881025667.db2.gz RWTOVRIVOUJNMQ-IBGZPJMESA-N 2 0 405.542 4.173 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)Nc2cccc3c2OCC[C@@H]3[NH+](C)C)cc1 ZINC000469319088 883423519 /nfs/dbraw/zinc/42/35/19/883423519.db2.gz YTAOPQBJPKYJEF-QFIPXVFZSA-N 2 0 411.546 4.045 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CCN(C(=O)[C@H]2CCCC[NH+]2Cc2ccccc2)CC1 ZINC000469367050 883490897 /nfs/dbraw/zinc/49/08/97/883490897.db2.gz IIKJRHOYEIUBDR-AREMUKBSSA-N 2 0 419.613 4.412 20 0 HIADRP C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NC[C@@H]1CCC[NH+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000469538988 883806166 /nfs/dbraw/zinc/80/61/66/883806166.db2.gz AVLKCVZNCINSRY-ONFYXGJMSA-N 2 0 411.512 4.077 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](NCc2ccc(Br)c(Cl)c2)[C@@H](C)C1 ZINC000469765943 883936199 /nfs/dbraw/zinc/93/61/99/883936199.db2.gz CUNQDNOCAPPVSN-KSSFIOAISA-N 2 0 403.792 4.329 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000469843785 884026297 /nfs/dbraw/zinc/02/62/97/884026297.db2.gz VWRSPTGYXMSIKV-CJFMBICVSA-N 2 0 414.553 4.372 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)c1ccccc1 ZINC000503690510 912794367 /nfs/dbraw/zinc/79/43/67/912794367.db2.gz PJFUWUMXCXBHGW-VXKWHMMOSA-N 2 0 414.638 4.269 20 0 HIADRP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CCCC[NH+]1Cc1ccccc1 ZINC000470543690 884950705 /nfs/dbraw/zinc/95/07/05/884950705.db2.gz OCXQAJGHDIPCCN-DQEYMECFSA-N 2 0 405.586 4.022 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N1CC[C@@H](C[N@H+](C)CC2CC2)C1)c1ccccc1Cl ZINC000470735968 885191973 /nfs/dbraw/zinc/19/19/73/885191973.db2.gz HTWPMAIWDSPIPZ-UGKGYDQZSA-N 2 0 421.029 4.096 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N(C)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470744258 885207988 /nfs/dbraw/zinc/20/79/88/885207988.db2.gz FWPJHULLZGMDCB-VWLOTQADSA-N 2 0 422.617 4.334 20 0 HIADRP C[C@H](CCNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1 ZINC000473019687 887845751 /nfs/dbraw/zinc/84/57/51/887845751.db2.gz HJXWLOIICVZWLZ-RDGATRHJSA-N 2 0 422.617 4.061 20 0 HIADRP Cc1csc(NC2CC[NH+](Cc3ccccc3N(C)C3CC[NH+](C)CC3)CC2)n1 ZINC000473071450 887890278 /nfs/dbraw/zinc/89/02/78/887890278.db2.gz IBMRTOQJQLRFPD-UHFFFAOYSA-N 2 0 413.635 4.058 20 0 HIADRP CCN(C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473886808 888755457 /nfs/dbraw/zinc/75/54/57/888755457.db2.gz NVKVBDQTFNMYSV-NQIIRXRSSA-N 2 0 400.611 4.163 20 0 HIADRP CCN(C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473886807 888756386 /nfs/dbraw/zinc/75/63/86/888756386.db2.gz NVKVBDQTFNMYSV-GHTZIAJQSA-N 2 0 400.611 4.163 20 0 HIADRP CCN(C(=O)NCc1cccc(C[NH+](C)C)c1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473943889 888820314 /nfs/dbraw/zinc/82/03/14/888820314.db2.gz IVQQYCYQBWCORH-GBXCKJPGSA-N 2 0 408.590 4.115 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)N(CC)[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)CC1 ZINC000474011004 888867602 /nfs/dbraw/zinc/86/76/02/888867602.db2.gz OIWUKUJUWNQTTR-REWPJTCUSA-N 2 0 400.611 4.118 20 0 HIADRP C[C@@H](CCc1ccc(I)cc1)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000474606254 889473805 /nfs/dbraw/zinc/47/38/05/889473805.db2.gz SRQYTCWBNSEDRG-HNNXBMFYSA-N 2 0 412.359 4.219 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000474815447 889667343 /nfs/dbraw/zinc/66/73/43/889667343.db2.gz YNMKRVGKAHLPMF-DLBZAZTESA-N 2 0 416.635 4.005 20 0 HIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2ccc(Cl)cc2-n2cncn2)C[N@@H+]1Cc1ccccc1 ZINC000474874316 889727730 /nfs/dbraw/zinc/72/77/30/889727730.db2.gz AASYCWRUNTWPHX-QUCCMNQESA-N 2 0 409.965 4.311 20 0 HIADRP CC(C)Sc1cccc(Cl)c1C[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000474889623 889747483 /nfs/dbraw/zinc/74/74/83/889747483.db2.gz TUQMMIHCASJZMT-UHFFFAOYSA-N 2 0 420.022 4.422 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccsc1 ZINC000475138817 890005144 /nfs/dbraw/zinc/00/51/44/890005144.db2.gz NECSYPLCVVSVIX-OAQYLSRUSA-N 2 0 406.640 4.227 20 0 HIADRP COc1ccc(Cn2nc(C)c(C[NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)c2C)cc1 ZINC000475225484 890095932 /nfs/dbraw/zinc/09/59/32/890095932.db2.gz SRFMHNWIYIAPPE-XMMPIXPASA-N 2 0 418.585 4.169 20 0 HIADRP COc1cc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OCc1ccncc1 ZINC000475286095 890184744 /nfs/dbraw/zinc/18/47/44/890184744.db2.gz OWXLBBPDTGGNIX-DEOSSOPVSA-N 2 0 417.553 4.281 20 0 HIADRP C[NH+](C)[C@H](CNc1cc(NC[C@H](c2ccsc2)[NH+](C)C)ncn1)c1ccsc1 ZINC000475451940 890367428 /nfs/dbraw/zinc/36/74/28/890367428.db2.gz LFWJLYHKHIUMFJ-QZTJIDSGSA-N 2 0 416.620 4.029 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000476008852 890937245 /nfs/dbraw/zinc/93/72/45/890937245.db2.gz RJHRLLBWVQZSBY-IBGZPJMESA-N 2 0 400.611 4.212 20 0 HIADRP CC[NH+](CC)CCN(Cc1cccs1)C(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000476013859 890944368 /nfs/dbraw/zinc/94/43/68/890944368.db2.gz UNXILAYFGQSXOX-UHFFFAOYSA-N 2 0 420.667 4.399 20 0 HIADRP CC1(C)C[C@@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c2cc(Br)ccc21 ZINC000479062823 894324035 /nfs/dbraw/zinc/32/40/35/894324035.db2.gz OPZHMPMRTZKZQN-FOIQADDNSA-N 2 0 407.396 4.262 20 0 HIADRP c1c2c(nn1-c1ccccc1)CCC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000479064567 894325714 /nfs/dbraw/zinc/32/57/14/894325714.db2.gz RXWNXOJDLJVUQX-WIOPSUGQSA-N 2 0 400.570 4.404 20 0 HIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(Br)cc1C(F)(F)F)CN1CC[NH+](C)CC1 ZINC000479276585 894552383 /nfs/dbraw/zinc/55/23/83/894552383.db2.gz XPPJUXUAKRCDHO-KBPBESRZSA-N 2 0 422.333 4.002 20 0 HIADRP COc1cc2c(cc1OC)[C@H]([NH2+]Cc1ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc1)CC2 ZINC000479360653 894660475 /nfs/dbraw/zinc/66/04/75/894660475.db2.gz MRZLVVXORPHWBI-IUKKYPGJSA-N 2 0 410.558 4.090 20 0 HIADRP CCS(=O)(=O)c1c(Cl)cccc1CNCc1ccccc1C[N@H+](C)C(C)C ZINC000479565560 894861705 /nfs/dbraw/zinc/86/17/05/894861705.db2.gz KSCDTAJLMUAJGN-UHFFFAOYSA-N 2 0 408.995 4.264 20 0 HIADRP COc1ccccc1[C@H](CN[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)[NH+]1CCCC1 ZINC000479877817 895221025 /nfs/dbraw/zinc/22/10/25/895221025.db2.gz YTKKRCFLCMKOHE-ZODMCCGTSA-N 2 0 407.602 4.332 20 0 HIADRP COc1ccccc1[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)[NH+]1CCCC1 ZINC000479877649 895221170 /nfs/dbraw/zinc/22/11/70/895221170.db2.gz YTKKRCFLCMKOHE-GPUOULLFSA-N 2 0 407.602 4.332 20 0 HIADRP COc1ccc([C@H](CN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)[NH+]2CCCC2)cc1 ZINC000480086226 895446263 /nfs/dbraw/zinc/44/62/63/895446263.db2.gz AHAXIZBDSIWHFL-BYXVTNLJSA-N 2 0 407.602 4.332 20 0 HIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc(NS(=O)(=O)CC)cc2)cc1 ZINC000480143134 895522623 /nfs/dbraw/zinc/52/26/23/895522623.db2.gz QOUSSSXCLXCELU-GOSISDBHSA-N 2 0 403.592 4.141 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc1)CCCO2 ZINC000480241887 895652325 /nfs/dbraw/zinc/65/23/25/895652325.db2.gz QQJCKUBKMOBFOG-YDIMBITNSA-N 2 0 410.558 4.308 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(-c4cccc(F)c4F)o3)cc2)CC1 ZINC000480364899 895771789 /nfs/dbraw/zinc/77/17/89/895771789.db2.gz NXPYSLVXMCUFQF-UHFFFAOYSA-N 2 0 412.480 4.471 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000480447541 895836626 /nfs/dbraw/zinc/83/66/26/895836626.db2.gz SPXRXOQHTFYUCP-XMMPIXPASA-N 2 0 423.601 4.380 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1)N1CC[NH+](C)CC1 ZINC000480553026 895913098 /nfs/dbraw/zinc/91/30/98/895913098.db2.gz LOCVTRGVZBAGIT-CPJSRVTESA-N 2 0 413.581 4.327 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000480612360 895978694 /nfs/dbraw/zinc/97/86/94/895978694.db2.gz LQCYVTJIFXSIQP-XLGIIRLISA-N 2 0 406.618 4.456 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000480617773 895983445 /nfs/dbraw/zinc/98/34/45/895983445.db2.gz VVIJKNZVFOJGHS-RBUKOAKNSA-N 2 0 415.603 4.141 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(-c4cccc(F)c4F)o3)cc2)CC1 ZINC000480633992 896004500 /nfs/dbraw/zinc/00/45/00/896004500.db2.gz HHDOQXHNCPJRRW-UHFFFAOYSA-N 2 0 411.496 4.262 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480699771 896059959 /nfs/dbraw/zinc/05/99/59/896059959.db2.gz BBDANRJCEVWONQ-GOSISDBHSA-N 2 0 409.574 4.488 20 0 HIADRP Cc1ccc(OCCCC(=O)Nc2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@H](C)C3)cc2)cc1 ZINC000480708235 896070681 /nfs/dbraw/zinc/07/06/81/896070681.db2.gz IKRXTEBKNJUQKC-OFNKIYASSA-N 2 0 409.574 4.365 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]C2CCN(Cc3ccccn3)CC2)C1 ZINC000480718380 896079351 /nfs/dbraw/zinc/07/93/51/896079351.db2.gz OBSRZIUBOHISLZ-SZPZYZBQSA-N 2 0 406.618 4.314 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480721283 896081714 /nfs/dbraw/zinc/08/17/14/896081714.db2.gz LUDCJTOLLQBMQE-MSOLQXFVSA-N 2 0 410.562 4.323 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cc(Cl)ccc3OC(F)F)cn2)CC1 ZINC000480733350 896093445 /nfs/dbraw/zinc/09/34/45/896093445.db2.gz SVEVMKLWUFSPSD-OAHLLOKOSA-N 2 0 424.923 4.329 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4c3ccc(Cl)c4Cl)cn2)CC1 ZINC000480742840 896105983 /nfs/dbraw/zinc/10/59/83/896105983.db2.gz YASNHWVYBBPEDS-LJQANCHMSA-N 2 0 405.373 4.307 20 0 HIADRP C[C@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000480749887 896111410 /nfs/dbraw/zinc/11/14/10/896111410.db2.gz QJOWJSLZZYWBCG-CVEARBPZSA-N 2 0 403.364 4.444 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)CC1 ZINC000480761357 896122262 /nfs/dbraw/zinc/12/22/62/896122262.db2.gz SIOUMUFDZXAROJ-KRWDZBQOSA-N 2 0 404.599 4.326 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccncc2)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000480915789 896274448 /nfs/dbraw/zinc/27/44/48/896274448.db2.gz XXBXKMCBSFXCTE-LJQANCHMSA-N 2 0 418.541 4.125 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CCSc4c(Cl)cccc43)cc2)CC1 ZINC000480921632 896278279 /nfs/dbraw/zinc/27/82/79/896278279.db2.gz RXYFQINEXFRKBP-OAQYLSRUSA-N 2 0 402.007 4.414 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000481242020 896591770 /nfs/dbraw/zinc/59/17/70/896591770.db2.gz MNQHOQSPCZYYGO-RUZDIDTESA-N 2 0 400.570 4.297 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCCc3nc(C)sc32)cc1OC ZINC000481312345 896660407 /nfs/dbraw/zinc/66/04/07/896660407.db2.gz XHFDMDSICQICNK-GOSISDBHSA-N 2 0 403.592 4.348 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Cn3cnc4ccccc43)cc2)[C@H](C)C1 ZINC000481733152 897127727 /nfs/dbraw/zinc/12/77/27/897127727.db2.gz GUVNHFHQHAOVIF-QPPBQGQZSA-N 2 0 420.601 4.311 20 0 HIADRP C[NH+](C)[C@]1(CNC(=O)Nc2ccccc2C[N@@H+](C)C2CCCCC2)CCSC1 ZINC000481791002 897172853 /nfs/dbraw/zinc/17/28/53/897172853.db2.gz VBUHGKGQTMQCNN-QFIPXVFZSA-N 2 0 404.624 4.010 20 0 HIADRP COCCC[NH+]1CCC([NH2+][C@H](C)c2cccc(OCc3cn4ccccc4n3)c2)CC1 ZINC000481912007 897294816 /nfs/dbraw/zinc/29/48/16/897294816.db2.gz HWQPRUZAMAOLPR-HXUWFJFHSA-N 2 0 422.573 4.065 20 0 HIADRP COCCC[NH+]1CCC([NH2+][C@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)CC1 ZINC000481938637 897324643 /nfs/dbraw/zinc/32/46/43/897324643.db2.gz GQPMDFXJWHSJRK-XMMPIXPASA-N 2 0 400.538 4.209 20 0 HIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CC3CC[NH+](CCN(C)C)CC3)s2)cc1 ZINC000482354782 897869151 /nfs/dbraw/zinc/86/91/51/897869151.db2.gz YXZKVJANMBDPQH-QGZVFWFLSA-N 2 0 416.635 4.051 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)[C@@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000482504035 898086741 /nfs/dbraw/zinc/08/67/41/898086741.db2.gz MPDTWFVNUOSLHL-BRWVUGGUSA-N 2 0 402.410 4.012 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2ccc3ccccc3c2OC(F)F)CC1 ZINC000482513720 898100179 /nfs/dbraw/zinc/10/01/79/898100179.db2.gz SLMHRBPYWQTWRK-ZWKOTPCHSA-N 2 0 405.533 4.365 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(-n2cccn2)cc1 ZINC000482542729 898131521 /nfs/dbraw/zinc/13/15/21/898131521.db2.gz YQQFFRUBAAGWQU-RTBURBONSA-N 2 0 407.537 4.175 20 0 HIADRP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1ccc(-c2ccccc2Cl)s1 ZINC000482547657 898136506 /nfs/dbraw/zinc/13/65/06/898136506.db2.gz CMJSPWATHZERFB-JKSUJKDBSA-N 2 0 405.995 4.307 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000482567418 898162492 /nfs/dbraw/zinc/16/24/92/898162492.db2.gz VHGUTRZOIDRRHJ-QGZVFWFLSA-N 2 0 422.491 4.435 20 0 HIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000482634367 898239191 /nfs/dbraw/zinc/23/91/91/898239191.db2.gz SLCVHXUWGURGRC-WMZHIEFXSA-N 2 0 409.574 4.022 20 0 HIADRP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000482645552 898250510 /nfs/dbraw/zinc/25/05/10/898250510.db2.gz ZBMHPVXQEDJCHA-OXJNMPFZSA-N 2 0 414.619 4.123 20 0 HIADRP COc1ccc2oc(C[NH2+]Cc3cccc(OCC[N@H+](C)C4CCOCC4)c3)cc2c1 ZINC000482648769 898253525 /nfs/dbraw/zinc/25/35/25/898253525.db2.gz MGEPOOFAIZBESK-UHFFFAOYSA-N 2 0 424.541 4.221 20 0 HIADRP COc1ccccc1OC[C@H](C)C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000482706716 898307393 /nfs/dbraw/zinc/30/73/93/898307393.db2.gz PAKPGFKIBHKAPX-HXUWFJFHSA-N 2 0 411.590 4.030 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000482886227 898501605 /nfs/dbraw/zinc/50/16/05/898501605.db2.gz IMRUZZFKVFVFCI-QPPBQGQZSA-N 2 0 405.586 4.240 20 0 HIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482886833 898503215 /nfs/dbraw/zinc/50/32/15/898503215.db2.gz JMYZKVULEUWKBU-QLKXDWOZSA-N 3 0 407.602 4.473 20 0 HIADRP CC[NH+](CC)CCOc1cc(NC(=O)[C@@H]2CC[N@@H+](C3CCCCC3)C2)ccc1OC ZINC000483198301 898853676 /nfs/dbraw/zinc/85/36/76/898853676.db2.gz LJQOZEHHPCKQFX-LJQANCHMSA-N 2 0 417.594 4.009 20 0 HIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000483202144 898855732 /nfs/dbraw/zinc/85/57/32/898855732.db2.gz QTARVAVJGBPWDH-NRSPTQNISA-N 2 0 415.528 4.367 20 0 HIADRP Cc1ccc(C[NH+]2CCSCC2)cc1NC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000483208856 898859360 /nfs/dbraw/zinc/85/93/60/898859360.db2.gz AFVOBWMDLNLVRG-HXUWFJFHSA-N 2 0 401.620 4.137 20 0 HIADRP Cc1c([C@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cnn1-c1cc(C)ccc1C ZINC000483536045 899198500 /nfs/dbraw/zinc/19/85/00/899198500.db2.gz AYKVKIJRPGSDOR-QFIPXVFZSA-N 2 0 423.649 4.398 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)(N2CCCCC2)CC1 ZINC000483543435 899204948 /nfs/dbraw/zinc/20/49/48/899204948.db2.gz LZPUKRSOORZHRK-HXUWFJFHSA-N 2 0 411.512 4.112 20 0 HIADRP O=C([C@@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000483603885 899254116 /nfs/dbraw/zinc/25/41/16/899254116.db2.gz FVLSTDWREIBWLZ-OYRHQHFDSA-N 2 0 409.618 4.154 20 0 HIADRP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2C[C@@H](C)C[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000483635733 899289412 /nfs/dbraw/zinc/28/94/12/899289412.db2.gz LFYVJMWCTQGDQV-JXFKEZNVSA-N 2 0 411.512 4.077 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C[C@@H]1C ZINC000483691491 899349001 /nfs/dbraw/zinc/34/90/01/899349001.db2.gz JQXSMJDRXHSZOV-GBXCKJPGSA-N 2 0 422.617 4.429 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NC3CC[NH+](C4CCCC4)CC3)cc2)CC1 ZINC000483693621 899350505 /nfs/dbraw/zinc/35/05/05/899350505.db2.gz QDFBUXQEBLYSRT-UHFFFAOYSA-N 2 0 412.622 4.125 20 0 HIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2nnn(-c3cccc(Br)c3)c2C)CC1 ZINC000483735302 899396298 /nfs/dbraw/zinc/39/62/98/899396298.db2.gz QJSQWVGWUBDBFX-OAHLLOKOSA-N 2 0 420.399 4.111 20 0 HIADRP Cc1nc2c(s1)[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)CCC2 ZINC000483739984 899401981 /nfs/dbraw/zinc/40/19/81/899401981.db2.gz HAYUWRQPROCEJU-QGZVFWFLSA-N 2 0 424.536 4.389 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)NC1CC[NH+](C2CCCC2)CC1 ZINC000483755657 899416897 /nfs/dbraw/zinc/41/68/97/899416897.db2.gz JUUNWJKYBMUBPO-UHFFFAOYSA-N 2 0 412.622 4.269 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H](CO)Cc1c(F)cccc1Cl ZINC000483803687 899478424 /nfs/dbraw/zinc/47/84/24/899478424.db2.gz FYVRIEWBOHPBBK-BOCKYXSRSA-N 2 0 404.957 4.130 20 0 HIADRP CC[C@@H]1Oc2cc([C@@H](C)[NH2+][C@H](C)c3cccc(OCC[NH+](C)C)c3)ccc2NC1=O ZINC000483866327 899547532 /nfs/dbraw/zinc/54/75/32/899547532.db2.gz SDXDKCKTEICYEO-YVHKJVDXSA-N 2 0 411.546 4.148 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(Cl)ccc1Cl ZINC000484273761 899845232 /nfs/dbraw/zinc/84/52/32/899845232.db2.gz BWSGOECSDSYSHK-AWEZNQCLSA-N 2 0 400.394 4.271 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(Cl)cc1Cl ZINC000484302685 899863902 /nfs/dbraw/zinc/86/39/02/899863902.db2.gz QPFDPXYMHOLLML-AWEZNQCLSA-N 2 0 400.394 4.271 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1cccc(Br)c1 ZINC000484468154 899962253 /nfs/dbraw/zinc/96/22/53/899962253.db2.gz BCMSTYCDSVBPIU-MRXNPFEDSA-N 2 0 403.364 4.257 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000484480108 899973269 /nfs/dbraw/zinc/97/32/69/899973269.db2.gz KUDFOSALYGDCGX-INIZCTEOSA-N 2 0 408.464 4.393 20 0 HIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c1 ZINC000484486476 899978732 /nfs/dbraw/zinc/97/87/32/899978732.db2.gz LHNXQLHFTPQTTO-QGZVFWFLSA-N 2 0 404.501 4.404 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000484490231 899981652 /nfs/dbraw/zinc/98/16/52/899981652.db2.gz XHTIPJSYAPULFK-FXAWDEMLSA-N 2 0 415.965 4.177 20 0 HIADRP Cc1ccc(C[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@H]2C)c(OCC(F)(F)F)c1 ZINC000484646402 900091455 /nfs/dbraw/zinc/09/14/55/900091455.db2.gz XSYOHWZEURKNKE-YLJYHZDGSA-N 2 0 407.480 4.331 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@@H]4CCO[C@@]5(CCSC5)C4)[C@@H]3C2)cc1 ZINC000485258679 900543488 /nfs/dbraw/zinc/54/34/88/900543488.db2.gz HEVVBLAKLTWKMZ-JTKSJCOOSA-N 2 0 400.632 4.322 20 0 HIADRP COc1cccc(NC(=O)CC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000485300778 900578907 /nfs/dbraw/zinc/57/89/07/900578907.db2.gz FRUOGLQTTBBIFU-QPPBQGQZSA-N 2 0 407.558 4.010 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C)C1)C1CCCCC1 ZINC000485614848 900872203 /nfs/dbraw/zinc/87/22/03/900872203.db2.gz OSCMXJNVCBVYEP-LADGPHEKSA-N 2 0 412.622 4.077 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2ncsc2c1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000485837060 901082915 /nfs/dbraw/zinc/08/29/15/901082915.db2.gz ZMWZFUSCFUMNFG-ZWKOTPCHSA-N 2 0 422.598 4.116 20 0 HIADRP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCC(c2ccsc2)CC1 ZINC000485984946 901203057 /nfs/dbraw/zinc/20/30/57/901203057.db2.gz AXTDWJCSPWJEBI-IBGZPJMESA-N 2 0 411.615 4.097 20 0 HIADRP CCOc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)cc1F ZINC000487294787 902138919 /nfs/dbraw/zinc/13/89/19/902138919.db2.gz BUSYFKHBUSVXEF-KRWDZBQOSA-N 2 0 403.517 4.356 20 0 HIADRP CCOc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)cc1F ZINC000487294797 902139058 /nfs/dbraw/zinc/13/90/58/902139058.db2.gz BUSYFKHBUSVXEF-QGZVFWFLSA-N 2 0 403.517 4.356 20 0 HIADRP CC[C@H](c1ccc(F)cc1F)[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000487980692 902502058 /nfs/dbraw/zinc/50/20/58/902502058.db2.gz UYEOZKLCVVMEOQ-JOCHJYFZSA-N 2 0 407.549 4.120 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CS[C@@H](C(C)(C)C)C2)c1)C1CCOCC1 ZINC000488443350 902828664 /nfs/dbraw/zinc/82/86/64/902828664.db2.gz URTKWPPVKNQCBG-DENIHFKCSA-N 2 0 406.636 4.186 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489312375 903324553 /nfs/dbraw/zinc/32/45/53/903324553.db2.gz GCIOKPGUSRPEBK-NHCUHLMSSA-N 2 0 414.638 4.049 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000489539831 903451270 /nfs/dbraw/zinc/45/12/70/903451270.db2.gz SHOAJPNFBBXFIH-HXUWFJFHSA-N 2 0 408.590 4.080 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCOc4c(Cl)cc(C)cc43)cn2)CC1 ZINC000489606104 903495445 /nfs/dbraw/zinc/49/54/45/903495445.db2.gz CLHWWNMDPVGKBS-OAQYLSRUSA-N 2 0 414.981 4.189 20 0 HIADRP C[C@@H](c1ccc(F)cc1)N(C)C(=O)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000489648593 903512852 /nfs/dbraw/zinc/51/28/52/903512852.db2.gz LYJVIOYEXNWUID-FQEVSTJZSA-N 2 0 411.565 4.189 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000489852104 903630996 /nfs/dbraw/zinc/63/09/96/903630996.db2.gz XKXUJBPEEICASA-SQJMNOBHSA-N 2 0 422.617 4.190 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)c1ccccc1 ZINC000489920546 903675887 /nfs/dbraw/zinc/67/58/87/903675887.db2.gz YWLJDFCRHDZGDI-RUZDIDTESA-N 2 0 422.617 4.376 20 0 HIADRP C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506052872 914751883 /nfs/dbraw/zinc/75/18/83/914751883.db2.gz ZYTXMEAMXWPOGD-KRWDZBQOSA-N 2 0 418.969 4.275 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)CC3 ZINC000491010663 904367777 /nfs/dbraw/zinc/36/77/77/904367777.db2.gz UEHIZXUTSNNSOH-NRFANRHFSA-N 2 0 403.570 4.080 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000491015708 904370292 /nfs/dbraw/zinc/37/02/92/904370292.db2.gz ALZDWVCRNIOPHD-MBSDFSHPSA-N 2 0 403.973 4.432 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1 ZINC000491018470 904371924 /nfs/dbraw/zinc/37/19/24/904371924.db2.gz IBECWOYMYDNSQW-IIBYNOLFSA-N 2 0 423.935 4.256 20 0 HIADRP O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000506182101 914836049 /nfs/dbraw/zinc/83/60/49/914836049.db2.gz DHMGYNFLIREFPG-JOCHJYFZSA-N 2 0 416.610 4.104 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000494615625 905864372 /nfs/dbraw/zinc/86/43/72/905864372.db2.gz KQCSLYUVTWSLNI-QHCPKHFHSA-N 2 0 424.589 4.292 20 0 HIADRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)C1 ZINC000494945590 906118400 /nfs/dbraw/zinc/11/84/00/906118400.db2.gz GOHJOHPGTZNLFU-IBGZPJMESA-N 2 0 410.484 4.028 20 0 HIADRP C[C@@H]([NH2+]C1CCC2(CC1)c1ccccc1NC2=O)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495421110 906441342 /nfs/dbraw/zinc/44/13/42/906441342.db2.gz NVBZSWHCZAVWQF-MNDTXZRJSA-N 2 0 403.570 4.319 20 0 HIADRP c1cn(Cc2ccccc2)c(CC[NH2+][C@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000512618656 921263725 /nfs/dbraw/zinc/26/37/25/921263725.db2.gz JMTWMQWDCAKYEF-GSDHBNRESA-N 2 0 414.597 4.364 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]Cc4ccnc(OC5CCOCC5)c4)[C@H]3C2)cc1 ZINC000512621624 921265145 /nfs/dbraw/zinc/26/51/45/921265145.db2.gz ZXBDRGQTTAFCQX-ZKMPZPQNSA-N 2 0 421.585 4.030 20 0 HIADRP OCC[NH+]1CCC(C[NH2+][C@@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)CC1 ZINC000512634528 921268923 /nfs/dbraw/zinc/26/89/23/921268923.db2.gz DCMCXAXURUHYIH-OAQYLSRUSA-N 2 0 410.455 4.228 20 0 HIADRP C[C@H](CNC(=O)[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccccc1 ZINC000497297239 906829407 /nfs/dbraw/zinc/82/94/07/906829407.db2.gz UTEYXTVUXBGJMS-YADHBBJMSA-N 2 0 407.602 4.461 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c2ccccc21 ZINC000512667861 921281586 /nfs/dbraw/zinc/28/15/86/921281586.db2.gz RJLNNFMQFMHKNS-QVQNZMNRSA-N 2 0 403.570 4.375 20 0 HIADRP CC[C@H](c1ccc(Br)cc1)N1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000497491681 906973836 /nfs/dbraw/zinc/97/38/36/906973836.db2.gz GFCQCDHLMAJYLL-JGUMPVPUSA-N 2 0 406.412 4.143 20 0 HIADRP C[C@H](NC(=O)N1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000512694368 921289647 /nfs/dbraw/zinc/28/96/47/921289647.db2.gz OEJGABUWBBERLP-FUPPJEDESA-N 2 0 418.670 4.326 20 0 HIADRP CC[NH+](CC)CCN(Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512693731 921289737 /nfs/dbraw/zinc/28/97/37/921289737.db2.gz KKCHLTGTOCUOMT-FYYLOGMGSA-N 2 0 414.638 4.193 20 0 HIADRP CC[NH+](CC)CCN(Cc1cccs1)C(=O)N[C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512702306 921292633 /nfs/dbraw/zinc/29/26/33/921292633.db2.gz DMQXDUJYRJCXPP-UXHICEINSA-N 2 0 420.667 4.255 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1)c1ccco1 ZINC000497631998 907113588 /nfs/dbraw/zinc/11/35/88/907113588.db2.gz FTLBQQHUWDWVQW-CNNODRBYSA-N 2 0 412.578 4.234 20 0 HIADRP CCCN(C(=O)NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)[C@@H](CC)c1ccccc1 ZINC000498712003 908138690 /nfs/dbraw/zinc/13/86/90/908138690.db2.gz WGKLFDFOONMZOM-DEOSSOPVSA-N 2 0 423.605 4.167 20 0 HIADRP O=c1ccccn1Cc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499150689 908509811 /nfs/dbraw/zinc/50/98/11/908509811.db2.gz JMRJPHJLYOYLRG-PBROBROCSA-N 2 0 413.565 4.182 20 0 HIADRP COc1cc(OC)cc(OCCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499177283 908530019 /nfs/dbraw/zinc/53/00/19/908530019.db2.gz PHMPBRQCPOSESX-DKUWSORSSA-N 2 0 410.558 4.258 20 0 HIADRP COc1cc(OC)c(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(OC)c1 ZINC000499235793 908600154 /nfs/dbraw/zinc/60/01/54/908600154.db2.gz SBGQYHYTFWCBIP-WKCHPHFGSA-N 2 0 410.558 4.040 20 0 HIADRP FC(F)(F)CN1CCC(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499238945 908604060 /nfs/dbraw/zinc/60/40/60/908604060.db2.gz XYYZJELWWVWKBH-KOUNCHBCSA-N 2 0 409.540 4.436 20 0 HIADRP c1csc(N2CCC([NH2+]CCCC[NH+]3CCC(Cc4ccccc4)CC3)CC2)n1 ZINC000513060641 921517580 /nfs/dbraw/zinc/51/75/80/921517580.db2.gz YOLBHFGCHQATIU-UHFFFAOYSA-N 2 0 412.647 4.436 20 0 HIADRP C[C@@H]1CN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)[C@@H](C)C[N@@H+]1Cc1ccccc1 ZINC000500441883 909860752 /nfs/dbraw/zinc/86/07/52/909860752.db2.gz ZKJRKKNMUPHYSG-YADHBBJMSA-N 2 0 405.586 4.020 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccccn1 ZINC000500616057 909966507 /nfs/dbraw/zinc/96/65/07/909966507.db2.gz FWMVJBKITNMEPI-GOSISDBHSA-N 2 0 406.496 4.353 20 0 HIADRP C[NH+](C)CCCC1CCN(C(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC000500777635 910073350 /nfs/dbraw/zinc/07/33/50/910073350.db2.gz JUENAXGMYXUCEK-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP C[C@@H](C(=O)N1CCC[C@H]1c1cccs1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501019870 910239651 /nfs/dbraw/zinc/23/96/51/910239651.db2.gz AYGNYVUEBFXJLA-RXVVDRJESA-N 2 0 412.603 4.044 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1ccccc1 ZINC000501023035 910240630 /nfs/dbraw/zinc/24/06/30/910240630.db2.gz LTSFZAAVJNLJDQ-YADHBBJMSA-N 2 0 414.981 4.079 20 0 HIADRP C[N@@H+](CC(=O)N[C@H](c1cccs1)C(C)(C)C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501028492 910245933 /nfs/dbraw/zinc/24/59/33/910245933.db2.gz ZJBDYNCWXFNADR-JOCHJYFZSA-N 2 0 414.619 4.195 20 0 HIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000501375323 910503146 /nfs/dbraw/zinc/50/31/46/910503146.db2.gz AAFIWILOTSREEV-LGMDPLHJSA-N 2 0 404.480 4.045 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)c1)C1CCOCC1 ZINC000501482776 910597331 /nfs/dbraw/zinc/59/73/31/910597331.db2.gz UPIMCPVSAKDFAE-LADGPHEKSA-N 2 0 423.601 4.387 20 0 HIADRP CCOc1ccc(-c2nc(C[N@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)co2)cc1 ZINC000501527827 910635831 /nfs/dbraw/zinc/63/58/31/910635831.db2.gz MUTBUQDITHXSEX-UHFFFAOYSA-N 2 0 406.530 4.484 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[N@@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)CC1 ZINC000502320820 911294520 /nfs/dbraw/zinc/29/45/20/911294520.db2.gz MNJIDZBVAZVJNM-QHCPKHFHSA-N 2 0 421.633 4.131 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000502653768 911697299 /nfs/dbraw/zinc/69/72/99/911697299.db2.gz YDFZKKLNCFWNDG-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)NC3CCC([NH+]4CCC(C)CC4)CC3)CC2)CC1 ZINC000502760157 911782684 /nfs/dbraw/zinc/78/26/84/911782684.db2.gz RCWAOQOXLAGHFH-UHFFFAOYSA-N 2 0 418.670 4.372 20 0 HIADRP CCC(CC)(CNC(=O)NC[C@H]1CCC[N@@H+](C(C)C)C1)[NH2+][C@H](C)c1ccccc1 ZINC000502762668 911786043 /nfs/dbraw/zinc/78/60/43/911786043.db2.gz JRXKRABQCZXUNE-NHCUHLMSSA-N 2 0 402.627 4.316 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccccc1 ZINC000502974011 911954329 /nfs/dbraw/zinc/95/43/29/911954329.db2.gz ZNGCCFBZYZIWQM-NJYVYQBISA-N 2 0 402.627 4.173 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NCCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1 ZINC000502974009 911955251 /nfs/dbraw/zinc/95/52/51/911955251.db2.gz ZNGCCFBZYZIWQM-HBMCJLEFSA-N 2 0 402.627 4.173 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000503086835 912056447 /nfs/dbraw/zinc/05/64/47/912056447.db2.gz JLJKXASWARVZML-URXFXBBRSA-N 2 0 420.601 4.128 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000506331702 914942143 /nfs/dbraw/zinc/94/21/43/914942143.db2.gz PCCZDWNMQWBZOB-QGZVFWFLSA-N 2 0 415.965 4.451 20 0 HIADRP CN(c1ccccc1C[N@@H+](Cc1cccs1)C[C@H]1CCCO1)C1CC[NH+](C)CC1 ZINC000506718240 915397308 /nfs/dbraw/zinc/39/73/08/915397308.db2.gz HYFGMLQHPSPCPY-JOCHJYFZSA-N 2 0 413.631 4.460 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1)c1ccsc1 ZINC000506928240 915730093 /nfs/dbraw/zinc/73/00/93/915730093.db2.gz AMEKTLWSZOMZET-KCZVDYSFSA-N 2 0 420.667 4.427 20 0 HIADRP Clc1ccc(-c2noc(CC[NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)n2)cc1 ZINC000507508602 916272820 /nfs/dbraw/zinc/27/28/20/916272820.db2.gz JGLUBFRWNFBRGE-ILWGZMRPSA-N 2 0 422.960 4.433 20 0 HIADRP Clc1ccc(-c2noc(CC[NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@H]34)n2)cc1 ZINC000507508596 916273794 /nfs/dbraw/zinc/27/37/94/916273794.db2.gz JGLUBFRWNFBRGE-BAGYTPMASA-N 2 0 422.960 4.433 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccncc1 ZINC000507654490 916417057 /nfs/dbraw/zinc/41/70/57/916417057.db2.gz UNPJLUAZJAFJGE-SFHVURJKSA-N 2 0 406.496 4.353 20 0 HIADRP COc1cccc([C@H](CN[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)c1 ZINC000508718549 917481057 /nfs/dbraw/zinc/48/10/57/917481057.db2.gz NYRYUPISEFJWPR-DSBYRVASSA-N 2 0 407.602 4.332 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000509132186 917862092 /nfs/dbraw/zinc/86/20/92/917862092.db2.gz OHGZRIVMKBYMIX-GMAHTHKFSA-N 2 0 424.589 4.016 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000509132183 917862427 /nfs/dbraw/zinc/86/24/27/917862427.db2.gz OHGZRIVMKBYMIX-FYYLOGMGSA-N 2 0 424.589 4.016 20 0 HIADRP C[C@@H]1C[C@H](CCNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)C[N@@H+]1Cc1ccccc1 ZINC000509569324 918220056 /nfs/dbraw/zinc/22/00/56/918220056.db2.gz CMAVPXZVTPSGRR-AKIFATBCSA-N 2 0 424.589 4.016 20 0 HIADRP CC[C@@H](C)[NH2+][C@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000509576709 918226323 /nfs/dbraw/zinc/22/63/23/918226323.db2.gz HOAZLIAEMCOBNV-DENIHFKCSA-N 2 0 412.578 4.015 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OC)c(OC)c2Br)CC1 ZINC000510263608 918794859 /nfs/dbraw/zinc/79/48/59/918794859.db2.gz GQTBCCRVHYWRIJ-UHFFFAOYSA-N 2 0 413.400 4.410 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CCCC23CC[NH+](C)CC3)cc1 ZINC000510356511 918850066 /nfs/dbraw/zinc/85/00/66/918850066.db2.gz SPDWTLMHKJFHOA-UHFFFAOYSA-N 2 0 420.601 4.185 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC[C@H](c2ccc(C)o2)[NH+]2CCCC2)cc1 ZINC000510465534 918921632 /nfs/dbraw/zinc/92/16/32/918921632.db2.gz QHTCERXZERJBNY-JOCHJYFZSA-N 2 0 412.578 4.066 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(=O)N1CCc2sccc2C1 ZINC000511022462 919592243 /nfs/dbraw/zinc/59/22/43/919592243.db2.gz PMGHMFGTFMVAGA-MOPGFXCFSA-N 2 0 411.615 4.186 20 0 HIADRP CC(C)Sc1ccc(C[NH+]2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)cc1 ZINC000511117989 919729697 /nfs/dbraw/zinc/72/96/97/919729697.db2.gz XTRVBHFPKMADGC-UHFFFAOYSA-N 2 0 405.652 4.103 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000511265006 919862430 /nfs/dbraw/zinc/86/24/30/919862430.db2.gz JGCLCGBEKFZPDO-ZJOUEHCJSA-N 2 0 400.611 4.068 20 0 HIADRP CC[C@@H](CNC(=O)c1ccc(C[N@H+](CC)C2CC2)cc1)[NH+]1CCc2ccccc2C1 ZINC000511265844 919862679 /nfs/dbraw/zinc/86/26/79/919862679.db2.gz KQUDBOHISKAGMH-DEOSSOPVSA-N 2 0 405.586 4.238 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000511398460 920011436 /nfs/dbraw/zinc/01/14/36/920011436.db2.gz OUDXODWRLDKFPR-BJKOFHAPSA-N 2 0 416.009 4.343 20 0 HIADRP C[C@@H](NC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000511399475 920012338 /nfs/dbraw/zinc/01/23/38/920012338.db2.gz JJZCRIWXSMXYNG-NQUJAWNTSA-N 2 0 424.633 4.134 20 0 HIADRP C[C@H](NC(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511416708 920029756 /nfs/dbraw/zinc/02/97/56/920029756.db2.gz FVKMNJYIXNIMHF-ONTIZHBOSA-N 2 0 412.622 4.164 20 0 HIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)C1 ZINC000512129640 920877998 /nfs/dbraw/zinc/87/79/98/920877998.db2.gz LNACRBMNUURKMV-KGLIPLIRSA-N 2 0 405.892 4.397 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)N(C)Cc2c(F)cccc2Cl)CC1 ZINC000512247739 921006390 /nfs/dbraw/zinc/00/63/90/921006390.db2.gz AJHFKAJWLQTIMC-KRWDZBQOSA-N 2 0 411.993 4.270 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](CC(=O)N2CCC[C@H]2c2ccc(OCC)cc2)CC1 ZINC000512264213 921021708 /nfs/dbraw/zinc/02/17/08/921021708.db2.gz LRYFAPDKIZNYIF-DEOSSOPVSA-N 2 0 415.622 4.193 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCN(c3ccccc3Cl)C2=O)CC1 ZINC000513654636 921975823 /nfs/dbraw/zinc/97/58/23/921975823.db2.gz JBGRBYPTQYDERC-QETWGEEDSA-N 2 0 411.977 4.478 20 0 HIADRP Cc1ccc(NC(=O)COc2ccc(CC[NH2+][C@@H]3CC[N@@H+](C)[C@H]4CCC[C@@H]43)cc2)cc1 ZINC000513703491 922022943 /nfs/dbraw/zinc/02/29/43/922022943.db2.gz WKCQJVGEAZAZQP-SDHSZQHLSA-N 2 0 421.585 4.017 20 0 HIADRP CCOc1cc(C[N@H+](C)CC2CC[NH+](C)CC2)cc(Br)c1OC(F)F ZINC000513736584 922057950 /nfs/dbraw/zinc/05/79/50/922057950.db2.gz FZXGIYNFFRKDAV-UHFFFAOYSA-N 2 0 421.326 4.223 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N(C)c2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000513811428 922135920 /nfs/dbraw/zinc/13/59/20/922135920.db2.gz RPXDGLGPACEMBM-UHFFFAOYSA-N 2 0 409.574 4.280 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccc(OC)c(OC)c2C)CC1 ZINC000514100226 922426583 /nfs/dbraw/zinc/42/65/83/922426583.db2.gz UIHRMFFNVWONSI-HXUWFJFHSA-N 2 0 411.590 4.001 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H](CN2CCCC2=O)c2ccccc2)CC1 ZINC000514105325 922435230 /nfs/dbraw/zinc/43/52/30/922435230.db2.gz QPGBYQULAHBDAQ-DDJHWDJXSA-N 2 0 405.586 4.383 20 0 HIADRP COc1ccc(-c2ccccc2)cc1C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000514250431 922591657 /nfs/dbraw/zinc/59/16/57/922591657.db2.gz UMAPNQSMHQMXQV-RUZDIDTESA-N 2 0 402.538 4.219 20 0 HIADRP COc1ccc(C[C@H]([NH2+]CC2(SC)CC[NH+](C)CC2)c2ccc(OC)cc2)cc1 ZINC000515097160 922909910 /nfs/dbraw/zinc/90/99/10/922909910.db2.gz FKHRDOKJKPLOJN-QHCPKHFHSA-N 2 0 414.615 4.405 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)N2CCC([NH+]3CCCCC3)CC2)c2cccs2)CC1 ZINC000515291838 923038551 /nfs/dbraw/zinc/03/85/51/923038551.db2.gz PYQMZFFWFKHFIP-NRFANRHFSA-N 2 0 418.651 4.181 20 0 HIADRP CSC1(C[NH2+]Cc2cc(C(F)(F)F)ccc2Br)CC[NH+](C)CC1 ZINC000515410409 923087739 /nfs/dbraw/zinc/08/77/39/923087739.db2.gz ZGSLRUYEUPSIPT-UHFFFAOYSA-N 2 0 411.331 4.385 20 0 HIADRP COc1c(Br)cccc1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000515470240 923122379 /nfs/dbraw/zinc/12/23/79/923122379.db2.gz NRQOSNGOMVVSMZ-UHFFFAOYSA-N 2 0 419.363 4.221 20 0 HIADRP CC[N@H+](Cc1cnc2ccc(Br)cn12)Cc1ccc(C[NH+](C)C)cc1 ZINC000516512914 923771709 /nfs/dbraw/zinc/77/17/09/923771709.db2.gz IQWAWYRESUKVFU-UHFFFAOYSA-N 2 0 401.352 4.181 20 0 HIADRP CCC[N@@H+]1CCC[C@@H]1C(=O)N1CCC([NH+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000517680832 926786358 /nfs/dbraw/zinc/78/63/58/926786358.db2.gz IIPGTWCFKXUFFE-HXUWFJFHSA-N 2 0 411.512 4.003 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc(Br)c2c(c1)OCCCO2 ZINC000518267565 927126254 /nfs/dbraw/zinc/12/62/54/927126254.db2.gz LGOZELAUUTZEML-MRXNPFEDSA-N 2 0 411.384 4.355 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]CCC[NH+]2CCCC2)cc1 ZINC000518271536 927131115 /nfs/dbraw/zinc/13/11/15/927131115.db2.gz XXKRZTKPWSJXJB-UHFFFAOYSA-N 2 0 404.558 4.183 20 0 HIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(OCc3ccccc3)c(Br)c2)C1 ZINC000518285709 927143689 /nfs/dbraw/zinc/14/36/89/927143689.db2.gz UMPGPXOZJHBNPE-IBGZPJMESA-N 2 0 403.364 4.460 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000518285647 927144511 /nfs/dbraw/zinc/14/45/11/927144511.db2.gz YEBFSNFERQKMFU-OAQYLSRUSA-N 2 0 404.558 4.038 20 0 HIADRP CCOc1c(Br)cc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1OC ZINC000520205252 928387896 /nfs/dbraw/zinc/38/78/96/928387896.db2.gz DZCBNFHQCCRVGQ-MRXNPFEDSA-N 2 0 413.400 4.458 20 0 HIADRP FC(F)(F)COc1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cn1 ZINC000521062228 928967778 /nfs/dbraw/zinc/96/77/78/928967778.db2.gz XZMVYOJINHBVGY-MZADTFQBSA-N 2 0 419.491 4.350 20 0 HIADRP C[C@H]1C[N@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC[C@@H]1c1ccccc1 ZINC000525122899 930048888 /nfs/dbraw/zinc/04/88/88/930048888.db2.gz PYGUGZDEVDALCA-OFVILXPXSA-N 2 0 405.586 4.024 20 0 HIADRP CC(C)c1ccc([C@@H](NC(=O)N(CC[NH+](C)C)CC[NH+](C)C)c2cccs2)cc1 ZINC000525452346 930249066 /nfs/dbraw/zinc/24/90/66/930249066.db2.gz YRTNHGOHLNFZFD-JOCHJYFZSA-N 2 0 416.635 4.096 20 0 HIADRP COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000525709151 930411886 /nfs/dbraw/zinc/41/18/86/930411886.db2.gz WARWUMDQUYYUES-UYAOXDASSA-N 2 0 420.557 4.129 20 0 HIADRP C[C@@H]1C[NH+](CCOc2ccc(CC[NH2+][C@@H](c3ncc[nH]3)c3ccccc3)cc2)C[C@H]1C ZINC000525869312 930473346 /nfs/dbraw/zinc/47/33/46/930473346.db2.gz WBQVMQUJOZZCAU-DNRQZRRGSA-N 2 0 418.585 4.298 20 0 HIADRP C[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000527223048 930615514 /nfs/dbraw/zinc/61/55/14/930615514.db2.gz LJDIQXPHQPLGOC-MDNKFWRPSA-N 2 0 404.023 4.472 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+]Cc3cccc4c3OCCCO4)CC2)cc1 ZINC000530664598 930790877 /nfs/dbraw/zinc/79/08/77/930790877.db2.gz HNAJYRHNBJODLF-UHFFFAOYSA-N 2 0 410.558 4.009 20 0 HIADRP C[C@H](c1ccccc1)N1CC[C@@H]([NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000531594426 931113552 /nfs/dbraw/zinc/11/35/52/931113552.db2.gz KAYARRVNTNPWKC-ZJSXRUAMSA-N 2 0 406.618 4.142 20 0 HIADRP Cc1c([C@H](C)[NH2+]CCCC[NH+]2CCN(C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000531685424 931151879 /nfs/dbraw/zinc/15/18/79/931151879.db2.gz JEULGPSWHSWVBN-INIZCTEOSA-N 2 0 424.420 4.166 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc4c(c3)OCCCO4)CC2)cc1 ZINC000531694861 931156972 /nfs/dbraw/zinc/15/69/72/931156972.db2.gz VYZMFPBHISJMRZ-IBGZPJMESA-N 2 0 410.558 4.419 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531711404 931169940 /nfs/dbraw/zinc/16/99/40/931169940.db2.gz YGIGDAPWRUFLIC-MRXNPFEDSA-N 2 0 405.945 4.068 20 0 HIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000531959356 931265836 /nfs/dbraw/zinc/26/58/36/931265836.db2.gz YTQBTUWUKDTGMZ-RBUKOAKNSA-N 2 0 421.564 4.483 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccc(S(C)(=O)=O)cc1 ZINC000531980882 931274527 /nfs/dbraw/zinc/27/45/27/931274527.db2.gz ZNNXBRMJQDGGCX-GOSISDBHSA-N 2 0 412.555 4.166 20 0 HIADRP O[C@H]1CCC[C@@H]1[NH+]1CCC([NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000532016107 931285298 /nfs/dbraw/zinc/28/52/98/931285298.db2.gz QHFBIUMEIHLIGW-ZEQRLZLVSA-N 2 0 414.977 4.386 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000532197536 931344946 /nfs/dbraw/zinc/34/49/46/931344946.db2.gz XKRKPTVTEOPRJD-IBGZPJMESA-N 2 0 413.993 4.463 20 0 HIADRP Fc1cccc(Cl)c1[C@H](C[NH2+]C1CCN(c2ccccn2)CC1)N1CCCC1 ZINC000532198081 931346359 /nfs/dbraw/zinc/34/63/59/931346359.db2.gz XXRMAPMHKBNGNN-FQEVSTJZSA-N 2 0 402.945 4.270 20 0 HIADRP CC[C@@H]([NH2+][C@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Cl)ccc1OC ZINC000532221226 931359186 /nfs/dbraw/zinc/35/91/86/931359186.db2.gz DOKGDEJRDQIBTN-FGZHOGPDSA-N 2 0 401.982 4.378 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccccc2-n2ccc(C)n2)CC1 ZINC000532269775 931377608 /nfs/dbraw/zinc/37/76/08/931377608.db2.gz ZCQGHZPQNDQZDD-UHFFFAOYSA-N 2 0 403.574 4.003 20 0 HIADRP CC[NH+](CC)CCN(Cc1cccs1)C(=O)C1CCN(c2cc[nH+]cc2C)CC1 ZINC000532357544 931406712 /nfs/dbraw/zinc/40/67/12/931406712.db2.gz AGFZQCFQMBJIMF-UHFFFAOYSA-N 2 0 414.619 4.039 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C[C@H](c1ccccc1Cl)N1CCCC1 ZINC000532461741 931445891 /nfs/dbraw/zinc/44/58/91/931445891.db2.gz QNXDIZZOTZSHDW-VEXUSMLFSA-N 2 0 413.009 4.372 20 0 HIADRP COc1ccc([C@@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)c2ccccc12 ZINC000532498292 931463274 /nfs/dbraw/zinc/46/32/74/931463274.db2.gz XRFPSMLXWIIRAG-NLFFAJNJSA-N 2 0 403.570 4.488 20 0 HIADRP COc1ccc(-c2nc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)cs2)cc1OC ZINC000532537837 931515262 /nfs/dbraw/zinc/51/52/62/931515262.db2.gz OGIYXGXITQZXEH-UHFFFAOYSA-N 2 0 403.592 4.380 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000532548935 931517750 /nfs/dbraw/zinc/51/77/50/931517750.db2.gz KBSNCSAYIORKHT-GOSISDBHSA-N 2 0 406.014 4.464 20 0 HIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccc2c(c1)CCC(=O)N2 ZINC000532549195 931518264 /nfs/dbraw/zinc/51/82/64/931518264.db2.gz DAIVKRKKBQELJT-FQEVSTJZSA-N 2 0 421.585 4.293 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000532794485 931632742 /nfs/dbraw/zinc/63/27/42/931632742.db2.gz OMYCBHDXBTWSDF-JTHBVZDNSA-N 2 0 420.601 4.023 20 0 HIADRP C(CCN1CCC([NH+]2CCCCC2)CC1)CC[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC000533240627 931816758 /nfs/dbraw/zinc/81/67/58/931816758.db2.gz YARJFEBXGUYRJP-UHFFFAOYSA-N 3 0 404.687 4.057 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]C[C@@H](c2ccccc2)C(C)(C)CO)CC1 ZINC000533330658 931840524 /nfs/dbraw/zinc/84/05/24/931840524.db2.gz PQSHQZOFKNHTGK-DEOSSOPVSA-N 2 0 409.618 4.111 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(OCc3nccn3C)cc2)CC1 ZINC000533342001 931842357 /nfs/dbraw/zinc/84/23/57/931842357.db2.gz HOELKSPMEHHFDJ-OAQYLSRUSA-N 2 0 410.606 4.476 20 0 HIADRP CC(C)[C@H](NC(=O)N(C)[C@H]1CCCC[C@@H]1[N@H+](C)C1CCN(C)CC1)c1ccccc1 ZINC000533663238 931956313 /nfs/dbraw/zinc/95/63/13/931956313.db2.gz WKWAYJVJJZFCLD-HJOGWXRNSA-N 2 0 414.638 4.362 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1)c1ccccc1Cl ZINC000533763323 932018047 /nfs/dbraw/zinc/01/80/47/932018047.db2.gz BPHWGJCZZGVYDA-UGKGYDQZSA-N 2 0 421.029 4.096 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N2CC[C@@H](C3CC[NH+](C)CC3)C2)c1 ZINC000533780582 932029493 /nfs/dbraw/zinc/02/94/93/932029493.db2.gz HMNQVQNRTGAUTI-XMMPIXPASA-N 2 0 414.638 4.182 20 0 HIADRP CCSc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000533784979 932032134 /nfs/dbraw/zinc/03/21/34/932032134.db2.gz XZNKRKIRSNEWTR-GCJKJVERSA-N 2 0 411.615 4.347 20 0 HIADRP Cc1ccccc1-c1cnc(C[N@@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)o1 ZINC000533816880 932044751 /nfs/dbraw/zinc/04/47/51/932044751.db2.gz CIEJVSKNKIYBBP-UHFFFAOYSA-N 2 0 410.606 4.278 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)NCCC[NH2+]C2CCCCC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000534250508 932365082 /nfs/dbraw/zinc/36/50/82/932365082.db2.gz IBXOWMQPBWQFBO-DYESRHJHSA-N 2 0 424.992 4.084 20 0 HIADRP c1nc([C@H]2CCCO2)sc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000534467677 932487221 /nfs/dbraw/zinc/48/72/21/932487221.db2.gz MZHZINGDVRPXDE-JOCHJYFZSA-N 2 0 415.603 4.156 20 0 HIADRP C[NH+](C)CC[C@@H](NC(=O)N1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1)C(C)(C)C ZINC000534957565 932858350 /nfs/dbraw/zinc/85/83/50/932858350.db2.gz ISMHOLVMYQOJRA-JOCHJYFZSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CC[NH+](C)[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000535434076 933133638 /nfs/dbraw/zinc/13/36/38/933133638.db2.gz CJKDZTLKENCSDL-HVHOJJEHSA-N 2 0 420.601 4.126 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000535703286 933358652 /nfs/dbraw/zinc/35/86/52/933358652.db2.gz XXUZKSVTBKANEG-DNVCBOLYSA-N 2 0 424.992 4.080 20 0 HIADRP CN1CC[C@@H](NC(=O)Nc2cccc(C[NH+](C)C)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000535839375 933424583 /nfs/dbraw/zinc/42/45/83/933424583.db2.gz YGJDJIKXEYFKEB-UXHICEINSA-N 2 0 404.917 4.108 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C[C@H]3CCOC3)c3ccccc3)cc2)CC1 ZINC000535838740 933424825 /nfs/dbraw/zinc/42/48/25/933424825.db2.gz DXWWZIXWECIAIB-AOYPEHQESA-N 2 0 407.602 4.082 20 0 HIADRP CSc1cccc([C@@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000537607082 938332438 /nfs/dbraw/zinc/33/24/38/938332438.db2.gz ONYUFZPKXMSNQS-HSZRJFAPSA-N 2 0 419.585 4.393 20 0 HIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(-c4nc5ccccc5s4)o3)C2)CC1 ZINC000537658744 938348260 /nfs/dbraw/zinc/34/82/60/938348260.db2.gz CFICVNYCUPNWHE-SFHVURJKSA-N 2 0 410.587 4.157 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2cn(-c3ccc(Cl)cc3)nc2C)CC1 ZINC000537662129 938349428 /nfs/dbraw/zinc/34/94/28/938349428.db2.gz WNURXMDREZIWJR-UHFFFAOYSA-N 2 0 404.986 4.157 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)[C@@H]3CCC[N@H+](Cc4cccnc4)C3)c2)CC1 ZINC000537714719 938362253 /nfs/dbraw/zinc/36/22/53/938362253.db2.gz CRTBHOLFCQAISM-XMMPIXPASA-N 2 0 420.601 4.207 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNCc2c(Cl)cccc2N2CC[NH+](C)CC2)c1 ZINC000537748509 938368751 /nfs/dbraw/zinc/36/87/51/938368751.db2.gz IXDMXJTXCWBTRM-UHFFFAOYSA-N 2 0 415.025 4.223 20 0 HIADRP CCOc1ccccc1NC(=O)[C@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537840730 938387146 /nfs/dbraw/zinc/38/71/46/938387146.db2.gz FQIRCTIGZUXEGA-IBGZPJMESA-N 2 0 410.562 4.046 20 0 HIADRP CCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)cc1OCCC ZINC000537957914 938433408 /nfs/dbraw/zinc/43/34/08/938433408.db2.gz YNCYNNLGOPGDBC-NYVOZVTQSA-N 2 0 404.595 4.293 20 0 HIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1F ZINC000537962436 938436206 /nfs/dbraw/zinc/43/62/06/938436206.db2.gz ZKWXDXKQWCTZHQ-SNJCGAMXSA-N 2 0 404.570 4.218 20 0 HIADRP CC[NH+]1CCC(NC(=O)Nc2ccc(C[N@H+](C[C@@H]3CCCCO3)C(C)C)cc2)CC1 ZINC000538248562 938573887 /nfs/dbraw/zinc/57/38/87/938573887.db2.gz RABWPMALJWEREE-QHCPKHFHSA-N 2 0 416.610 4.072 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CC(C)(C)c1ccc3c(c1)OCO3)c1ccccc1O2 ZINC000538276529 938581607 /nfs/dbraw/zinc/58/16/07/938581607.db2.gz RDJQZFSQSBHDHN-HXUWFJFHSA-N 2 0 408.542 4.271 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CC(C)(C)c1ccc3c(c1)OCO3)c1ccccc1O2 ZINC000538276528 938581718 /nfs/dbraw/zinc/58/17/18/938581718.db2.gz RDJQZFSQSBHDHN-FQEVSTJZSA-N 2 0 408.542 4.271 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@@H](c1ccc3c(c1)OCCO3)C1CC1)c1ccccc1O2 ZINC000538294527 938585666 /nfs/dbraw/zinc/58/56/66/938585666.db2.gz RZZZSNGYVMHRGR-SQJMNOBHSA-N 2 0 420.553 4.487 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@H]1CCCN1Cc1ccccc1)c1ccccc1O2 ZINC000538295940 938585997 /nfs/dbraw/zinc/58/59/97/938585997.db2.gz NCFSCOZRZWKQLU-VWNXMTODSA-N 2 0 405.586 4.229 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c(Br)c1 ZINC000538397211 938610649 /nfs/dbraw/zinc/61/06/49/938610649.db2.gz UUWPOOXGEKJOER-HNNXBMFYSA-N 2 0 407.352 4.249 20 0 HIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)CCO1 ZINC000538507689 938638283 /nfs/dbraw/zinc/63/82/83/938638283.db2.gz YCWAFTGDQTWYTK-RSXGOPAZSA-N 2 0 407.602 4.302 20 0 HIADRP c1cc(C[N@@H+]2CCC[C@@H]2C2CCOCC2)ccc1C[NH+]1CCC[C@@H]1C1CCOCC1 ZINC000538627215 938666478 /nfs/dbraw/zinc/66/64/78/938666478.db2.gz COCAQABJIAHWGP-CLJLJLNGSA-N 2 0 412.618 4.469 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cc(Br)cs3)CC2)CC1 ZINC000538722435 938691156 /nfs/dbraw/zinc/69/11/56/938691156.db2.gz PXXXBWCWWJZOBI-UHFFFAOYSA-N 2 0 414.457 4.139 20 0 HIADRP COc1cc(OC)c(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c(OC)c1 ZINC000538725406 938692771 /nfs/dbraw/zinc/69/27/71/938692771.db2.gz SYJWGNJQNULBQJ-UHFFFAOYSA-N 2 0 410.558 4.201 20 0 HIADRP Cc1cc(Cl)ccc1NC(=O)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538943019 938743022 /nfs/dbraw/zinc/74/30/22/938743022.db2.gz GRRVWEWHOWACCI-UHFFFAOYSA-N 2 0 400.954 4.220 20 0 HIADRP C[N@H+](CCCc1nc(-c2ccccc2)no1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538946109 938743983 /nfs/dbraw/zinc/74/39/83/938743983.db2.gz MDGGMMWNUBZWDW-UHFFFAOYSA-N 2 0 405.546 4.303 20 0 HIADRP C[C@@H](C(=O)Nc1cccc2ncccc21)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538947063 938744556 /nfs/dbraw/zinc/74/45/56/938744556.db2.gz RIFGHTQXYDHNHX-IBGZPJMESA-N 2 0 417.557 4.195 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)cc1 ZINC000539074084 938794995 /nfs/dbraw/zinc/79/49/95/938794995.db2.gz UDVPRZFVYVKSEU-QHCPKHFHSA-N 2 0 421.585 4.294 20 0 HIADRP COc1ccccc1[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)C1CCCC1 ZINC000539204972 938818967 /nfs/dbraw/zinc/81/89/67/938818967.db2.gz WYYDYPOUTHZSAX-XMMPIXPASA-N 2 0 409.574 4.008 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2nc3sc(C)c(C)c3c(N)n2)CC1 ZINC000539248565 938825509 /nfs/dbraw/zinc/82/55/09/938825509.db2.gz VXLYRURAFOFMRY-INIZCTEOSA-N 2 0 419.639 4.022 20 0 HIADRP C[C@@H]([NH2+]CCC[NH2+][C@@H](C)c1ccc(-n2cccn2)cc1)c1ccc(-n2cccn2)cc1 ZINC000539343471 938845426 /nfs/dbraw/zinc/84/54/26/938845426.db2.gz YXAWHXGASRRLLV-OYRHEFFESA-N 2 0 414.557 4.450 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cccc(-n3cccn3)c2)CC1 ZINC000539494325 938868298 /nfs/dbraw/zinc/86/82/98/938868298.db2.gz DSDGVARANCYCPA-LJQANCHMSA-N 2 0 407.537 4.004 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2cccc(Br)c2OC(F)F)C[C@@H](C)O1 ZINC000539634055 938891123 /nfs/dbraw/zinc/89/11/23/938891123.db2.gz CHOMJVXWMKNEJS-ZIAGYGMSSA-N 2 0 421.326 4.030 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(F)c(NC2CC[NH+](C(C)(C)C)CC2)c1 ZINC000539645074 938893131 /nfs/dbraw/zinc/89/31/31/938893131.db2.gz FUQDMYZNIHRBSS-KRWDZBQOSA-N 2 0 404.574 4.313 20 0 HIADRP CN(Cc1ccccc1N(C)C1CC[NH+](C)CC1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539828152 938949387 /nfs/dbraw/zinc/94/93/87/938949387.db2.gz DCPBZEKMEDSDOS-XMMPIXPASA-N 2 0 420.645 4.171 20 0 HIADRP COc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c(OC)c1OC ZINC000539861440 938959580 /nfs/dbraw/zinc/95/95/80/938959580.db2.gz QLBTUNKYJUFZBG-UHFFFAOYSA-N 2 0 410.558 4.201 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)NC3CC[NH+](C(C)(C)C)CC3)c2)CC1 ZINC000539874267 938963179 /nfs/dbraw/zinc/96/31/79/938963179.db2.gz MOXHKCNFYLRVAC-UHFFFAOYSA-N 2 0 400.611 4.345 20 0 HIADRP CCc1cccc(CC)c1NC(=O)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540043925 939047223 /nfs/dbraw/zinc/04/72/23/939047223.db2.gz MCGZJMKPPYRVHJ-UHFFFAOYSA-N 2 0 408.590 4.383 20 0 HIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]Cc1ccnc(OCC[NH+](C)C)c1 ZINC000540157610 939095046 /nfs/dbraw/zinc/09/50/46/939095046.db2.gz NQNZOWPQLOYZOS-OAHLLOKOSA-N 2 0 414.550 4.444 20 0 HIADRP C[C@@H]([NH2+]CCc1nc2ccccc2n1C(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000540187252 939111939 /nfs/dbraw/zinc/11/19/39/939111939.db2.gz ITIAMUJCXVUECJ-MRXNPFEDSA-N 2 0 402.489 4.265 20 0 HIADRP CC[N@H+](CCC1CC[NH+]([C@@H](C)C(=O)N[C@@H]2CCOc3ccccc32)CC1)CC(C)C ZINC000540197863 939122402 /nfs/dbraw/zinc/12/24/02/939122402.db2.gz SSWOMATZIGZZOH-NZQKXSOJSA-N 2 0 415.622 4.095 20 0 HIADRP CC(C)[C@H]([NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1)c1ccc2[nH]c(=O)oc2c1 ZINC000540260241 939176116 /nfs/dbraw/zinc/17/61/16/939176116.db2.gz BDDDIOWSDFOYHK-UPVQGACJSA-N 2 0 422.573 4.199 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000540302743 939187776 /nfs/dbraw/zinc/18/77/76/939187776.db2.gz SLCZIIADBXJACH-NRFANRHFSA-N 2 0 421.507 4.484 20 0 HIADRP C[C@@H]([NH2+]CCC[NH2+][C@H](C)c1cccc(-n2cccn2)c1)c1cccc(-n2cccn2)c1 ZINC000540390465 939228269 /nfs/dbraw/zinc/22/82/69/939228269.db2.gz XZKYDRRJJWUJGI-NHCUHLMSSA-N 2 0 414.557 4.450 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@@H]1CCCN(Cc3ccccc3)C1)c1ccccc1O2 ZINC000540461009 939261359 /nfs/dbraw/zinc/26/13/59/939261359.db2.gz IRDYJCJBYUSGPZ-ISKFKSNPSA-N 2 0 405.586 4.229 20 0 HIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000540476188 939267231 /nfs/dbraw/zinc/26/72/31/939267231.db2.gz YQKONADDKTWQRM-DEOSSOPVSA-N 3 0 423.601 4.095 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCc1nc(-c3ccncc3)cs1)c1ccccc1O2 ZINC000540500887 939278731 /nfs/dbraw/zinc/27/87/31/939278731.db2.gz CPCFRWWQJCZCGS-FQEVSTJZSA-N 2 0 420.582 4.325 20 0 HIADRP CCOc1cccc2cc([C@@H](C)[NH2+]Cc3ccc(N4CC[NH+](CC)CC4)nc3)oc21 ZINC000540597090 939315148 /nfs/dbraw/zinc/31/51/48/939315148.db2.gz HPZOCZCNBXKSOV-GOSISDBHSA-N 2 0 408.546 4.219 20 0 HIADRP CC[NH+]1CCN(c2ccc(N[C@H](C)c3cccc(OCC[NH+](C)C)c3)c(C)c2)CC1 ZINC000540707422 939344799 /nfs/dbraw/zinc/34/47/99/939344799.db2.gz AKYNMZDHTPXUAX-OAQYLSRUSA-N 2 0 410.606 4.250 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000540908567 939415266 /nfs/dbraw/zinc/41/52/66/939415266.db2.gz OAOJJLDQUMDQQU-JOCHJYFZSA-N 2 0 416.407 4.156 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc(Br)ccc1F ZINC000540988142 939425789 /nfs/dbraw/zinc/42/57/89/939425789.db2.gz HEQCFPTXANSBEH-KBXCAEBGSA-N 2 0 407.327 4.006 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(OCC(F)(F)F)cc1 ZINC000540991127 939426638 /nfs/dbraw/zinc/42/66/38/939426638.db2.gz XZXOIPRFNBAXHR-UTKZUKDTSA-N 2 0 422.491 4.435 20 0 HIADRP CCN1CC[C@H]([NH2+]Cc2cn(-c3cc[nH+]cc3)nc2C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000541377669 939500710 /nfs/dbraw/zinc/50/07/10/939500710.db2.gz HGVORXAXYJERIA-VXKWHMMOSA-N 2 0 413.928 4.293 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000541545504 939550035 /nfs/dbraw/zinc/55/00/35/939550035.db2.gz IHQOJGZRSBUMHZ-UFYCRDLUSA-N 2 0 410.558 4.046 20 0 HIADRP C[C@H]1C[N@H+](CCOc2ccc(CC[NH2+][C@H]3CCC(=O)Nc4ccccc43)cc2)C[C@H]1C ZINC000541564474 939556125 /nfs/dbraw/zinc/55/61/25/939556125.db2.gz RFBZAEVDQAFTPX-ROKPMTFOSA-N 2 0 421.585 4.259 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000541575328 939558668 /nfs/dbraw/zinc/55/86/68/939558668.db2.gz YBOZIISXBBLCBS-UHFFFAOYSA-N 2 0 407.602 4.445 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000541744096 939618991 /nfs/dbraw/zinc/61/89/91/939618991.db2.gz BONAREYISDIUOA-MDNUFGMLSA-N 2 0 406.636 4.324 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3cnc(-c4ccncc4)s3)CC2)c1 ZINC000563719185 945266076 /nfs/dbraw/zinc/26/60/76/945266076.db2.gz YXIUJAGGKYSJQC-UHFFFAOYSA-N 2 0 421.614 4.206 20 0 HIADRP Cn1cc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c(C2CCCCC2)n1 ZINC000542466344 939827881 /nfs/dbraw/zinc/82/78/81/939827881.db2.gz BRIOBIYBOHVVQA-UHFFFAOYSA-N 2 0 415.670 4.096 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@@H](c2ccccc2)c2ccc(F)cn2)[C@H](c2ccccc2)C1 ZINC000542480805 939830865 /nfs/dbraw/zinc/83/08/65/939830865.db2.gz QLHGTXKTQKDSFW-UIOOFZCWSA-N 2 0 418.560 4.279 20 0 HIADRP CC1(C(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000542502920 939833824 /nfs/dbraw/zinc/83/38/24/939833824.db2.gz KBUKMPSNGNKEOC-UHFFFAOYSA-N 2 0 423.576 4.209 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCOc2ccc(Cl)cc21 ZINC000542845700 939862606 /nfs/dbraw/zinc/86/26/06/939862606.db2.gz HCXKRPYHBZWWQZ-RBBKRZOGSA-N 2 0 400.950 4.300 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCOc2ccc(Cl)cc21 ZINC000542845702 939862662 /nfs/dbraw/zinc/86/26/62/939862662.db2.gz HCXKRPYHBZWWQZ-UNMCSNQZSA-N 2 0 400.950 4.300 20 0 HIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1F ZINC000542847767 939862799 /nfs/dbraw/zinc/86/27/99/939862799.db2.gz SZCYWQSHRSPQGT-GPXNEJASSA-N 2 0 412.549 4.217 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccccc1Br ZINC000542848313 939862804 /nfs/dbraw/zinc/86/28/04/939862804.db2.gz XOCLSNIFUQHDRB-NQIIRXRSSA-N 2 0 403.364 4.257 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1 ZINC000542852319 939863230 /nfs/dbraw/zinc/86/32/30/939863230.db2.gz YRBNACNTIMDHQF-CYFREDJKSA-N 2 0 424.589 4.024 20 0 HIADRP Fc1ccc([C@@H]([NH2+]CCCN2CC[NH+](Cc3ccccc3)CC2)c2cccnc2)cc1 ZINC000543406720 940054864 /nfs/dbraw/zinc/05/48/64/940054864.db2.gz PQWNIKKRRBMKHS-AREMUKBSSA-N 2 0 418.560 4.108 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cnn1-c1cccc(Cl)c1 ZINC000543775823 940182372 /nfs/dbraw/zinc/18/23/72/940182372.db2.gz KXPHAGMTVUESGS-SBUREZEXSA-N 2 0 424.976 4.252 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(F)c(Br)c1 ZINC000543778256 940184560 /nfs/dbraw/zinc/18/45/60/940184560.db2.gz ZQIBLXNVBUNSKH-RDTXWAMCSA-N 2 0 407.327 4.006 20 0 HIADRP C[NH+](C)Cc1cc(CNC(=O)c2cccc(C[N@H+](C)Cc3ccccc3)c2)ccc1F ZINC000544223889 940359848 /nfs/dbraw/zinc/35/98/48/940359848.db2.gz UDFWQUQGBLQURA-UHFFFAOYSA-N 2 0 419.544 4.449 20 0 HIADRP C[C@H]1[N@H+](Cc2cccc(C[NH+]3CCC4(CCOCC4)[C@@H]3C)c2)CCC12CCOCC2 ZINC000544549948 940477197 /nfs/dbraw/zinc/47/71/97/940477197.db2.gz NZTSCWZKCURXKQ-SZPZYZBQSA-N 2 0 412.618 4.469 20 0 HIADRP CN(c1ccccc1C[NH2+][C@H]1CCO[C@H](c2ccc(F)cc2)C1)C1CC[NH+](C)CC1 ZINC000544596864 940487014 /nfs/dbraw/zinc/48/70/14/940487014.db2.gz YGTWPKBHEDBDNE-DHLKQENFSA-N 2 0 411.565 4.366 20 0 HIADRP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000544619701 940491688 /nfs/dbraw/zinc/49/16/88/940491688.db2.gz PMXAWZGRXINAAQ-FQEVSTJZSA-N 2 0 414.638 4.323 20 0 HIADRP C[NH+](C)CCOc1cccc(-c2noc(C3CC[NH+](Cc4ccccc4)CC3)n2)c1 ZINC000544734480 940508955 /nfs/dbraw/zinc/50/89/55/940508955.db2.gz YCYPIGLHLSITGS-UHFFFAOYSA-N 2 0 406.530 4.057 20 0 HIADRP c1cncc(C[N@H+]2CCC[C@@H](c3nc(-c4cccc(C[NH+]5CCCC5)c4)no3)C2)c1 ZINC000545675573 940580059 /nfs/dbraw/zinc/58/00/59/940580059.db2.gz RLTKCYZQSZXUQL-JOCHJYFZSA-N 2 0 403.530 4.107 20 0 HIADRP COc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)CC3 ZINC000545899844 940655484 /nfs/dbraw/zinc/65/54/84/940655484.db2.gz QXQOCQVBDCVBRS-LJQANCHMSA-N 2 0 407.558 4.154 20 0 HIADRP Cc1cc(Br)cn2cc(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)nc12 ZINC000546266826 940752442 /nfs/dbraw/zinc/75/24/42/940752442.db2.gz NZSBJFTUVOONLC-UHFFFAOYSA-N 2 0 419.411 4.334 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@H]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000547363108 941058495 /nfs/dbraw/zinc/05/84/95/941058495.db2.gz PEXLMQWPYMLLCS-ZEQRLZLVSA-N 2 0 409.549 4.077 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(COC2CCOCC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547828344 941077658 /nfs/dbraw/zinc/07/76/58/941077658.db2.gz FCMFEJNFOZEIAM-PXDATVDWSA-N 2 0 408.586 4.382 20 0 HIADRP CC[N@H+](CCNC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C)C1CC1 ZINC000548970538 941135942 /nfs/dbraw/zinc/13/59/42/941135942.db2.gz FHSRKCZGCDRINF-DRLVYXDUSA-N 2 0 419.013 4.037 20 0 HIADRP C[NH+](C)CC1CCN(c2ccccc2NC(=O)c2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000549086791 941155645 /nfs/dbraw/zinc/15/56/45/941155645.db2.gz VUZNNMAVCIWDRJ-UHFFFAOYSA-N 2 0 420.601 4.313 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000549204784 941170806 /nfs/dbraw/zinc/17/08/06/941170806.db2.gz NDOPQYLPLHSCKU-QHCPKHFHSA-N 2 0 414.638 4.051 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000549251111 941174219 /nfs/dbraw/zinc/17/42/19/941174219.db2.gz OCMBAVXHPSGFKN-LJQANCHMSA-N 2 0 403.574 4.406 20 0 HIADRP CC(C)(C)c1ncc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)s1 ZINC000550263541 941305669 /nfs/dbraw/zinc/30/56/69/941305669.db2.gz QQMYOAFOXPSSJZ-HXUWFJFHSA-N 2 0 413.631 4.459 20 0 HIADRP CC(C)[C@@]1(CO)CCC[NH+](Cc2cccc(C[N@H+]3CCC[C@](CO)(C(C)C)C3)c2)C1 ZINC000550433507 941326516 /nfs/dbraw/zinc/32/65/16/941326516.db2.gz LWXSNONHHQZXGQ-UIOOFZCWSA-N 2 0 416.650 4.148 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCC[C@@H]2Cc2ccccc2Br)CC1 ZINC000550524633 941335160 /nfs/dbraw/zinc/33/51/60/941335160.db2.gz AJZABRRWWNFFDD-OAQYLSRUSA-N 2 0 422.455 4.262 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCCOc4ccccc43)C3(C2)CCOCC3)cc1 ZINC000551265893 941439351 /nfs/dbraw/zinc/43/93/51/941439351.db2.gz ZVERXACISXPKLN-LADGPHEKSA-N 2 0 406.570 4.419 20 0 HIADRP CC[N@H+](CCC1CC[NH+](C[C@H]2CN(Cc3ccccc3)CCCO2)CC1)CC1CC1 ZINC000551391956 941467970 /nfs/dbraw/zinc/46/79/70/941467970.db2.gz UTWJLMWLJHABHT-SANMLTNESA-N 2 0 413.650 4.112 20 0 HIADRP FC1(c2cccnc2)CC[NH+](CCCC[NH+]2CCC(F)(c3cccnc3)CC2)CC1 ZINC000551464189 941484540 /nfs/dbraw/zinc/48/45/40/941484540.db2.gz ABVLYIDLAGKSJY-UHFFFAOYSA-N 2 0 414.544 4.478 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000551814570 941550792 /nfs/dbraw/zinc/55/07/92/941550792.db2.gz YEJNPGXHTMQBCT-KRWDZBQOSA-N 2 0 407.558 4.240 20 0 HIADRP CCn1nccc1[C@@H]1OCC[C@H]1C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000552054084 941574933 /nfs/dbraw/zinc/57/49/33/941574933.db2.gz JQVXLCRSXRQLMC-PVYVPZCISA-N 2 0 422.617 4.261 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+]C(C)(C)c2cccc(Cl)c2)CC1 ZINC000553339135 941869879 /nfs/dbraw/zinc/86/98/79/941869879.db2.gz ZRNAEPRNFFUUSX-UHFFFAOYSA-N 2 0 413.993 4.254 20 0 HIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000555000491 942350431 /nfs/dbraw/zinc/35/04/31/942350431.db2.gz YYLDQICHPDNFQU-AHKZPQOWSA-N 2 0 416.565 4.335 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3cccc(Br)c3C2)[C@@H](C)C1 ZINC000555545773 942636937 /nfs/dbraw/zinc/63/69/37/942636937.db2.gz CQKXDSHOIOMWAZ-CDXJDZJCSA-N 2 0 409.412 4.033 20 0 HIADRP COc1ccc(CC[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(Cl)c1OC ZINC000556218457 942820103 /nfs/dbraw/zinc/82/01/03/942820103.db2.gz UREWEOFLERCIAJ-FXAWDEMLSA-N 2 0 402.966 4.400 20 0 HIADRP COc1ccc(CC[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(Cl)c1OC ZINC000556218461 942820157 /nfs/dbraw/zinc/82/01/57/942820157.db2.gz UREWEOFLERCIAJ-PXNSSMCTSA-N 2 0 402.966 4.400 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]CCCOCC4CCOCC4)[C@@H]3C2)cc1 ZINC000556870766 942945717 /nfs/dbraw/zinc/94/57/17/942945717.db2.gz JAYFZMMRIYHJMI-GVAUOCQISA-N 2 0 400.607 4.100 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+]CCCc3ccc4c(c3)CCO4)C3(C2)CCOCC3)cc1 ZINC000556936416 942972671 /nfs/dbraw/zinc/97/26/71/942972671.db2.gz OONAQGPEPWRGAO-RUZDIDTESA-N 2 0 420.597 4.073 20 0 HIADRP CN1CC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000557337029 943076621 /nfs/dbraw/zinc/07/66/21/943076621.db2.gz ZDABOOFQVPSRPU-XNMGPUDCSA-N 2 0 421.629 4.483 20 0 HIADRP CC(C)Oc1ccc([C@@H](CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)[NH+](C)C)cc1 ZINC000557954643 943338867 /nfs/dbraw/zinc/33/88/67/943338867.db2.gz MWULXDVJKNITNF-RUZDIDTESA-N 2 0 423.601 4.105 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)c1 ZINC000558292161 943487715 /nfs/dbraw/zinc/48/77/15/943487715.db2.gz DTPSKACBDVXOIC-IEZKXTBUSA-N 2 0 420.601 4.289 20 0 HIADRP CSC1(C[NH2+][C@H](C)c2ccc(OC(F)F)cc2OC(F)F)CC[NH+](C)CC1 ZINC000558507029 943579297 /nfs/dbraw/zinc/57/92/97/943579297.db2.gz CHZASLGQNGDGNB-GFCCVEGCSA-N 2 0 410.477 4.367 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000558703080 943630468 /nfs/dbraw/zinc/63/04/68/943630468.db2.gz KUONRMHRQUYCNP-DEOSSOPVSA-N 2 0 420.601 4.023 20 0 HIADRP CCN(CC)C(=O)C[C@@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000558967344 943774082 /nfs/dbraw/zinc/77/40/82/943774082.db2.gz JABPOKFHEWITNM-YBKQGPHKSA-N 2 0 406.014 4.491 20 0 HIADRP CC1CC[NH+](CC(=O)N[C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000558970230 943776379 /nfs/dbraw/zinc/77/63/79/943776379.db2.gz DESATPRVFFWJON-WYNJDRFBSA-N 2 0 403.998 4.102 20 0 HIADRP C[C@@H](c1ccc(F)cc1)N1CC[C@@H]([NH+]2CCC(CCC[NH+]3CCCC3)CC2)C1=O ZINC000559145600 943853475 /nfs/dbraw/zinc/85/34/75/943853475.db2.gz MVHOYFOEMIFVEY-WMZHIEFXSA-N 2 0 401.570 4.076 20 0 HIADRP c1ccc([C@@H](C[C@H]2CCOC2)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc1 ZINC000559147370 943853944 /nfs/dbraw/zinc/85/39/44/943853944.db2.gz VRNUCBDUAMSZMU-ZEQKJWHPSA-N 2 0 407.602 4.346 20 0 HIADRP CCS(=O)(=O)c1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000560266425 944211859 /nfs/dbraw/zinc/21/18/59/944211859.db2.gz XYXAFYHUSXQLCU-CNNODRBYSA-N 2 0 400.588 4.041 20 0 HIADRP COc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(C)c1OC ZINC000560528593 944243621 /nfs/dbraw/zinc/24/36/21/944243621.db2.gz JEEAAROPGJRKMS-QZTJIDSGSA-N 2 0 415.553 4.315 20 0 HIADRP COc1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(C)c1OC ZINC000560528595 944243943 /nfs/dbraw/zinc/24/39/43/944243943.db2.gz JEEAAROPGJRKMS-ZWKOTPCHSA-N 2 0 415.553 4.315 20 0 HIADRP CC(C)Cc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c1 ZINC000560530487 944244473 /nfs/dbraw/zinc/24/44/73/944244473.db2.gz PKRZKJQMCADKHY-CJFMBICVSA-N 2 0 407.602 4.433 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000561297682 944542997 /nfs/dbraw/zinc/54/29/97/944542997.db2.gz HPIXHGAJVHNYTP-SFTDATJTSA-N 2 0 418.507 4.278 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)NC1CC([NH+]2CCCCC2)C1)c1ccc(Cl)cc1 ZINC000561765834 944786722 /nfs/dbraw/zinc/78/67/22/944786722.db2.gz LOGFELNCJFWZBZ-XVAXZDLZSA-N 2 0 407.002 4.039 20 0 HIADRP CSc1ccc([C@@H](CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)[NH+](C)C)cc1 ZINC000565502771 945840415 /nfs/dbraw/zinc/84/04/15/945840415.db2.gz JBUWYGIRRLMRNY-HSZRJFAPSA-N 2 0 411.615 4.040 20 0 HIADRP Cc1ccc(CN2CC[C@@H]([NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)C2=O)cc1 ZINC000565672180 945863505 /nfs/dbraw/zinc/86/35/05/945863505.db2.gz YQOGAUHLCXLGRO-DDJHWDJXSA-N 2 0 405.586 4.129 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H]1CC(C)(C)c2ccc(Br)cc21 ZINC000565918050 945921028 /nfs/dbraw/zinc/92/10/28/945921028.db2.gz SVHKRPWCVQAQKF-IBGZPJMESA-N 2 0 418.379 4.297 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000568304695 946495908 /nfs/dbraw/zinc/49/59/08/946495908.db2.gz FPVDBYRWIAOEDZ-QPPBQGQZSA-N 3 0 407.602 4.160 20 0 HIADRP Brc1ccc(/C=C\CC[NH+]2CCC(CC[NH+]3CCOCC3)CC2)cc1 ZINC000568795747 946694356 /nfs/dbraw/zinc/69/43/56/946694356.db2.gz DNMSVFQWPDYXQI-IWQZZHSRSA-N 2 0 407.396 4.287 20 0 HIADRP C[C@@H]([NH2+]CC(=O)NC1CC[NH+](C2CC2)CC1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000570149182 947117401 /nfs/dbraw/zinc/11/74/01/947117401.db2.gz HYUMOGHVEAPALH-QGZVFWFLSA-N 2 0 411.521 4.012 20 0 HIADRP C[C@H](C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000572079799 947841378 /nfs/dbraw/zinc/84/13/78/947841378.db2.gz RMVCKSKNYALBFZ-GCJKJVERSA-N 2 0 405.508 4.387 20 0 HIADRP COC(=O)c1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)cn1C ZINC000572286454 947876481 /nfs/dbraw/zinc/87/64/81/947876481.db2.gz KGIGIMMMXBYXSM-UHFFFAOYSA-N 2 0 417.553 4.364 20 0 HIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000572439183 947904587 /nfs/dbraw/zinc/90/45/87/947904587.db2.gz OJEOEVHOBFOJKT-LGMDPLHJSA-N 2 0 404.480 4.045 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)CC1 ZINC000572575083 947952477 /nfs/dbraw/zinc/95/24/77/947952477.db2.gz JYADGRJDPJBDPS-UHFFFAOYSA-N 2 0 420.601 4.155 20 0 HIADRP CC[C@H](C(=O)N[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000572969986 948049731 /nfs/dbraw/zinc/04/97/31/948049731.db2.gz WQRXTSKHTQFSNE-XZOQPEGZSA-N 2 0 421.585 4.001 20 0 HIADRP C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)[C@@H](n2cncn2)C1 ZINC000574343807 948416846 /nfs/dbraw/zinc/41/68/46/948416846.db2.gz UKFAELLIFSISQD-YHYVQYDKSA-N 2 0 401.986 4.163 20 0 HIADRP C[C@@H]1CC[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)[C@H](n2cncn2)C1 ZINC000574343802 948417427 /nfs/dbraw/zinc/41/74/27/948417427.db2.gz UKFAELLIFSISQD-VOQZNFBZSA-N 2 0 401.986 4.163 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(OCC(F)(F)F)cc3)cc2)CC1 ZINC000574386133 948430169 /nfs/dbraw/zinc/43/01/69/948430169.db2.gz ILXQKSKLUMZNBK-UHFFFAOYSA-N 2 0 408.464 4.391 20 0 HIADRP Cc1nc(COc2ccc(C[NH2+]C[C@H]3CCCC[N@H+](Cc4ccccc4)C3)cc2)no1 ZINC000574799045 948529995 /nfs/dbraw/zinc/52/99/95/948529995.db2.gz KBEPUQADBWRURM-HSZRJFAPSA-N 2 0 420.557 4.349 20 0 HIADRP Cc1nc(COc2ccc(C[NH2+]C[C@@H]3CCCC[N@H+](Cc4ccccc4)C3)cc2)no1 ZINC000574799046 948530447 /nfs/dbraw/zinc/53/04/47/948530447.db2.gz KBEPUQADBWRURM-QHCPKHFHSA-N 2 0 420.557 4.349 20 0 HIADRP COc1cccc(-c2nn(C(C)(C)C)cc2C[NH2+]CC2(SC)CC[NH+](C)CC2)c1 ZINC000575625557 948684136 /nfs/dbraw/zinc/68/41/36/948684136.db2.gz QKVUQKDGTNQTNZ-UHFFFAOYSA-N 2 0 416.635 4.231 20 0 HIADRP c1ccc(C[N@@H+]2CCc3nc(N4CC[C@]5(C[NH2+]C[C@H]5c5ccccc5)C4)ccc3C2)cc1 ZINC001164618371 719045209 /nfs/dbraw/zinc/04/52/09/719045209.db2.gz AVVPIFMNMMODOK-LSYYVWMOSA-N 2 0 424.592 4.223 20 0 HIADRP CC(C)(c1ccnc(Cl)c1)[NH+]1CCC2(CC1)C[N@H+](Cc1cccs1)CCO2 ZINC001164707297 719908734 /nfs/dbraw/zinc/90/87/34/719908734.db2.gz OVNGOVAIOPOULQ-UHFFFAOYSA-N 2 0 405.995 4.399 20 0 HIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@H]2CC[NH+]3Cc2cccnc2)nc1 ZINC001164732090 720471665 /nfs/dbraw/zinc/47/16/65/720471665.db2.gz YNTUFGGWCCMPAP-WXFUMESZSA-N 2 0 405.590 4.267 20 0 HIADRP O=C([C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1)N1CCCCC1 ZINC000436281190 861590385 /nfs/dbraw/zinc/59/03/85/861590385.db2.gz FXTZHIXROSYBIG-NHTNDUFYSA-N 2 0 409.618 4.058 20 0 HIADRP CC[NH+]1CCC([NH2+]Cc2cn(-c3ccccc3)nc2-c2cc(OC)ccc2OC)CC1 ZINC000017313586 846243921 /nfs/dbraw/zinc/24/39/21/846243921.db2.gz ORUPGXMJJWFJFK-UHFFFAOYSA-N 2 0 420.557 4.130 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C(=O)Nc1cccc2ncccc21 ZINC000026985282 847230468 /nfs/dbraw/zinc/23/04/68/847230468.db2.gz LWAXTNDXXKPNLE-LJQANCHMSA-N 2 0 402.542 4.338 20 0 HIADRP COc1cccc([C@@H](CNC(=O)c2ccc(C[NH+]3CCCCC3)cc2)[NH+]2CCCC2)c1 ZINC000027341972 847285861 /nfs/dbraw/zinc/28/58/61/847285861.db2.gz XICYPNZBQRMRLO-RUZDIDTESA-N 2 0 421.585 4.248 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC([NH+]2CCCCC2)CC1 ZINC000045780581 848727716 /nfs/dbraw/zinc/72/77/16/848727716.db2.gz HLUQDYUUXBEOGM-OAQYLSRUSA-N 2 0 412.622 4.221 20 0 HIADRP c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+]Cc3cccc4c3OCO4)CC2)cc1 ZINC000047702752 849092983 /nfs/dbraw/zinc/09/29/83/849092983.db2.gz ZAKFPJKCLHSYCT-UHFFFAOYSA-N 2 0 415.537 4.027 20 0 HIADRP CC[C@H]([NH2+][C@H](C)CCN1CC[NH+](C)CC1)c1ccc(Br)cc1Cl ZINC000437031140 862217438 /nfs/dbraw/zinc/21/74/38/862217438.db2.gz VUAWUQNHWPKQNG-KDOFPFPSSA-N 2 0 402.808 4.169 20 0 HIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCCC[NH+]2CCOCC2)cc1C ZINC000060979268 851265588 /nfs/dbraw/zinc/26/55/88/851265588.db2.gz AKNIVBCWNIQTLA-UHFFFAOYSA-N 2 0 418.585 4.358 20 0 HIADRP Brc1ccccc1-c1ccc(C[NH2+]CCCC[NH+]2CCOCC2)s1 ZINC000060979342 851265784 /nfs/dbraw/zinc/26/57/84/851265784.db2.gz POMMCMUMSVGBQC-UHFFFAOYSA-N 2 0 409.393 4.380 20 0 HIADRP CC1(C)CC(NC(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)CC(C)(C)[NH2+]1 ZINC000061011695 851272024 /nfs/dbraw/zinc/27/20/24/851272024.db2.gz YBDSSMAPGSKJGY-UHFFFAOYSA-N 2 0 400.611 4.171 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1 ZINC000061229781 851323120 /nfs/dbraw/zinc/32/31/20/851323120.db2.gz APENUMCKLXGFKB-XMMPIXPASA-N 2 0 408.590 4.163 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1)C1CC1 ZINC000437044890 862237340 /nfs/dbraw/zinc/23/73/40/862237340.db2.gz RNJYBMCODXZCNL-QHCPKHFHSA-N 2 0 405.586 4.265 20 0 HIADRP Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000061596828 851412004 /nfs/dbraw/zinc/41/20/04/851412004.db2.gz LSUUZQRTUBLJPN-HSZRJFAPSA-N 2 0 423.626 4.395 20 0 HIADRP C/C=C/c1ccc(OC[C@H](O)C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c(OC)c1 ZINC000061735380 851433620 /nfs/dbraw/zinc/43/36/20/851433620.db2.gz WSIGXYLAXYZBPP-DHXBXMGCSA-N 2 0 416.606 4.056 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccccc3Br)CC2)cc1 ZINC000063319581 851658691 /nfs/dbraw/zinc/65/86/91/851658691.db2.gz VINRXCCVYMLXEE-UHFFFAOYSA-N 2 0 403.364 4.460 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)c2ccccc2)CC1 ZINC000065992240 852344895 /nfs/dbraw/zinc/34/48/95/852344895.db2.gz CHEZYRNECZNHNH-AREMUKBSSA-N 2 0 419.613 4.488 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NC1CC[NH+](CC2CCCCC2)CC1 ZINC000066037553 852362448 /nfs/dbraw/zinc/36/24/48/852362448.db2.gz TWOMWFBKXZXRGQ-UHFFFAOYSA-N 2 0 414.638 4.372 20 0 HIADRP COc1ccccc1[C@H](C)NC(=O)[C@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000097549404 852628121 /nfs/dbraw/zinc/62/81/21/852628121.db2.gz AXWHERGEQRLWRP-SFTDATJTSA-N 2 0 423.601 4.105 20 0 HIADRP COc1ccccc1[C@H](C)NC(=O)[C@@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000097549402 852628358 /nfs/dbraw/zinc/62/83/58/852628358.db2.gz AXWHERGEQRLWRP-LEWJYISDSA-N 2 0 423.601 4.105 20 0 HIADRP COc1ccccc1[C@@H](C)NC(=O)[C@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000097549405 852628435 /nfs/dbraw/zinc/62/84/35/852628435.db2.gz AXWHERGEQRLWRP-RTWAWAEBSA-N 2 0 423.601 4.105 20 0 HIADRP C[C@H](C(=O)NC[C@@H](C)c1ccccc1)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000110913341 853167700 /nfs/dbraw/zinc/16/77/00/853167700.db2.gz JNHJJGBENUSWFD-FGZHOGPDSA-N 2 0 407.602 4.139 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)Nc1ccc(N2CC[NH+](CC)CC2)cc1C)c1ccccc1 ZINC000111034110 853190163 /nfs/dbraw/zinc/19/01/63/853190163.db2.gz WRLLDMCYHXJFLT-XMMPIXPASA-N 2 0 408.590 4.159 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NC[C@@H](c1ccccc1OC)[NH+]1CCCC1)c1ccccc1 ZINC000111075248 853197890 /nfs/dbraw/zinc/19/78/90/853197890.db2.gz KKEHNWTXOMPPQS-LADGPHEKSA-N 2 0 409.574 4.031 20 0 HIADRP Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000147365129 853587074 /nfs/dbraw/zinc/58/70/74/853587074.db2.gz QNWAVGPPNZSPPI-QHCPKHFHSA-N 2 0 409.599 4.147 20 0 HIADRP CC(C)(C)c1n[nH]cc1C[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000236763191 853920225 /nfs/dbraw/zinc/92/02/25/853920225.db2.gz YVYRJAALFRPSDL-UHFFFAOYSA-N 2 0 417.601 4.319 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccnc(N3CCCCCC3)c2)CC1 ZINC000236815431 853925897 /nfs/dbraw/zinc/92/58/97/853925897.db2.gz LQKGGADCRPMOSH-UHFFFAOYSA-N 2 0 421.633 4.284 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2ccc(F)c(-c3cccs3)c2)cc1 ZINC000237176953 853976244 /nfs/dbraw/zinc/97/62/44/853976244.db2.gz POUPRVSRBLYIFW-UHFFFAOYSA-N 2 0 411.546 4.135 20 0 HIADRP COc1c(C)cc(C[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)cc1C ZINC000237191340 853978777 /nfs/dbraw/zinc/97/87/77/853978777.db2.gz OPHLWUVGLLFIOP-UHFFFAOYSA-N 2 0 412.574 4.091 20 0 HIADRP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)ccc1OCc1c(C)noc1C ZINC000237277317 853996643 /nfs/dbraw/zinc/99/66/43/853996643.db2.gz LBZVKVXGLASNSF-HXUWFJFHSA-N 2 0 401.551 4.089 20 0 HIADRP COc1cc(C[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)ccc1OCC(F)(F)F ZINC000237315346 854005052 /nfs/dbraw/zinc/00/50/52/854005052.db2.gz CMLGWKODJHIGMX-UHFFFAOYSA-N 2 0 400.416 4.127 20 0 HIADRP CSc1ccc(C[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)cc1 ZINC000237392774 854021823 /nfs/dbraw/zinc/02/18/23/854021823.db2.gz ICJBEBUUQRKLFX-UHFFFAOYSA-N 2 0 400.588 4.188 20 0 HIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000237403539 854024400 /nfs/dbraw/zinc/02/44/00/854024400.db2.gz HSXNDHMQCLMSLG-QZTJIDSGSA-N 2 0 419.013 4.181 20 0 HIADRP C[C@@H](C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccnc1)C[NH+]1CCCCC1 ZINC000237418841 854029001 /nfs/dbraw/zinc/02/90/01/854029001.db2.gz XIWVLZJZKVNBKI-NRFANRHFSA-N 2 0 403.574 4.205 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2nc(-c3ccc(Br)cc3)c[nH]2)C1 ZINC000237464690 854038180 /nfs/dbraw/zinc/03/81/80/854038180.db2.gz QKRQPKYYLCKTMY-MRXNPFEDSA-N 2 0 405.384 4.441 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(OC(F)(F)F)cc2)C[C@H](C)O1 ZINC000237622356 854064054 /nfs/dbraw/zinc/06/40/54/854064054.db2.gz QRDXPRBPNSKNBS-CALCHBBNSA-N 2 0 408.464 4.484 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2cc3ccccc3nc2N2CCCCC2)C[C@H](C)O1 ZINC000237774155 854093600 /nfs/dbraw/zinc/09/36/00/854093600.db2.gz CRGFNFCKNHNKDM-OYRHEFFESA-N 2 0 410.606 4.204 20 0 HIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccccc2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000237775914 854095012 /nfs/dbraw/zinc/09/50/12/854095012.db2.gz GOHLYCFKTSNCAY-BGYRXZFFSA-N 2 0 404.558 4.284 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000237965576 854126109 /nfs/dbraw/zinc/12/61/09/854126109.db2.gz PEHRNFKEZULBRP-SFHVURJKSA-N 2 0 413.509 4.155 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000237965310 854126477 /nfs/dbraw/zinc/12/64/77/854126477.db2.gz JSLWYGJAKIWTSY-DEOSSOPVSA-N 2 0 422.548 4.005 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)[NH+]2CCCC2)o1 ZINC000303151858 854787859 /nfs/dbraw/zinc/78/78/59/854787859.db2.gz RQLJZCRRCMCQPP-HSZRJFAPSA-N 2 0 424.589 4.210 20 0 HIADRP O=C(NCCCCC[NH+]1CCCCC1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000303517169 855004385 /nfs/dbraw/zinc/00/43/85/855004385.db2.gz YEKKTDZUXCJFTI-CWAQXLGLSA-N 2 0 412.622 4.137 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NCC(C)(C)[N@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000303688207 855133982 /nfs/dbraw/zinc/13/39/82/855133982.db2.gz UMIQLHLKBHXCAZ-HBMCJLEFSA-N 2 0 414.638 4.268 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCC[NH+]2Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303767636 855185803 /nfs/dbraw/zinc/18/58/03/855185803.db2.gz QBLJLAMIMFVEIG-SDUSCBPUSA-N 2 0 405.586 4.163 20 0 HIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381878467 855432551 /nfs/dbraw/zinc/43/25/51/855432551.db2.gz NVHSSGIKOSMSSM-FRVYCDFKSA-N 2 0 413.606 4.417 20 0 HIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(Br)cc1F ZINC000397590414 855472954 /nfs/dbraw/zinc/47/29/54/855472954.db2.gz JIWFRFPSPBBWNO-MRXNPFEDSA-N 2 0 421.354 4.266 20 0 HIADRP CC(C)(C)OC(=O)NC1CCC([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000397505694 855472968 /nfs/dbraw/zinc/47/29/68/855472968.db2.gz IRKBVXMNNCEJCD-UHFFFAOYSA-N 2 0 401.595 4.324 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NCCCC[NH+]2CCCC[C@H]2C)C1 ZINC000410360660 855949614 /nfs/dbraw/zinc/94/96/14/855949614.db2.gz SCYKTYXNNBNJLQ-FGZHOGPDSA-N 2 0 414.638 4.372 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000410382953 855964209 /nfs/dbraw/zinc/96/42/09/855964209.db2.gz MRSLEERQDVJBEX-NHCUHLMSSA-N 2 0 402.627 4.084 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000426045281 856069541 /nfs/dbraw/zinc/06/95/41/856069541.db2.gz BSELRTFWVYKRLX-WXFUMESZSA-N 2 0 413.993 4.376 20 0 HIADRP C[NH+](C)CCN(Cc1ccccc1)C(=O)Nc1ccc(OCC[NH+]2CCCCC2)cc1 ZINC000426135010 856130926 /nfs/dbraw/zinc/13/09/26/856130926.db2.gz BTRVYBLOUCWVIL-UHFFFAOYSA-N 2 0 424.589 4.147 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000428645623 857287761 /nfs/dbraw/zinc/28/77/61/857287761.db2.gz ZNKBAYAWPLPLTA-RDGATRHJSA-N 2 0 419.613 4.316 20 0 HIADRP CC[N@@H+]1CCCN(C(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000428690247 857298283 /nfs/dbraw/zinc/29/82/83/857298283.db2.gz KDAZFTFZMDCJJE-UHFFFAOYSA-N 2 0 420.601 4.187 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)cc1 ZINC000429428276 857660855 /nfs/dbraw/zinc/66/08/55/857660855.db2.gz IRMIMQIMOQGZLE-VWLOTQADSA-N 2 0 419.544 4.191 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)CC1 ZINC000429520276 857713723 /nfs/dbraw/zinc/71/37/23/857713723.db2.gz XKTOIBABWCTSSL-DEOSSOPVSA-N 2 0 404.533 4.046 20 0 HIADRP Cc1cc(C)n(-c2ccc(C[N@@H+](C)CCC3CC[NH+](C4CCN(C)CC4)CC3)cc2)n1 ZINC000430950122 858379708 /nfs/dbraw/zinc/37/97/08/858379708.db2.gz GCFLZOSYFPDFNB-UHFFFAOYSA-N 2 0 423.649 4.117 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000431623178 858696286 /nfs/dbraw/zinc/69/62/86/858696286.db2.gz RYWOFDYNKBYCMQ-QPPBQGQZSA-N 2 0 414.638 4.097 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)CC1 ZINC000431626615 858698276 /nfs/dbraw/zinc/69/82/76/858698276.db2.gz WMQRYSLVPFDGMA-IFMALSPDSA-N 2 0 420.667 4.188 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000431642833 858708202 /nfs/dbraw/zinc/70/82/02/858708202.db2.gz IKRWNUXYTFPRHR-OAQYLSRUSA-N 2 0 420.667 4.017 20 0 HIADRP C[C@H]1CN(CCC[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCCO1 ZINC000432424566 859158712 /nfs/dbraw/zinc/15/87/12/859158712.db2.gz PFIXTRMFURJOPO-LPHOPBHVSA-N 2 0 403.567 4.417 20 0 HIADRP COc1cc(C[NH+]2CCC[C@](C)(OC)CC2)cc(C[N@@H+]2CCC[C@](C)(OC)CC2)c1 ZINC000433201028 859564959 /nfs/dbraw/zinc/56/49/59/859564959.db2.gz KIGNACVVSPIUTC-DQEYMECFSA-N 2 0 418.622 4.477 20 0 HIADRP C[C@H](c1ccc(F)cc1)N(C)C(=O)C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433214535 859570713 /nfs/dbraw/zinc/57/07/13/859570713.db2.gz UMMGMEQUDFCIPR-OAQYLSRUSA-N 2 0 423.576 4.333 20 0 HIADRP CN1CCO[C@@H]([C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c2ccc(Cl)cc2)C1 ZINC000467736041 881538958 /nfs/dbraw/zinc/53/89/58/881538958.db2.gz TWXGKSZDXZWXCS-DNQXCXABSA-N 2 0 413.993 4.097 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)c1)C1CCOCC1 ZINC000438196148 863624493 /nfs/dbraw/zinc/62/44/93/863624493.db2.gz CQAHWPSXBFMPGD-RBUKOAKNSA-N 2 0 414.512 4.387 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](c2ccc(Br)s2)C2CC2)C1 ZINC000439137634 864571387 /nfs/dbraw/zinc/57/13/87/864571387.db2.gz BAHAHZLAFTWPNW-XLIONFOSSA-N 2 0 421.404 4.318 20 0 HIADRP c1ccc(CN2CC[NH+](CCCC[NH2+]Cc3cccc(-c4ccncc4)c3)CC2)cc1 ZINC000439473023 864844870 /nfs/dbraw/zinc/84/48/70/864844870.db2.gz KWKLDUXMHOYRRN-UHFFFAOYSA-N 2 0 414.597 4.436 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C(=O)N1CCSc2ccccc21 ZINC000439547521 864874905 /nfs/dbraw/zinc/87/49/05/864874905.db2.gz KAMCHQMLMMBXHL-LJQANCHMSA-N 2 0 409.599 4.290 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N1CCCc2ccccc21 ZINC000439593941 864915066 /nfs/dbraw/zinc/91/50/66/864915066.db2.gz HKTAIXQKPQBPIU-HXUWFJFHSA-N 2 0 417.553 4.369 20 0 HIADRP COc1ccccc1NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000439595505 864918778 /nfs/dbraw/zinc/91/87/78/864918778.db2.gz KCUUMASURTZPIA-SFHVURJKSA-N 2 0 407.514 4.037 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC[NH+]([C@H](C)c3ccncc3)CC2)cc1)C(C)C ZINC000439747593 865077138 /nfs/dbraw/zinc/07/71/38/865077138.db2.gz PMWGDLGLIUYWBL-HXUWFJFHSA-N 2 0 408.590 4.267 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)cc1)C(C)C ZINC000439747592 865077582 /nfs/dbraw/zinc/07/75/82/865077582.db2.gz PMWGDLGLIUYWBL-FQEVSTJZSA-N 2 0 408.590 4.267 20 0 HIADRP Cc1ccc(NC2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)cc1NC(=O)CC[NH+](C)C ZINC000468044923 881872190 /nfs/dbraw/zinc/87/21/90/881872190.db2.gz NUERZSAMWMJSPC-AUSIDOKSSA-N 2 0 400.611 4.340 20 0 HIADRP Cc1ccc(NC2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)cc1NC(=O)CC[NH+](C)C ZINC000468044925 881872418 /nfs/dbraw/zinc/87/24/18/881872418.db2.gz NUERZSAMWMJSPC-WMZHIEFXSA-N 2 0 400.611 4.340 20 0 HIADRP COc1ccc2cc(CN(C)C(=O)[C@H](C)N(C)CC[C@@H]3CCCC[N@@H+]3C)ccc2c1 ZINC000441327240 866398064 /nfs/dbraw/zinc/39/80/64/866398064.db2.gz GKNOBYARVCANMI-CVDCTZTESA-N 2 0 411.590 4.002 20 0 HIADRP Cc1ccccc1[C@H](OC[C@H](O)C[N@H+](C)CC[C@@H]1CCCC[NH+]1C)c1ccccc1 ZINC000441364256 866431667 /nfs/dbraw/zinc/43/16/67/866431667.db2.gz ZACFCDUQCDNCID-BFLUCZKCSA-N 2 0 410.602 4.268 20 0 HIADRP Cc1ccc([C@H](Cn2ccnc2)NC(=O)c2cccc(C[NH+]3CCCC3)c2)c(C)c1 ZINC000442187627 867209912 /nfs/dbraw/zinc/20/99/12/867209912.db2.gz KSASPTVJPJRHCM-DEOSSOPVSA-N 2 0 402.542 4.267 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H]3CC[C@@H](c4ccc(C(F)(F)F)cc4)C3)ccn2)CC1 ZINC000442722695 867648544 /nfs/dbraw/zinc/64/85/44/867648544.db2.gz VZODQMHGDLUXFM-CTNGQTDRSA-N 2 0 418.507 4.278 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+][C@@H]3CC[C@@H](c4ccc(C(F)(F)F)cc4)C3)CC2)CC1 ZINC000442784112 867674301 /nfs/dbraw/zinc/67/43/01/867674301.db2.gz SJPCUJFMEPOYOY-WIYYLYMNSA-N 2 0 409.540 4.490 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CCN1CC[N@H+](C)C(C)(C)C1 ZINC000442865748 867704227 /nfs/dbraw/zinc/70/42/27/867704227.db2.gz GIOQZKUMZLOBPM-OAHLLOKOSA-N 2 0 407.027 4.449 20 0 HIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000443011798 867791016 /nfs/dbraw/zinc/79/10/16/867791016.db2.gz HHRWNJUKLXMNBB-FQEVSTJZSA-N 2 0 419.491 4.001 20 0 HIADRP CCCc1cc(N2CCC(C(=O)NCCC[NH+]3CCCC3)CC2)c2ccccc2[nH+]1 ZINC000443670639 868276683 /nfs/dbraw/zinc/27/66/83/868276683.db2.gz AGHOPQFUIVXWSU-UHFFFAOYSA-N 2 0 408.590 4.006 20 0 HIADRP Cc1ccc(NC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)c(OCC[NH+](C)C)c1 ZINC000443926700 868464210 /nfs/dbraw/zinc/46/42/10/868464210.db2.gz GPJMDCFVHRUQPB-UHFFFAOYSA-N 2 0 416.610 4.100 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)cc1 ZINC000443994578 868516444 /nfs/dbraw/zinc/51/64/44/868516444.db2.gz FARRNQCKBMCVEK-UHFFFAOYSA-N 2 0 421.516 4.199 20 0 HIADRP COc1ccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(OCc2cccnc2)c1 ZINC000444000670 868519854 /nfs/dbraw/zinc/51/98/54/868519854.db2.gz XBNUUAGLPFTBRY-UHFFFAOYSA-N 2 0 418.541 4.070 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(CNC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)c1 ZINC000444002783 868523787 /nfs/dbraw/zinc/52/37/87/868523787.db2.gz GTZCRJHNBPDMGF-UHFFFAOYSA-N 2 0 407.602 4.445 20 0 HIADRP CCN(CCC[NH+](C)C)C(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000468438638 882381040 /nfs/dbraw/zinc/38/10/40/882381040.db2.gz MVMDAGBNJBQRHC-UHFFFAOYSA-N 2 0 422.617 4.433 20 0 HIADRP c1c[nH]c([C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c2ccccc2)n1 ZINC000446924376 870837616 /nfs/dbraw/zinc/83/76/16/870837616.db2.gz GDGBKBYGUTVKDP-XMMPIXPASA-N 2 0 404.558 4.160 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](CCCOc1ccccc1)C1CCOCC1 ZINC000468539610 882574118 /nfs/dbraw/zinc/57/41/18/882574118.db2.gz DOMLPRINSFWARM-UHFFFAOYSA-N 2 0 406.530 4.026 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)N3CC[C@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)cc2)CC1 ZINC000448203794 872096074 /nfs/dbraw/zinc/09/60/74/872096074.db2.gz YVSGBPLQHBQHMA-ZCYQVOJMSA-N 2 0 424.633 4.077 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000448212821 872113104 /nfs/dbraw/zinc/11/31/04/872113104.db2.gz MAYJSLSHJLKBNP-ILBGXUMGSA-N 2 0 424.633 4.221 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000448221105 872129392 /nfs/dbraw/zinc/12/93/92/872129392.db2.gz WCCLPDYQMJRUGH-ZCYQVOJMSA-N 2 0 424.633 4.221 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCCCC2)cc1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000448409304 872363932 /nfs/dbraw/zinc/36/39/32/872363932.db2.gz FECUIFLFWAVQLX-XUZZJYLKSA-N 2 0 410.606 4.196 20 0 HIADRP CCN(C(=O)Nc1ccc(C)cc1OCC[NH+](C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000460132809 872619296 /nfs/dbraw/zinc/61/92/96/872619296.db2.gz ULILXGLCOGIQRO-JOCHJYFZSA-N 2 0 424.589 4.064 20 0 HIADRP O=C(NC[C@H]1CCCC[N@H+](Cc2ccccc2)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000461465855 874522702 /nfs/dbraw/zinc/52/27/02/874522702.db2.gz GIQSIQWTZSHKIT-RUZDIDTESA-N 2 0 419.613 4.317 20 0 HIADRP Cc1c([C@H](C)[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)cnn1C(C)(C)C ZINC000468828059 882879637 /nfs/dbraw/zinc/87/96/37/882879637.db2.gz FBVFLEGINIVPSM-NRFANRHFSA-N 2 0 411.638 4.195 20 0 HIADRP CCC[NH+]1CCC([NH2+]CCSCCOc2cccc(Br)c2)CC1 ZINC000462118148 875222049 /nfs/dbraw/zinc/22/20/49/875222049.db2.gz CZMMLIYDRSIYGB-UHFFFAOYSA-N 2 0 401.414 4.025 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000462166205 875263606 /nfs/dbraw/zinc/26/36/06/875263606.db2.gz FAYRDBDQJNPWIQ-DNRQZRRGSA-N 2 0 420.601 4.032 20 0 HIADRP COc1ccccc1/C=C\C[NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000462722963 875800251 /nfs/dbraw/zinc/80/02/51/875800251.db2.gz CTQREGIJZHTNKI-ALCCZGGFSA-N 2 0 419.491 4.269 20 0 HIADRP C[NH+](C)CCCC1CCN(C(=O)NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000462748041 875815202 /nfs/dbraw/zinc/81/52/02/875815202.db2.gz ZVICVFSZKBVESW-XMMPIXPASA-N 2 0 414.638 4.052 20 0 HIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CCN(C2CC[NH+](C(C)C)CC2)CC1 ZINC000463113320 876153550 /nfs/dbraw/zinc/15/35/50/876153550.db2.gz YAIOWKICTXDDBO-UHFFFAOYSA-N 2 0 411.638 4.005 20 0 HIADRP COc1ccc([C@H](CN[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[NH+]2CCCC2)cc1 ZINC000463141810 876193151 /nfs/dbraw/zinc/19/31/51/876193151.db2.gz ZZYKNXURAATERF-CVJWPJSTSA-N 2 0 407.602 4.475 20 0 HIADRP COc1ccc([C@H](CN[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[NH+]2CCCC2)cc1 ZINC000463141812 876193666 /nfs/dbraw/zinc/19/36/66/876193666.db2.gz ZZYKNXURAATERF-NZJKTDFXSA-N 2 0 407.602 4.475 20 0 HIADRP Cc1ccc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)c(-n2cc(Cl)cn2)n1 ZINC000468961774 883027062 /nfs/dbraw/zinc/02/70/62/883027062.db2.gz MVTXEBLLICPDSY-QGZVFWFLSA-N 2 0 413.953 4.020 20 0 HIADRP Cc1cc(Cl)ccc1C[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000463742827 876865015 /nfs/dbraw/zinc/86/50/15/876865015.db2.gz DDYVURTVNNZGOA-UHFFFAOYSA-N 2 0 402.966 4.428 20 0 HIADRP CC1(C)[C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)C[C@H]1c1ccccc1 ZINC000464093830 877249615 /nfs/dbraw/zinc/24/96/15/877249615.db2.gz QDUJILCWUGNSTP-TZRRMPRUSA-N 2 0 405.586 4.056 20 0 HIADRP CC1(C)[C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)C[C@H]1c1ccccc1 ZINC000464093827 877249713 /nfs/dbraw/zinc/24/97/13/877249713.db2.gz QDUJILCWUGNSTP-KMDXXIMOSA-N 2 0 405.586 4.056 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464828637 878082102 /nfs/dbraw/zinc/08/21/02/878082102.db2.gz DAZDGIVLBOBAKG-IBGZPJMESA-N 2 0 415.965 4.131 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)[NH+]2CCCC2)o1 ZINC000503342918 912319491 /nfs/dbraw/zinc/31/94/91/912319491.db2.gz LILROMNKICBWCQ-VXKWHMMOSA-N 2 0 416.610 4.023 20 0 HIADRP C[C@@H]1CCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000465444449 878874583 /nfs/dbraw/zinc/87/45/83/878874583.db2.gz RDKDLIBNVUASAB-RCZVLFRGSA-N 2 0 420.601 4.130 20 0 HIADRP CCC(CC)[C@@H](CNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCCC1 ZINC000465571641 879044904 /nfs/dbraw/zinc/04/49/04/879044904.db2.gz HKXDADNRGAMBLP-ISKFKSNPSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H]1CCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000465588567 879070352 /nfs/dbraw/zinc/07/03/52/879070352.db2.gz BOSVMBYGSHNXIT-JOCHJYFZSA-N 2 0 420.601 4.088 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CC[C@@H](C)[NH+](Cc3ccccc3)CC2)C1 ZINC000465606023 879097630 /nfs/dbraw/zinc/09/76/30/879097630.db2.gz QMFDQFMVHDMQJG-XPWALMASSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000465723896 879299615 /nfs/dbraw/zinc/29/96/15/879299615.db2.gz RVGLZPGQPMHLOV-XXBNENTESA-N 2 0 400.611 4.075 20 0 HIADRP C[C@H]1C[C@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000465723893 879300049 /nfs/dbraw/zinc/30/00/49/879300049.db2.gz RVGLZPGQPMHLOV-WMZHIEFXSA-N 2 0 400.611 4.075 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)NC[C@H]2CCC[NH+](C)[C@H]2c2cccs2)C1 ZINC000465750035 879337579 /nfs/dbraw/zinc/33/75/79/879337579.db2.gz HLGREOGHLICGCZ-RCLSDMTESA-N 2 0 420.667 4.187 20 0 HIADRP CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)NCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000465805737 879419329 /nfs/dbraw/zinc/41/93/29/879419329.db2.gz FNSRXJHPLMWLBJ-HSZRJFAPSA-N 2 0 400.611 4.078 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N1CCC[C@H](C[NH+]2CCC(C)CC2)C1)c1ccsc1 ZINC000503446327 912468951 /nfs/dbraw/zinc/46/89/51/912468951.db2.gz KONPSKBPWLTRCG-IRLDBZIGSA-N 2 0 420.667 4.285 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)CCCC1)c1ccccc1 ZINC000465911888 879573011 /nfs/dbraw/zinc/57/30/11/879573011.db2.gz SBTAIYFDFHPHRF-IRLDBZIGSA-N 2 0 400.611 4.166 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NC[C@@H]2CCC[NH+](C)[C@H]2c2cccs2)CC1 ZINC000466087543 879807177 /nfs/dbraw/zinc/80/71/77/879807177.db2.gz YIQGCMGUCNLZFE-RBBKRZOGSA-N 2 0 420.667 4.285 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CCC[C@H]([C@H]4CCOC4)C3)CC2)cc1 ZINC000466347617 880104819 /nfs/dbraw/zinc/10/48/19/880104819.db2.gz SGGOULPSLMVNIL-KMDXXIMOSA-N 2 0 400.607 4.243 20 0 HIADRP C[NH+](C)CCn1ccc2ccc(NC(=O)c3oc4ccccc4c3C[NH+](C)C)cc21 ZINC000467096490 880859999 /nfs/dbraw/zinc/85/99/99/880859999.db2.gz QQIJRMUHYJFXPG-UHFFFAOYSA-N 2 0 404.514 4.263 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[NH+]1CCN(c3ccccc3)CC1)CCS2 ZINC000467396077 881180375 /nfs/dbraw/zinc/18/03/75/881180375.db2.gz WGNJDOGQWUILNW-QHCPKHFHSA-N 2 0 411.615 4.424 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H]2CCSc3ccc(OC)cc32)CC1 ZINC000467416536 881205159 /nfs/dbraw/zinc/20/51/59/881205159.db2.gz GVNHTSAGSZBDOK-QHCPKHFHSA-N 2 0 411.615 4.159 20 0 HIADRP Brc1cccc([C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)C2CCOCC2)c1 ZINC000467426273 881214765 /nfs/dbraw/zinc/21/47/65/881214765.db2.gz AKXROZYTFNHKIE-NRFANRHFSA-N 2 0 407.396 4.381 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC([NH+]2CCCC2)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000503691647 912796479 /nfs/dbraw/zinc/79/64/79/912796479.db2.gz YEXDTWPTELDWPU-FQEVSTJZSA-N 2 0 400.611 4.166 20 0 HIADRP Brc1cc2cccnc2c(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1 ZINC000470195747 884504343 /nfs/dbraw/zinc/50/43/43/884504343.db2.gz QMNHEKNFHIHKLM-UHFFFAOYSA-N 2 0 418.379 4.074 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(C)[C@H]2CCC[NH+](Cc3ccccc3)C2)cc1)C1CC1 ZINC000470675222 885107368 /nfs/dbraw/zinc/10/73/68/885107368.db2.gz YMZVWMGWRAENIU-VWLOTQADSA-N 2 0 405.586 4.408 20 0 HIADRP Cc1c([C@H](C)[NH2+][C@H](C)CCN2CC[NH+](C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000471592748 886303637 /nfs/dbraw/zinc/30/36/37/886303637.db2.gz GPHWMTRWZSHZMM-CVEARBPZSA-N 2 0 424.420 4.164 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000471596427 886308717 /nfs/dbraw/zinc/30/87/17/886308717.db2.gz LKNHTTCWSMEPOV-APWZRJJASA-N 2 0 419.038 4.457 20 0 HIADRP C[NH+](C)CC1CCN(c2ccccc2NC(=O)[C@H]2CC[N@@H+](C3CCCCC3)C2)CC1 ZINC000473275165 888032589 /nfs/dbraw/zinc/03/25/89/888032589.db2.gz HKJMQIJGKQCKGV-NRFANRHFSA-N 2 0 412.622 4.058 20 0 HIADRP CCN(C(=O)NCc1cccc(C[NH+](C)C)c1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473943892 888820833 /nfs/dbraw/zinc/82/08/33/888820833.db2.gz IVQQYCYQBWCORH-RDPSFJRHSA-N 2 0 408.590 4.115 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCN(c2ccc(Cl)cc2Cl)C1 ZINC000474021764 888873820 /nfs/dbraw/zinc/87/38/20/888873820.db2.gz NHJGUEMWXLZRKM-KRWDZBQOSA-N 2 0 402.329 4.251 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CCCC[C@@H]3[C@H]3CCOC3)CC2)cc1 ZINC000474056743 888893068 /nfs/dbraw/zinc/89/30/68/888893068.db2.gz MCODGCBTMOTLNB-ICDZXHCJSA-N 2 0 400.607 4.243 20 0 HIADRP CC[N@@H+](Cc1ccc(Cl)cc1-n1cncn1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000474276324 889139949 /nfs/dbraw/zinc/13/99/49/889139949.db2.gz QLQDDFVGHYUGBW-HXUWFJFHSA-N 2 0 409.965 4.265 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)[C@@H](C)C1 ZINC000474425395 889289585 /nfs/dbraw/zinc/28/95/85/889289585.db2.gz JDLYMSQBXOCNBU-HQRMLTQVSA-N 2 0 414.421 4.299 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccnn3-c3ccccc3C)CC2)cc1 ZINC000474598335 889466212 /nfs/dbraw/zinc/46/62/12/889466212.db2.gz LCJNIOKXPWYAJZ-UHFFFAOYSA-N 2 0 404.558 4.191 20 0 HIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000474610879 889474783 /nfs/dbraw/zinc/47/47/83/889474783.db2.gz DOIGNAAHUOKSEA-NHCUHLMSSA-N 2 0 404.558 4.080 20 0 HIADRP C[C@@H](CCc1ccc(I)cc1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000474621595 889486516 /nfs/dbraw/zinc/48/65/16/889486516.db2.gz XMOLIPXTYYOIOU-HNNXBMFYSA-N 2 0 412.359 4.076 20 0 HIADRP CCOC(=O)C1(C)CCC([NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)CC1 ZINC000474708443 889567380 /nfs/dbraw/zinc/56/73/80/889567380.db2.gz LBAUDYAQIXJPJE-NWKXHEKXSA-N 2 0 419.585 4.130 20 0 HIADRP CCOC(=O)C1(C)CCC([NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)CC1 ZINC000474708444 889567457 /nfs/dbraw/zinc/56/74/57/889567457.db2.gz LBAUDYAQIXJPJE-ZGIGLSJSSA-N 2 0 419.585 4.130 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)C[NH2+][C@H](Cc1ccccc1)c1cccs1)c1ccccc1 ZINC000475142526 890008470 /nfs/dbraw/zinc/00/84/70/890008470.db2.gz ZGEVXTYVYKNBGG-YADHBBJMSA-N 2 0 407.583 4.041 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cc2cccc(F)c2o1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000475712871 890651405 /nfs/dbraw/zinc/65/14/05/890651405.db2.gz GWRXUZLMCPWNSY-ZWKOTPCHSA-N 2 0 423.532 4.392 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NC2CC[NH+](C3CCCCC3)CC2)[NH+]2CCCC2)cc1 ZINC000475909954 890838724 /nfs/dbraw/zinc/83/87/24/890838724.db2.gz NWBJRDBOMKIZQS-XMMPIXPASA-N 2 0 412.622 4.228 20 0 HIADRP Cc1nc([C@H](C)[NH+]2CCC(C[NH+]3CCOCC3)CC2)oc1-c1ccc(Cl)cc1 ZINC000477145727 892070842 /nfs/dbraw/zinc/07/08/42/892070842.db2.gz WTQXYNYXRVANET-KRWDZBQOSA-N 2 0 403.954 4.409 20 0 HIADRP C[C@H]1[C@H]([NH+]2CCCC2)CCN1C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000478222843 893384816 /nfs/dbraw/zinc/38/48/16/893384816.db2.gz DAKVSZCXCZCDEW-NBGIEHNGSA-N 2 0 420.601 4.183 20 0 HIADRP C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479284744 894562985 /nfs/dbraw/zinc/56/29/85/894562985.db2.gz QEIJAYNORQYPSP-ZDUSSCGKSA-N 2 0 422.333 4.145 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479286237 894564898 /nfs/dbraw/zinc/56/48/98/894564898.db2.gz MVQQMLXBVJSDEM-JOCHJYFZSA-N 2 0 416.407 4.156 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000479365705 894666712 /nfs/dbraw/zinc/66/67/12/894666712.db2.gz UIEPTKMSOXGDPO-ZCYQVOJMSA-N 2 0 424.633 4.077 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@@H](c2ccsc2)[NH+](C)C)CC1 ZINC000479447779 894764664 /nfs/dbraw/zinc/76/46/64/894764664.db2.gz CQISFPHMUMEJRV-NQIIRXRSSA-N 2 0 406.640 4.037 20 0 HIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000479767581 895068198 /nfs/dbraw/zinc/06/81/98/895068198.db2.gz JTKNZZUOHGDMNT-HOTGVXAUSA-N 2 0 422.415 4.499 20 0 HIADRP COc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1OC ZINC000480241867 895651363 /nfs/dbraw/zinc/65/13/63/895651363.db2.gz QLXWJFMGFWXDQE-HSALFYBXSA-N 2 0 412.574 4.472 20 0 HIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480536669 895899084 /nfs/dbraw/zinc/89/90/84/895899084.db2.gz CWPUJFMQHAPMDS-RXVVDRJESA-N 2 0 400.636 4.350 20 0 HIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480536666 895899239 /nfs/dbraw/zinc/89/92/39/895899239.db2.gz CWPUJFMQHAPMDS-NQIIRXRSSA-N 2 0 400.636 4.350 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(SCC(F)(F)F)cc1)N1CC[NH+](C)CC1 ZINC000480544325 895905290 /nfs/dbraw/zinc/90/52/90/895905290.db2.gz ZFRKWUHUYGGOMZ-VQIMIIECSA-N 2 0 403.558 4.264 20 0 HIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@@H](C(C)C)N2CC[NH+](C)CC2)CCC3)cc1 ZINC000480557577 895916948 /nfs/dbraw/zinc/91/69/48/895916948.db2.gz RIIHYUQOWPMKNZ-IRLDBZIGSA-N 2 0 412.647 4.358 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)N1CC[NH+](C)CC1 ZINC000480559801 895919751 /nfs/dbraw/zinc/91/97/51/895919751.db2.gz UFHGZOSWUWKFNL-FPOVZHCZSA-N 2 0 416.610 4.188 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)[C@@H](C)C1 ZINC000480600988 895965103 /nfs/dbraw/zinc/96/51/03/895965103.db2.gz MUPUSAFQYDWWBH-HWBMXIPRSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480603287 895967874 /nfs/dbraw/zinc/96/78/74/895967874.db2.gz DYLALQFQOPOLPH-RTWAWAEBSA-N 2 0 421.651 4.166 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000480603656 895968139 /nfs/dbraw/zinc/96/81/39/895968139.db2.gz DZOIPCBWRLOZBZ-APWZRJJASA-N 2 0 419.038 4.457 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000480617775 895984319 /nfs/dbraw/zinc/98/43/19/895984319.db2.gz VVIJKNZVFOJGHS-RTBURBONSA-N 2 0 415.603 4.141 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480645622 896014255 /nfs/dbraw/zinc/01/42/55/896014255.db2.gz SAUATXWGTFSBAT-OALUTQOASA-N 2 0 415.603 4.283 20 0 HIADRP C[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(SCC(F)F)cc1 ZINC000480713134 896074230 /nfs/dbraw/zinc/07/42/30/896074230.db2.gz VHRPHTRBHVCYDG-INIZCTEOSA-N 2 0 406.546 4.041 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3ccc(F)cc3OC(F)F)cc2)CC1 ZINC000480727796 896088387 /nfs/dbraw/zinc/08/83/87/896088387.db2.gz JYQULIBJZYFIJF-KRWDZBQOSA-N 2 0 421.507 4.415 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3sc(C(C)(C)C)nc3C)cn2)CC1 ZINC000480731310 896091208 /nfs/dbraw/zinc/09/12/08/896091208.db2.gz XCYJFUSROWROJC-MRXNPFEDSA-N 2 0 401.624 4.137 20 0 HIADRP Cc1ccccc1OCCCC(=O)Nc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000480737735 896098355 /nfs/dbraw/zinc/09/83/55/896098355.db2.gz DTOOFWOWAVFEKN-NFBKMPQASA-N 2 0 409.574 4.223 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(NC(=O)NC(C)C)cc2)[C@H](C)C1 ZINC000480739819 896101108 /nfs/dbraw/zinc/10/11/08/896101108.db2.gz KCMUBYOGAAKFGZ-KNKQGSTJSA-N 2 0 404.599 4.004 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cccc(-c4ccncc4)c3)cn2)CC1 ZINC000480741211 896103103 /nfs/dbraw/zinc/10/31/03/896103103.db2.gz RQKHBGUUOQRTIQ-FQEVSTJZSA-N 2 0 401.558 4.136 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3ccc(Br)s3)cc2)CC1 ZINC000480743187 896104974 /nfs/dbraw/zinc/10/49/74/896104974.db2.gz YSRAHRVWHHYPDL-MRXNPFEDSA-N 2 0 422.436 4.499 20 0 HIADRP CCn1cc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)cn1 ZINC000480774408 896138645 /nfs/dbraw/zinc/13/86/45/896138645.db2.gz AOXCSJOABKAZGV-SFHVURJKSA-N 2 0 423.527 4.175 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CCc4ccc(OC(F)(F)F)cc43)cc2)CC1 ZINC000480884190 896240333 /nfs/dbraw/zinc/24/03/33/896240333.db2.gz SDWYLSIRHKVCOQ-QFIPXVFZSA-N 2 0 419.491 4.110 20 0 HIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c1 ZINC000480905123 896261578 /nfs/dbraw/zinc/26/15/78/896261578.db2.gz WNWZXOCFAXNVBH-GOSISDBHSA-N 2 0 403.517 4.195 20 0 HIADRP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000481234035 896583816 /nfs/dbraw/zinc/58/38/16/896583816.db2.gz PXQMRUCUVSXWQM-HZPDHXFCSA-N 2 0 423.388 4.086 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCCOc3c(Br)cccc32)c1 ZINC000481318309 896669665 /nfs/dbraw/zinc/66/96/65/896669665.db2.gz GLCXNVHTGDQTPU-FQEVSTJZSA-N 2 0 419.363 4.393 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(I)cc1 ZINC000481327776 896685287 /nfs/dbraw/zinc/68/52/87/896685287.db2.gz MMFFMJRYPFYBHG-OAHLLOKOSA-N 2 0 424.326 4.082 20 0 HIADRP Clc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(OCCN3CCOCC3)c1)CCCO2 ZINC000481415392 896818639 /nfs/dbraw/zinc/81/86/39/896818639.db2.gz OAQXKTNARYKHTD-JOCHJYFZSA-N 2 0 416.949 4.055 20 0 HIADRP COc1ccc(C)cc1C1(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)CCOCC1 ZINC000481558499 896930895 /nfs/dbraw/zinc/93/08/95/896930895.db2.gz DFJLJVBDHIJJRH-UHFFFAOYSA-N 2 0 400.607 4.439 20 0 HIADRP COc1ccc(C2(C[NH2+][C@@H](C)c3cccc(OCC[NH+](C)C)c3)CCOCC2)cc1 ZINC000481560015 896932390 /nfs/dbraw/zinc/93/23/90/896932390.db2.gz UTVDTISRHIMXPY-FQEVSTJZSA-N 2 0 412.574 4.035 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000481716327 897108377 /nfs/dbraw/zinc/10/83/77/897108377.db2.gz KIMBIONVXDNJRN-BKMJKUGQSA-N 2 0 406.618 4.458 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cc(OC)c(OC)cc3F)CC2)cc1 ZINC000481720891 897116278 /nfs/dbraw/zinc/11/62/78/897116278.db2.gz WAOJPPZVYRCOPV-KRWDZBQOSA-N 2 0 416.537 4.414 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)[C@H](C)C1 ZINC000481727176 897121656 /nfs/dbraw/zinc/12/16/56/897121656.db2.gz PGVVRCSEDPNYQT-RCZVLFRGSA-N 3 0 401.639 4.289 20 0 HIADRP C[NH+](C)CC1CCN(C(=O)NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC1 ZINC000481789921 897170908 /nfs/dbraw/zinc/17/09/08/897170908.db2.gz YCJOQPSAYMAGNE-UHFFFAOYSA-N 2 0 422.617 4.062 20 0 HIADRP COc1ccc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1Br ZINC000482037061 897452731 /nfs/dbraw/zinc/45/27/31/897452731.db2.gz CSZOGWILJNWXHW-OAHLLOKOSA-N 2 0 407.352 4.249 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCN(c3cc(Cl)ccc3C)C2)[C@H](C)C1 ZINC000482090960 897534749 /nfs/dbraw/zinc/53/47/49/897534749.db2.gz TXVOIWDGTHBMOS-URVUXULASA-N 2 0 408.030 4.201 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1 ZINC000482111364 897561434 /nfs/dbraw/zinc/56/14/34/897561434.db2.gz BGKOEIUGJLRWAU-CJFMBICVSA-N 2 0 414.553 4.334 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CCCN(Cc2cccs2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482117132 897569319 /nfs/dbraw/zinc/56/93/19/897569319.db2.gz BLVZTBVZOHWGKV-VQTJNVASSA-N 2 0 401.620 4.251 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CCCN(Cc2cccs2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000482122403 897576137 /nfs/dbraw/zinc/57/61/37/897576137.db2.gz NAJCKMKXDHVODB-PMACEKPBSA-N 2 0 401.620 4.251 20 0 HIADRP C[C@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1cccc(-c2ccncc2)c1 ZINC000482123417 897579058 /nfs/dbraw/zinc/57/90/58/897579058.db2.gz GSVUBHBHPLYFDJ-NRFANRHFSA-N 2 0 401.558 4.007 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482130846 897587568 /nfs/dbraw/zinc/58/75/68/897587568.db2.gz FMUORFSTTWWWPT-LJQANCHMSA-N 2 0 418.541 4.125 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(-c2ccccc2)cc1 ZINC000482253952 897734653 /nfs/dbraw/zinc/73/46/53/897734653.db2.gz HTCYWCUOMXHMSH-HXUWFJFHSA-N 2 0 401.554 4.496 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@@H]2CCSc3ccc(F)cc32)c1 ZINC000482267682 897752837 /nfs/dbraw/zinc/75/28/37/897752837.db2.gz QGLKHIYOWHUDNK-OAQYLSRUSA-N 2 0 404.551 4.109 20 0 HIADRP Cc1nc(C)c([C@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)s1 ZINC000482274445 897762157 /nfs/dbraw/zinc/76/21/57/897762157.db2.gz WRHXRZHJXFFVHZ-INIZCTEOSA-N 2 0 403.592 4.100 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000482355174 897870482 /nfs/dbraw/zinc/87/04/82/897870482.db2.gz FCDSUSYLCNJZKS-HXUWFJFHSA-N 2 0 416.610 4.190 20 0 HIADRP CC[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482455735 898024953 /nfs/dbraw/zinc/02/49/53/898024953.db2.gz QTCZJLFNUAWILH-FQEVSTJZSA-N 2 0 422.404 4.427 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2ccc(SCC(F)(F)F)cc2)CC1 ZINC000482511137 898094504 /nfs/dbraw/zinc/09/45/04/898094504.db2.gz PFRZLHZMDQUNCM-IRXDYDNUSA-N 2 0 403.558 4.265 20 0 HIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2nnn(-c3cccc(Br)c3)c2C)CC1 ZINC000482511265 898094694 /nfs/dbraw/zinc/09/46/94/898094694.db2.gz PPUOZIHTQXFTOL-HNNXBMFYSA-N 2 0 420.399 4.111 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(OC(F)F)cc1 ZINC000482533649 898121233 /nfs/dbraw/zinc/12/12/33/898121233.db2.gz IGCZRGAUKRJPPV-JOCHJYFZSA-N 2 0 404.501 4.486 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cnn(Cc2ccccc2)c1 ZINC000482550198 898139990 /nfs/dbraw/zinc/13/99/90/898139990.db2.gz PNRHHNODOBAWEH-PMACEKPBSA-N 2 0 421.564 4.234 20 0 HIADRP C[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(-c2ccc(Br)cc2)s1 ZINC000482560557 898152722 /nfs/dbraw/zinc/15/27/22/898152722.db2.gz QFLGUFSHQPNSKF-JKSUJKDBSA-N 2 0 422.436 4.464 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@H](CCSc1ccccc1)c1ccc(F)cc1 ZINC000482634134 898237160 /nfs/dbraw/zinc/23/71/60/898237160.db2.gz UEXXESMYBIKVEK-WMZHIEFXSA-N 2 0 401.595 4.275 20 0 HIADRP CCSc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000482651018 898254976 /nfs/dbraw/zinc/25/49/76/898254976.db2.gz KZGIFJLWFFHEQE-GHTZIAJQSA-N 2 0 411.615 4.347 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000482871258 898485024 /nfs/dbraw/zinc/48/50/24/898485024.db2.gz WXLYNKGEHOXTBG-APWZRJJASA-N 2 0 403.567 4.153 20 0 HIADRP O=C1Nc2ccccc2C12CCC([NH2+]Cc1ccc(OCC[NH+]3CCCC3)cc1)CC2 ZINC000482880013 898493831 /nfs/dbraw/zinc/49/38/31/898493831.db2.gz ZMQVVIQOWGKCCQ-UHFFFAOYSA-N 2 0 419.569 4.084 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(CCO)CC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000483155276 898829405 /nfs/dbraw/zinc/82/94/05/898829405.db2.gz LGZQPBXWULOMHX-SFHVURJKSA-N 2 0 422.038 4.109 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)[C@@H](C)C1 ZINC000483158055 898830257 /nfs/dbraw/zinc/83/02/57/898830257.db2.gz PRGVOYYZUFRRQH-YSSFQJQWSA-N 2 0 400.485 4.299 20 0 HIADRP CCCCOc1ccc([C@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1OC ZINC000483519686 899181758 /nfs/dbraw/zinc/18/17/58/899181758.db2.gz REMYIISMMZZMJL-NRFANRHFSA-N 2 0 417.638 4.475 20 0 HIADRP CCOc1ccc([C@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1OCC ZINC000483529971 899191915 /nfs/dbraw/zinc/19/19/15/899191915.db2.gz IXHXIRJDWOHDEU-FQEVSTJZSA-N 2 0 403.611 4.085 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)C[C@H]1C ZINC000483698037 899355081 /nfs/dbraw/zinc/35/50/81/899355081.db2.gz GEZBPYXAMGJYBA-YKSBVNFPSA-N 2 0 414.638 4.465 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CCCN(C)[C@@H]1c1cccs1)c1cccc(OCC[NH+](C)C)c1 ZINC000483728954 899389110 /nfs/dbraw/zinc/38/91/10/899389110.db2.gz PKKSEARZACGBHL-LEDOBFOHSA-N 2 0 401.620 4.422 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@@H]2CCc3ccc(F)cc32)CC1 ZINC000483734174 899394638 /nfs/dbraw/zinc/39/46/38/899394638.db2.gz PCVWPOKOWHPAHD-HXUWFJFHSA-N 2 0 407.455 4.373 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)C[C@H]1C ZINC000483800321 899475292 /nfs/dbraw/zinc/47/52/92/899475292.db2.gz OLCGXVKJKHOGDV-URVUXULASA-N 2 0 400.611 4.164 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCN(C(=O)c2ccccc2)CC1 ZINC000484165864 899785316 /nfs/dbraw/zinc/78/53/16/899785316.db2.gz VPGCGQPEGQLRFQ-SQJMNOBHSA-N 2 0 405.586 4.039 20 0 HIADRP COc1ccc2cc([C@H](C)[NH2+]CC3CC[NH+](CC(=O)NC(C)(C)C)CC3)ccc2c1 ZINC000484275990 899846298 /nfs/dbraw/zinc/84/62/98/899846298.db2.gz JTZONDXADYMYAU-SFHVURJKSA-N 2 0 411.590 4.126 20 0 HIADRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+][C@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000484296884 899859929 /nfs/dbraw/zinc/85/99/29/899859929.db2.gz SAMUYOQFZWKKHY-SFHVURJKSA-N 2 0 410.027 4.093 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000484472096 899964946 /nfs/dbraw/zinc/96/49/46/899964946.db2.gz GVHMEIUMJYUTLY-KRWDZBQOSA-N 2 0 422.491 4.435 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(F)c(Br)c1 ZINC000484488729 899980171 /nfs/dbraw/zinc/98/01/71/899980171.db2.gz VFYRWQCYVVJTME-OAHLLOKOSA-N 2 0 421.354 4.396 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cnn1-c1ccc(F)cc1 ZINC000484490517 899982741 /nfs/dbraw/zinc/98/27/41/899982741.db2.gz QUJKHNUAYCVJRI-SFHVURJKSA-N 2 0 422.548 4.127 20 0 HIADRP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000485918634 901144016 /nfs/dbraw/zinc/14/40/16/901144016.db2.gz YSUVQNAGEUBOFD-DEOSSOPVSA-N 2 0 405.586 4.267 20 0 HIADRP C[C@H]([NH2+]Cc1cnc2ccc(Br)cn12)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486505722 901657514 /nfs/dbraw/zinc/65/75/14/901657514.db2.gz MOPLPIFBCGTQOX-WMZOPIPTSA-N 2 0 413.363 4.097 20 0 HIADRP c1cc(C[NH+]2CCC[C@H]([C@@H]3CCOC3)C2)cc(C[N@@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000487904964 902441347 /nfs/dbraw/zinc/44/13/47/902441347.db2.gz CZSUZPGGZRMYBW-FATVKVNYSA-N 2 0 412.618 4.184 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)N[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)CC1 ZINC000488606255 902896938 /nfs/dbraw/zinc/89/69/38/902896938.db2.gz CIPZAJTYZLYGPZ-FGZHOGPDSA-N 2 0 422.564 4.052 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)N[C@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)CC1 ZINC000488605828 902897018 /nfs/dbraw/zinc/89/70/18/902897018.db2.gz CIPZAJTYZLYGPZ-FCHUYYIVSA-N 2 0 422.564 4.052 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N[C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000489283439 903306401 /nfs/dbraw/zinc/30/64/01/903306401.db2.gz APGWBXSGVSCIEI-YENTXNKWSA-N 2 0 420.601 4.032 20 0 HIADRP CC[C@H](C)c1ccccc1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506032019 914715691 /nfs/dbraw/zinc/71/56/91/914715691.db2.gz OISBKLWLUQOZCC-SFTDATJTSA-N 2 0 415.622 4.352 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](c3ccccc3)c3ccc(C)cc3)cn2)CC1 ZINC000490158441 903799910 /nfs/dbraw/zinc/79/99/10/903799910.db2.gz RTZGKCYRFCFJND-SANMLTNESA-N 2 0 400.570 4.411 20 0 HIADRP C[N@H+](Cc1ccccc1C[NH2+]Cc1cnnn1Cc1ccccc1)C1CCCCC1 ZINC000490513080 904063187 /nfs/dbraw/zinc/06/31/87/904063187.db2.gz OJKRZQVLWTZJSJ-UHFFFAOYSA-N 2 0 403.574 4.381 20 0 HIADRP CSc1cccc([C@@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491005975 904365912 /nfs/dbraw/zinc/36/59/12/904365912.db2.gz LISXZXIGHUNKDO-HSZRJFAPSA-N 2 0 419.585 4.393 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000491020938 904373742 /nfs/dbraw/zinc/37/37/42/904373742.db2.gz NRERTWWCSADTFP-CVDCTZTESA-N 2 0 417.544 4.241 20 0 HIADRP CCC1(C[NH2+]Cc2cnnn2Cc2ccccc2)CC[NH+](Cc2ccccc2)CC1 ZINC000491358092 904556810 /nfs/dbraw/zinc/55/68/10/904556810.db2.gz CQBWBIAOQTULPS-UHFFFAOYSA-N 2 0 403.574 4.108 20 0 HIADRP CC(=O)N1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c2ccccc2C1 ZINC000492146163 904806144 /nfs/dbraw/zinc/80/61/44/904806144.db2.gz YTRBJPYKNSXGLV-SWIDVAJJSA-N 2 0 403.570 4.265 20 0 HIADRP C[C@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)[N@H+](C)CCCN1CC[NH+](C)CC1 ZINC000492810761 904911421 /nfs/dbraw/zinc/91/14/21/904911421.db2.gz UMMWVZIUXKAWNJ-OAHLLOKOSA-N 2 0 411.377 4.279 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1)C1CC[NH+](C)CC1 ZINC000506247061 914861639 /nfs/dbraw/zinc/86/16/39/914861639.db2.gz RPEASTDMSNXOPE-QFIPXVFZSA-N 2 0 420.601 4.068 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cc(Br)cs1 ZINC000494745279 905944455 /nfs/dbraw/zinc/94/44/55/905944455.db2.gz KTICHVOVVZLAFB-KSSFIOAISA-N 2 0 409.393 4.318 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccco1 ZINC000496649840 906729323 /nfs/dbraw/zinc/72/93/23/906729323.db2.gz JSVQGVQNEHZRRP-JDMFINLCSA-N 2 0 424.589 4.204 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]CCc4nnc(-c5ccccc5)o4)[C@H]3C2)cc1 ZINC000512615199 921262675 /nfs/dbraw/zinc/26/26/75/921262675.db2.gz YHXFCRACXOYHMN-VABKMULXSA-N 2 0 402.542 4.169 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)cc1)C1CC1 ZINC000512625303 921266959 /nfs/dbraw/zinc/26/69/59/921266959.db2.gz OUZRHBXWLUMYRJ-FQEVSTJZSA-N 2 0 411.615 4.374 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)N1CCc2sccc2C1 ZINC000497275977 906827873 /nfs/dbraw/zinc/82/78/73/906827873.db2.gz MIRXPLFFCLAAAF-LJQANCHMSA-N 2 0 411.615 4.187 20 0 HIADRP C[C@H](C[NH2+][C@@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1)CN1CC[NH+](C)CC1 ZINC000512643542 921271322 /nfs/dbraw/zinc/27/13/22/921271322.db2.gz XLYNNAHCILLIET-VGOFRKELSA-N 2 0 423.498 4.407 20 0 HIADRP O=C(C1CCCCC1)N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000512654812 921276674 /nfs/dbraw/zinc/27/66/74/921276674.db2.gz OXEGQLFZVHLCMI-WSOYEBOPSA-N 2 0 409.618 4.058 20 0 HIADRP CC[NH+](CC)CCN(Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512693732 921289606 /nfs/dbraw/zinc/28/96/06/921289606.db2.gz KKCHLTGTOCUOMT-GGAORHGYSA-N 2 0 414.638 4.193 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(CC[NH+](C)C)Cc2ccc(F)c(F)c2)cc1)C(C)C ZINC000497889881 907362850 /nfs/dbraw/zinc/36/28/50/907362850.db2.gz OOMPVRHKIUTWOB-UHFFFAOYSA-N 2 0 417.544 4.399 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)cc1 ZINC000498122936 907635249 /nfs/dbraw/zinc/63/52/49/907635249.db2.gz BJLYVCWXAVMANL-NOZRDPDXSA-N 2 0 420.601 4.041 20 0 HIADRP CC[NH+](CC)CCOc1ccc(NC(=O)N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000512842719 921345702 /nfs/dbraw/zinc/34/57/02/921345702.db2.gz ASQOGSYOOFDKNT-UXHICEINSA-N 2 0 416.610 4.182 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)c2cccc(C[NH+]3CCCC3)c2)C1 ZINC000498567454 908027988 /nfs/dbraw/zinc/02/79/88/908027988.db2.gz OOEWXWLRQVNWTH-NRFANRHFSA-N 2 0 405.586 4.444 20 0 HIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499144077 908501520 /nfs/dbraw/zinc/50/15/20/908501520.db2.gz CHPYOCNVZRUKID-MPIKPJSNSA-N 3 0 407.602 4.302 20 0 HIADRP CN(C(=O)C1CC[NH+](Cc2ccccc2)CC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000499479505 908812662 /nfs/dbraw/zinc/81/26/62/908812662.db2.gz CTCTYGPAPGIPLM-UHFFFAOYSA-N 2 0 405.586 4.022 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000499636433 908862794 /nfs/dbraw/zinc/86/27/94/908862794.db2.gz ZDJDVNQBMRFHMH-UHFFFAOYSA-N 2 0 423.601 4.144 20 0 HIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000500442240 909861142 /nfs/dbraw/zinc/86/11/42/909861142.db2.gz SMOGZBNAXQCMAF-NYXAKURHSA-N 2 0 404.476 4.465 20 0 HIADRP CC(C)C[NH+]1CCC(NC(=O)NCc2ccccc2C[N@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000500647102 909990273 /nfs/dbraw/zinc/99/02/73/909990273.db2.gz HOYFTONYLLUPMP-OYRHEFFESA-N 2 0 414.638 4.084 20 0 HIADRP Brc1ccc(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)s1 ZINC000513092027 921541463 /nfs/dbraw/zinc/54/14/63/921541463.db2.gz GTWBSWDBJMDEGN-UHFFFAOYSA-N 2 0 422.436 4.198 20 0 HIADRP Brc1cc(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)cs1 ZINC000513104679 921553061 /nfs/dbraw/zinc/55/30/61/921553061.db2.gz LWDQBAIAGWPWRI-UHFFFAOYSA-N 2 0 422.436 4.198 20 0 HIADRP C[C@H](C1CC1)N(Cc1ccccc1)C(=O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501039090 910253765 /nfs/dbraw/zinc/25/37/65/910253765.db2.gz LCRAPTRSXWFLCG-OAQYLSRUSA-N 2 0 420.601 4.057 20 0 HIADRP C[N@@H+](Cc1ccc(I)cc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501051110 910260531 /nfs/dbraw/zinc/26/05/31/910260531.db2.gz XMAMZTBBQJWSBM-UHFFFAOYSA-N 2 0 421.326 4.035 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1)c1ccsc1 ZINC000501177241 910344450 /nfs/dbraw/zinc/34/44/50/910344450.db2.gz VSOHRQHUNIXCOS-OALUTQOASA-N 2 0 420.648 4.329 20 0 HIADRP CC(C)(C)[NH+]1CCC([NH2+]C[C@@H](c2ccc(Cl)cc2)N2CCOC(C)(C)C2)CC1 ZINC000513216682 921631647 /nfs/dbraw/zinc/63/16/47/921631647.db2.gz GUIRQMAXNGOJHV-NRFANRHFSA-N 2 0 408.030 4.344 20 0 HIADRP COCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000502710407 911743704 /nfs/dbraw/zinc/74/37/04/911743704.db2.gz CKDVPONBUNHRJA-GJZUVCINSA-N 2 0 407.602 4.304 20 0 HIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000502710405 911743944 /nfs/dbraw/zinc/74/39/44/911743944.db2.gz CKDVPONBUNHRJA-BKMJKUGQSA-N 2 0 407.602 4.304 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)CC1 ZINC000502790163 911812580 /nfs/dbraw/zinc/81/25/80/911812580.db2.gz RAOZYICZVNKPNZ-UHFFFAOYSA-N 2 0 421.029 4.116 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)N3CCC[C@H](C[N@@H+]4CCCC[C@H]4C)C3)CC2)CC1 ZINC000502807637 911825069 /nfs/dbraw/zinc/82/50/69/911825069.db2.gz GNZIZAFYQZRSQZ-SSPWFOHLSA-N 2 0 418.670 4.326 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)CCCC1)c1ccccc1 ZINC000502914426 911900196 /nfs/dbraw/zinc/90/01/96/911900196.db2.gz ZRZQNBWRXJIMMX-GHTZIAJQSA-N 2 0 414.619 4.314 20 0 HIADRP CC(C)C[NH+]1CCC(NC(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)CC1 ZINC000502923018 911908690 /nfs/dbraw/zinc/90/86/90/911908690.db2.gz AASLQCBATAENBU-FQEVSTJZSA-N 2 0 400.611 4.070 20 0 HIADRP c1c(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c(-c2cccnc2)nn1-c1ccccc1 ZINC000506909019 915707761 /nfs/dbraw/zinc/70/77/61/915707761.db2.gz OLFSQZQKPXQMIM-UHFFFAOYSA-N 2 0 401.558 4.242 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000506913741 915714495 /nfs/dbraw/zinc/71/44/95/915714495.db2.gz FQGVQMKUTZTZOX-VXKWHMMOSA-N 2 0 414.638 4.323 20 0 HIADRP COC(=O)[C@@H](C)C[N@H+](Cc1ccccc1)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000507092539 915866325 /nfs/dbraw/zinc/86/63/25/915866325.db2.gz CPTZUNGKFCFKGB-NRFANRHFSA-N 2 0 423.601 4.028 20 0 HIADRP C[C@H]([NH2+]CCc1nc(-c2cccc(Cl)c2)no1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508718478 917478629 /nfs/dbraw/zinc/47/86/29/917478629.db2.gz NULGHKQIEUSAQF-FXAWDEMLSA-N 2 0 410.949 4.433 20 0 HIADRP C[C@H](NC(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[C@H](c1ccccc1)[NH+](C)C ZINC000508855100 917607907 /nfs/dbraw/zinc/60/79/07/917607907.db2.gz UJGOKWDKWZBPMH-RRJCBXKSSA-N 2 0 422.617 4.372 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@H](C)[C@@H](c2ccccc2)[NH+](C)C)CC1)CC1CC1 ZINC000508869828 917623497 /nfs/dbraw/zinc/62/34/97/917623497.db2.gz JDBCTVKIKHBRRP-YKSBVNFPSA-N 2 0 414.638 4.221 20 0 HIADRP CC[C@@H](C)[NH2+][C@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)c1ccco1 ZINC000509568467 918217030 /nfs/dbraw/zinc/21/70/30/918217030.db2.gz LNGUYBIFSIHLLE-DENIHFKCSA-N 2 0 412.578 4.015 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)c1ccco1 ZINC000509595396 918243717 /nfs/dbraw/zinc/24/37/17/918243717.db2.gz HGHCAAWYLMTIIN-FPOVZHCZSA-N 2 0 404.599 4.006 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N(C)[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000509613194 918260836 /nfs/dbraw/zinc/26/08/36/918260836.db2.gz JNCWOLCIUSKGME-NNWRFLSQSA-N 2 0 412.578 4.015 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]C1CCC(NC(=O)COc2ccc(Cl)cc2)CC1 ZINC000509671115 918302537 /nfs/dbraw/zinc/30/25/37/918302537.db2.gz CIVXWRPMJILRQV-KMFTYDHNSA-N 2 0 422.013 4.000 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(Sc4ccccn4)o3)cc2)CC1 ZINC000509954641 918547992 /nfs/dbraw/zinc/54/79/92/918547992.db2.gz KRXUPYLGTGKZJS-UHFFFAOYSA-N 2 0 422.598 4.253 20 0 HIADRP C[C@H]1C[C@H](CCNC(=O)c2ccc(C[NH+]3CCCC3)cc2)C[N@@H+]1Cc1ccccc1 ZINC000510099404 918663063 /nfs/dbraw/zinc/66/30/63/918663063.db2.gz OLXQLVMEHUGYBH-URXFXBBRSA-N 2 0 405.586 4.313 20 0 HIADRP CC(C)[C@@H](CNC(=O)c1oc2ccccc2c1C[NH+](C)C)[N@@H+]1CCc2ccccc2C1 ZINC000510316072 918826066 /nfs/dbraw/zinc/82/60/66/918826066.db2.gz QDSNXDBQOIFUQO-HSZRJFAPSA-N 2 0 419.569 4.307 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CCCC12CC[NH+](C)CC2)C1CCCCC1 ZINC000510381446 918863800 /nfs/dbraw/zinc/86/38/00/918863800.db2.gz ZHRAEGDPNWMIOE-UHFFFAOYSA-N 2 0 412.622 4.221 20 0 HIADRP Cc1cc(OCCC[C@@H](C)[NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)ccc1Cl ZINC000510731764 919178569 /nfs/dbraw/zinc/17/85/69/919178569.db2.gz IKNUSAXOWFJUAL-LJQANCHMSA-N 2 0 408.030 4.344 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H](c2ccc(OC)cc2)[NH+]2CCCC2)cc1)C1CC1 ZINC000511524386 920142444 /nfs/dbraw/zinc/14/24/44/920142444.db2.gz XJSDJMSSRBXCCG-RUZDIDTESA-N 2 0 421.585 4.246 20 0 HIADRP Cc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)sc1Br ZINC000511926039 920671916 /nfs/dbraw/zinc/67/19/16/920671916.db2.gz JNPUOXPUJJVIFD-YOEHRIQHSA-N 2 0 409.393 4.236 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NCC2CC[NH+](Cc3ccccc3)CC2)cc1)C1CC1 ZINC000512148266 920889943 /nfs/dbraw/zinc/88/99/43/920889943.db2.gz LRUCHSKDWPKJJU-UHFFFAOYSA-N 2 0 405.586 4.313 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+]([C@@H](C)c2ccccc2)C2CC2)CC1 ZINC000512245165 921003035 /nfs/dbraw/zinc/00/30/35/921003035.db2.gz PZRMSPZCYLSPHV-NRFANRHFSA-N 2 0 405.586 4.301 20 0 HIADRP C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512318373 921067346 /nfs/dbraw/zinc/06/73/46/921067346.db2.gz OODZVCCZIQIQIK-ROUUACIJSA-N 2 0 403.998 4.187 20 0 HIADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)c1ccc(-c2cccc3cccnc32)cc1 ZINC000512325747 921076432 /nfs/dbraw/zinc/07/64/32/921076432.db2.gz XCQRAIWRGIPGQG-UHFFFAOYSA-N 2 0 418.585 4.247 20 0 HIADRP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3cccc(OCc4ccccc4Cl)c3)C2)CC1 ZINC000513486348 921840021 /nfs/dbraw/zinc/84/00/21/921840021.db2.gz XEEPCWHFHAUMBX-JOCHJYFZSA-N 2 0 413.993 4.131 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+][C@H](Cc2ccccn2)c2cccnc2)C[C@H](C)O1 ZINC000513498532 921848806 /nfs/dbraw/zinc/84/88/06/921848806.db2.gz AMTIQPGAEIPMCR-YZIHRLCOSA-N 2 0 416.569 4.159 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2csc(Br)c2)C[C@H](C)O1 ZINC000513587810 921920288 /nfs/dbraw/zinc/92/02/88/921920288.db2.gz BDXBUJRLPSNQIZ-GASCZTMLSA-N 2 0 409.393 4.410 20 0 HIADRP c1ccc(C(OCC[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c2ccccc2)cc1 ZINC000513818633 922141568 /nfs/dbraw/zinc/14/15/68/922141568.db2.gz HITNORNMGGKDIU-UHFFFAOYSA-N 2 0 408.586 4.227 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCCC2)[NH+]2CCCC2)cc1 ZINC000514026825 922348211 /nfs/dbraw/zinc/34/82/11/922348211.db2.gz LGVFBRGLGOXAIQ-RUZDIDTESA-N 2 0 420.601 4.227 20 0 HIADRP CN(C)C(=O)c1cccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000514092169 922414049 /nfs/dbraw/zinc/41/40/49/922414049.db2.gz CHONJANRPRGXPU-UBFVSLLYSA-N 2 0 405.586 4.169 20 0 HIADRP C[C@@H]1CCCC[NH+]1C[C@@H]1CCCN(CCN2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)C1 ZINC000514111676 922442664 /nfs/dbraw/zinc/44/26/64/922442664.db2.gz AQIDVMZHNHUORA-POTDNYQPSA-N 2 0 418.714 4.159 20 0 HIADRP CC(C)[C@H](CNC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)[NH+]1CCC(C)CC1 ZINC000514221826 922556973 /nfs/dbraw/zinc/55/69/73/922556973.db2.gz KBNKIMJSSNVQJF-UNMCSNQZSA-N 2 0 420.667 4.016 20 0 HIADRP CC[NH+]1CCC(C[NH2+][C@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)CC1 ZINC000514882643 922830680 /nfs/dbraw/zinc/83/06/80/922830680.db2.gz XYLCDBFEQSKUOD-XMMPIXPASA-N 2 0 414.615 4.118 20 0 HIADRP COc1ccc([C@@H](CNC(=O)C[N@@H+]2CCC[C@H]2c2ccccc2)[NH+]2CCCCC2)cc1 ZINC000514918689 922844049 /nfs/dbraw/zinc/84/40/49/922844049.db2.gz SMQCZVHIRFGYEW-LOSJGSFVSA-N 2 0 421.585 4.176 20 0 HIADRP C[C@@H](CC(=O)NCCc1ccccc1)[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000515410008 923087188 /nfs/dbraw/zinc/08/71/88/923087188.db2.gz NJHPPTHENSTJEK-DHLKQENFSA-N 2 0 407.602 4.016 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)C1CC[NH+](Cc2ccccc2)CC1)c1cccc(OC)c1 ZINC000516674410 923839182 /nfs/dbraw/zinc/83/91/82/923839182.db2.gz HPUZWHFIXYQHHF-RUZDIDTESA-N 2 0 423.601 4.107 20 0 HIADRP O[C@@H](C[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)COCc1ccccc1Cl ZINC000516709656 923857189 /nfs/dbraw/zinc/85/71/89/923857189.db2.gz NPFWILIUCAEBIQ-GMAHTHKFSA-N 2 0 416.993 4.109 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+]CC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000517552716 924260930 /nfs/dbraw/zinc/26/09/30/924260930.db2.gz ZUFWOAYESDFMEK-UHFFFAOYSA-N 2 0 407.341 4.499 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)cc2c1OCCO2 ZINC000518265204 927122615 /nfs/dbraw/zinc/12/26/15/927122615.db2.gz RAZMOYCBOAADEK-RTBURBONSA-N 2 0 410.558 4.234 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000518629021 927389431 /nfs/dbraw/zinc/38/94/31/927389431.db2.gz YEQNYRIDASVSNS-XUZZJYLKSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)C1 ZINC000519505580 927998030 /nfs/dbraw/zinc/99/80/30/927998030.db2.gz FKPDVYUPTAFODT-BGYRXZFFSA-N 2 0 423.045 4.171 20 0 HIADRP COc1ccccc1NC(=O)C[C@@H](C)[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000519674978 928046562 /nfs/dbraw/zinc/04/65/62/928046562.db2.gz VDXMWCXPKXIWOG-IFMALSPDSA-N 2 0 409.574 4.304 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NC[C@H](c2ccc(C)cc2)[NH+]2CCCC2)CC1 ZINC000519935957 928169488 /nfs/dbraw/zinc/16/94/88/928169488.db2.gz VCYIWNHYCXFDIT-XMMPIXPASA-N 2 0 414.638 4.285 20 0 HIADRP C[C@H](CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)[NH+]1CCC(C)CC1 ZINC000520071393 928293562 /nfs/dbraw/zinc/29/35/62/928293562.db2.gz IKBSJFYXHPSKRD-OAQYLSRUSA-N 2 0 422.617 4.335 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cc4c(cc3OC)C[C@@H](C)O4)CC2)cc1 ZINC000520140727 928336528 /nfs/dbraw/zinc/33/65/28/928336528.db2.gz GBZUTJFJGWGOOW-GOSISDBHSA-N 2 0 410.558 4.029 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cccc(OCC4CCCCC4)c3)cn2)CC1 ZINC000520950028 928886927 /nfs/dbraw/zinc/88/69/27/928886927.db2.gz DQYXHOINTMWNGF-UHFFFAOYSA-N 2 0 422.617 4.472 20 0 HIADRP CC(C)(C)[NH+]1CCC(NC(=O)NCC2CC[NH+](Cc3ccccc3Cl)CC2)CC1 ZINC000521238575 929072945 /nfs/dbraw/zinc/07/29/45/929072945.db2.gz HLLPCLYTLGSKJJ-UHFFFAOYSA-N 2 0 421.029 4.114 20 0 HIADRP C[NH+](C)[C@H]1CCCN(C(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000521522105 929273358 /nfs/dbraw/zinc/27/33/58/929273358.db2.gz UMPYJPTXHDMRQF-DEOSSOPVSA-N 2 0 420.601 4.185 20 0 HIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)cc1Cl ZINC000522009015 929617593 /nfs/dbraw/zinc/61/75/93/929617593.db2.gz VZYWKUBBMPAEDP-KRWDZBQOSA-N 2 0 417.981 4.269 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)[NH+]2CCCC2)o1 ZINC000524884772 929872029 /nfs/dbraw/zinc/87/20/29/929872029.db2.gz SUQFRUMTKNWEDH-OFNKIYASSA-N 2 0 424.589 4.031 20 0 HIADRP C[N@H+](C[C@H](O)COc1ccc2ccccc2c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525269548 930119654 /nfs/dbraw/zinc/11/96/54/930119654.db2.gz AQZFKSREXUNAID-RDGATRHJSA-N 2 0 404.554 4.033 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccccc2)CC1 ZINC000525311565 930150417 /nfs/dbraw/zinc/15/04/17/930150417.db2.gz MNHISDMXARNQJB-BWKNWUBXSA-N 2 0 405.586 4.383 20 0 HIADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)Nc1ccccc1Oc1ccccc1Cl ZINC000526134348 930541980 /nfs/dbraw/zinc/54/19/80/930541980.db2.gz UOHFXHONIZOIGK-UHFFFAOYSA-N 2 0 404.942 4.089 20 0 HIADRP Cc1ccc([C@H](CCn2cncn2)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc1 ZINC000527348620 930643197 /nfs/dbraw/zinc/64/31/97/930643197.db2.gz FVBIIEHKYBDFAY-VWLOTQADSA-N 2 0 403.574 4.494 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)N1CC[C@@H](C[NH+]2CCCC2)C1)c1cccc(C(F)(F)F)c1 ZINC000530582514 930758257 /nfs/dbraw/zinc/75/82/57/930758257.db2.gz JKZAUZIHVBOAAB-PXNSSMCTSA-N 2 0 411.512 4.033 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NC[C@@H](c1ccc(Cl)cc1)[NH+](C)C ZINC000531079054 930911507 /nfs/dbraw/zinc/91/15/07/930911507.db2.gz OIDJGLAVCDCSNL-QFIPXVFZSA-N 2 0 416.997 4.236 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NC[C@H](c2ccccc2)[NH+]2CCC(C)CC2)CC1 ZINC000531204018 930963559 /nfs/dbraw/zinc/96/35/59/930963559.db2.gz PVPZCLISGSDKQF-RUZDIDTESA-N 2 0 420.601 4.196 20 0 HIADRP COc1cc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)ccc1SC ZINC000531429746 931053674 /nfs/dbraw/zinc/05/36/74/931053674.db2.gz KFHPUMVNZYSSPQ-UHFFFAOYSA-N 2 0 405.652 4.045 20 0 HIADRP CCN(C(=O)C1CCN(c2cc[nH+]cc2C)CC1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000531443066 931058471 /nfs/dbraw/zinc/05/84/71/931058471.db2.gz VVDQHNFDWDLTGC-XUZZJYLKSA-N 2 0 420.601 4.290 20 0 HIADRP C[C@H]1C[C@H]([NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000531595355 931114264 /nfs/dbraw/zinc/11/42/64/931114264.db2.gz KRZBDDOFMVTLTD-WIOPSUGQSA-N 3 0 420.645 4.360 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNCc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccccc1 ZINC000531595836 931114289 /nfs/dbraw/zinc/11/42/89/931114289.db2.gz OHUDWZLUPSMMKD-OAQYLSRUSA-N 2 0 408.634 4.436 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1cccc(OCC(F)(F)F)c1)C1CC[NH+](C)CC1 ZINC000531596574 931115791 /nfs/dbraw/zinc/11/57/91/931115791.db2.gz ZPIXBIFHXHVKDP-UHFFFAOYSA-N 2 0 421.507 4.448 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CCCC[NH+]2CCN(C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000531685425 931152165 /nfs/dbraw/zinc/15/21/65/931152165.db2.gz JEULGPSWHSWVBN-MRXNPFEDSA-N 2 0 424.420 4.166 20 0 HIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]C[C@@H](c2cccc(F)c2)N2CCOCC2)cc1 ZINC000531697147 931160800 /nfs/dbraw/zinc/16/08/00/931160800.db2.gz ZMJQVBSPESLMQN-KOSHJBKYSA-N 2 0 408.521 4.044 20 0 HIADRP CC[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(Br)c1 ZINC000531710543 931168734 /nfs/dbraw/zinc/16/87/34/931168734.db2.gz XDASGSBWKHGZDA-FGZHOGPDSA-N 2 0 416.407 4.479 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000531937972 931253559 /nfs/dbraw/zinc/25/35/59/931253559.db2.gz UXRKOTWSGBFBLV-KRWDZBQOSA-N 2 0 410.400 4.268 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000531947123 931258721 /nfs/dbraw/zinc/25/87/21/931258721.db2.gz FKOMFWDWDNBSRY-RTBURBONSA-N 2 0 406.014 4.292 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531966748 931269267 /nfs/dbraw/zinc/26/92/67/931269267.db2.gz WMGULQUDDVMEFS-AWEZNQCLSA-N 2 0 411.443 4.413 20 0 HIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 ZINC000531989596 931278689 /nfs/dbraw/zinc/27/86/89/931278689.db2.gz POCFDMSOTJFZPZ-HNNXBMFYSA-N 2 0 401.473 4.012 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]C2CCN(c3ccccc3)CC2)CC1 ZINC000532215142 931356442 /nfs/dbraw/zinc/35/64/42/931356442.db2.gz IUMDZTQMMVNMGR-FQEVSTJZSA-N 2 0 410.581 4.287 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000532248034 931371335 /nfs/dbraw/zinc/37/13/35/931371335.db2.gz AFJKQWSDDXSCNJ-MRXNPFEDSA-N 2 0 407.986 4.452 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000532249421 931371928 /nfs/dbraw/zinc/37/19/28/931371928.db2.gz YRGYLZYHWWGTAH-JOCHJYFZSA-N 2 0 400.950 4.300 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCCOc4c(Cl)cccc43)cc2)CC1 ZINC000532483119 931456472 /nfs/dbraw/zinc/45/64/72/931456472.db2.gz KSUOOZNXEQIIIF-JOCHJYFZSA-N 2 0 400.950 4.300 20 0 HIADRP C[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(Br)cc1 ZINC000532497856 931463293 /nfs/dbraw/zinc/46/32/93/931463293.db2.gz ZIGUUIXPKHFTRF-LAUBAEHRSA-N 2 0 402.380 4.088 20 0 HIADRP c1ccc(CC2CC[NH+](CCCC[NH2+]C3CCN(Cc4ccncc4)CC3)CC2)cc1 ZINC000532506287 931466524 /nfs/dbraw/zinc/46/65/24/931466524.db2.gz GPFJQOYACPFHQV-UHFFFAOYSA-N 2 0 420.645 4.371 20 0 HIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1sccc1Br ZINC000532525538 931474845 /nfs/dbraw/zinc/47/48/45/931474845.db2.gz CHLHLFWRRULDRP-OAHLLOKOSA-N 2 0 400.430 4.112 20 0 HIADRP Cc1ccc(COc2ccc(C[NH2+]C3CC[NH+]([C@@H]4CCCC[C@@H]4O)CC3)cc2)cc1 ZINC000532628278 931560140 /nfs/dbraw/zinc/56/01/40/931560140.db2.gz FJMJODCVSYMLRQ-FTJBHMTQSA-N 2 0 408.586 4.432 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC1 ZINC000532756191 931623038 /nfs/dbraw/zinc/62/30/38/931623038.db2.gz ZHISCLOUJXDDSG-UHFFFAOYSA-N 2 0 417.395 4.458 20 0 HIADRP O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H]([NH2+]CCCCC[NH+]2CCCCC2)C1 ZINC000532762650 931624965 /nfs/dbraw/zinc/62/49/65/931624965.db2.gz ZFXYBMNUCVBGIK-NHCUHLMSSA-N 2 0 411.590 4.230 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCC[C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)C2)CC1 ZINC000532798985 931633830 /nfs/dbraw/zinc/63/38/30/931633830.db2.gz ARLYPOOFUFZKIR-ZJSXRUAMSA-N 2 0 414.638 4.049 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 ZINC000532804908 931634714 /nfs/dbraw/zinc/63/47/14/931634714.db2.gz JBWPVSADJMDWHR-CQSZACIVSA-N 2 0 413.418 4.233 20 0 HIADRP COc1ccc(NC(=O)CC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)cc1 ZINC000533025089 931743732 /nfs/dbraw/zinc/74/37/32/931743732.db2.gz YNSUHCFOXBHQHP-XUZZJYLKSA-N 2 0 407.558 4.010 20 0 HIADRP CC(C)[C@H](NC(=O)N(C)[C@@H]1CCCC[C@H]1[N@H+](C)C1CCN(C)CC1)c1ccccc1 ZINC000533663240 931956202 /nfs/dbraw/zinc/95/62/02/931956202.db2.gz WKWAYJVJJZFCLD-SMIHKQSGSA-N 2 0 414.638 4.362 20 0 HIADRP CCC[N@H+](Cc1nnc(-c2cc(C)oc2C)o1)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000534106422 932281134 /nfs/dbraw/zinc/28/11/34/932281134.db2.gz PJZHZPROEHEZRB-UHFFFAOYSA-N 2 0 424.549 4.234 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)NCCC[NH2+]C2CCCCC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000534250510 932365632 /nfs/dbraw/zinc/36/56/32/932365632.db2.gz IBXOWMQPBWQFBO-UTKZUKDTSA-N 2 0 424.992 4.084 20 0 HIADRP c1cc(C[N@@H+]2CC[C@H](C3CCOCC3)C2)ccc1C[NH+]1CC[C@@H](C2CCOCC2)C1 ZINC000534380283 932407266 /nfs/dbraw/zinc/40/72/66/932407266.db2.gz FIJYKIOGPSYAKK-WMPKNSHKSA-N 2 0 412.618 4.184 20 0 HIADRP CN(CC[N@H+](C)C1CCN(C)CC1)C(=O)Nc1ccc2c(c1)C(C)(C)CC2(C)C ZINC000534747063 932718748 /nfs/dbraw/zinc/71/87/48/932718748.db2.gz MTPDWBKUTZPORD-UHFFFAOYSA-N 2 0 400.611 4.135 20 0 HIADRP C[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1nc(-c2ccccc2)no1 ZINC000534818240 932790516 /nfs/dbraw/zinc/79/05/16/932790516.db2.gz PWMKAVIITNRGFD-LJQANCHMSA-N 2 0 419.573 4.160 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000535282501 933048560 /nfs/dbraw/zinc/04/85/60/933048560.db2.gz ZXQCCOGKFUOCNK-XMMPIXPASA-N 2 0 421.585 4.115 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccc(Br)cn1 ZINC000537315016 933713684 /nfs/dbraw/zinc/71/36/84/933713684.db2.gz QXVSOYAFZPXDTF-UHFFFAOYSA-N 2 0 400.320 4.359 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cccc(OC(F)(F)F)c3)CC2)CC1 ZINC000537620135 938336093 /nfs/dbraw/zinc/33/60/93/938336093.db2.gz QYEKWTWYUVXWTI-UHFFFAOYSA-N 2 0 413.528 4.213 20 0 HIADRP COc1cccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c1OC(C)C ZINC000537620557 938336296 /nfs/dbraw/zinc/33/62/96/938336296.db2.gz UMFNZJRNMGGJBN-UHFFFAOYSA-N 2 0 417.638 4.111 20 0 HIADRP CCOC(=O)COc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000537621790 938336851 /nfs/dbraw/zinc/33/68/51/938336851.db2.gz DYSCIZFNGNCMRR-UHFFFAOYSA-N 2 0 422.569 4.117 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)[C@H]3CCC[N@H+](Cc4cccnc4)C3)c2)CC1 ZINC000537714716 938361724 /nfs/dbraw/zinc/36/17/24/938361724.db2.gz CRTBHOLFCQAISM-DEOSSOPVSA-N 2 0 420.601 4.207 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNCc1c(Cl)cccc1N1CC[NH+](C)CC1 ZINC000537747044 938368216 /nfs/dbraw/zinc/36/82/16/938368216.db2.gz AABBTOVEGSLSBC-UHFFFAOYSA-N 2 0 415.025 4.223 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)CC1)CC1CC1 ZINC000537812620 938382626 /nfs/dbraw/zinc/38/26/26/938382626.db2.gz VYXOFJADCUQJLJ-UHFFFAOYSA-N 2 0 411.634 4.259 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)CC1)CC1CC1 ZINC000537819008 938383723 /nfs/dbraw/zinc/38/37/23/938383723.db2.gz XJXQHYJUWWJHOD-VWLOTQADSA-N 2 0 411.634 4.259 20 0 HIADRP COc1ccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1OCc1cccnc1 ZINC000537866724 938394769 /nfs/dbraw/zinc/39/47/69/938394769.db2.gz CZNHWLLJIQBEMU-UHFFFAOYSA-N 2 0 418.541 4.070 20 0 HIADRP Fc1cc(Br)cc2c1CC[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000537935643 938421948 /nfs/dbraw/zinc/42/19/48/938421948.db2.gz AJRFTETUECVIOT-FQEVSTJZSA-N 2 0 404.327 4.477 20 0 HIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000537970223 938439700 /nfs/dbraw/zinc/43/97/00/938439700.db2.gz MPQHDMPYPGKALW-HSZRJFAPSA-N 2 0 421.610 4.422 20 0 HIADRP CC[N@H+](CCC1CC[NH+]([C@H](C)C(=O)N2CCc3sccc3C2)CC1)CC(C)C ZINC000537994968 938454812 /nfs/dbraw/zinc/45/48/12/938454812.db2.gz JPDCZOMWZUPEQQ-LJQANCHMSA-N 2 0 405.652 4.101 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](c3cccc(C(F)(F)F)c3)C3CC3)cn2)CC1 ZINC000538062080 938491558 /nfs/dbraw/zinc/49/15/58/938491558.db2.gz MCYSSXDQARWVHR-OAQYLSRUSA-N 2 0 404.480 4.093 20 0 HIADRP C[C@H](CS(=O)(=O)c1ccccc1)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000538274782 938580588 /nfs/dbraw/zinc/58/05/88/938580588.db2.gz GVWHADAXTUWDKJ-UXHICEINSA-N 2 0 400.588 4.013 20 0 HIADRP C[C@@H](CS(=O)(=O)c1ccccc1)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000538274783 938580753 /nfs/dbraw/zinc/58/07/53/938580753.db2.gz GVWHADAXTUWDKJ-VQTJNVASSA-N 2 0 400.588 4.013 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@H]1CCOC3(CCSCC3)C1)c1ccccc1O2 ZINC000538294622 938585462 /nfs/dbraw/zinc/58/54/62/938585462.db2.gz VSYPKCFRLLWLSI-AZUAARDMSA-N 2 0 402.604 4.009 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]C[C@@H]1CCCN1Cc1ccccc1)c1ccccc1O2 ZINC000538295937 938586007 /nfs/dbraw/zinc/58/60/07/938586007.db2.gz NCFSCOZRZWKQLU-LADGPHEKSA-N 2 0 405.586 4.229 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCOc1cccc(C(F)(F)F)n1)c1ccccc1O2 ZINC000538308564 938589126 /nfs/dbraw/zinc/58/91/26/938589126.db2.gz XVITTZGFAYMMKK-KRWDZBQOSA-N 2 0 421.463 4.057 20 0 HIADRP COc1ccc(C[C@@H](C)C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1OC ZINC000538308469 938589147 /nfs/dbraw/zinc/58/91/47/938589147.db2.gz UYICYLIYDWSYEW-KNQAVFIVSA-N 2 0 424.585 4.460 20 0 HIADRP Cc1cc(Br)cc2cc([C@H]([NH2+][C@@H](C)CN3CC[NH+](C)CC3)C(C)C)oc21 ZINC000538447015 938623812 /nfs/dbraw/zinc/62/38/12/938623812.db2.gz SUIMLDWPDOJNCF-OXJNMPFZSA-N 2 0 422.411 4.426 20 0 HIADRP Cc1cc(Br)cc2cc([C@H]([NH2+][C@H](C)CN3CC[NH+](C)CC3)C(C)C)oc21 ZINC000538447016 938623976 /nfs/dbraw/zinc/62/39/76/938623976.db2.gz SUIMLDWPDOJNCF-OXQOHEQNSA-N 2 0 422.411 4.426 20 0 HIADRP CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)CCO1 ZINC000538507688 938637820 /nfs/dbraw/zinc/63/78/20/938637820.db2.gz YCWAFTGDQTWYTK-AZGAKELHSA-N 2 0 407.602 4.302 20 0 HIADRP CCn1c2ccccc2c2cc(C[N@@H+]3CC[C@H](N4CC[NH+](C)CC4)[C@@H](C)C3)ccc21 ZINC000538724192 938692003 /nfs/dbraw/zinc/69/20/03/938692003.db2.gz XDNXJWQEHCYYBS-RDPSFJRHSA-N 2 0 404.602 4.272 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ccc(F)cc3C(F)(F)F)CC2)CC1 ZINC000538724121 938692252 /nfs/dbraw/zinc/69/22/52/938692252.db2.gz TVFBWTRCBKYDDS-UHFFFAOYSA-N 2 0 415.519 4.473 20 0 HIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3cccc(OCc4ccc(F)cc4)c3)C2)CC1 ZINC000538764238 938704679 /nfs/dbraw/zinc/70/46/79/938704679.db2.gz VSQAAAGQJOFPRF-XMMPIXPASA-N 2 0 411.565 4.005 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000538944142 938743293 /nfs/dbraw/zinc/74/32/93/938743293.db2.gz NMTFQUTZBMXUOP-UHFFFAOYSA-N 2 0 420.479 4.277 20 0 HIADRP Cc1c([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)nnn1-c1cccc(Cl)c1 ZINC000539037397 938776435 /nfs/dbraw/zinc/77/64/35/938776435.db2.gz GKEJVRYYGBHEER-INIZCTEOSA-N 2 0 410.953 4.191 20 0 HIADRP COc1ccccc1NC(=O)C[C@H](C)[NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000539045983 938780871 /nfs/dbraw/zinc/78/08/71/938780871.db2.gz DTXHHRTUGMPMBE-TUNNFDKTSA-N 2 0 409.574 4.303 20 0 HIADRP Cc1c([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cnn1-c1cccc(Cl)c1 ZINC000539072661 938794023 /nfs/dbraw/zinc/79/40/23/938794023.db2.gz FIVFVDOXFPHPAW-BZSNNMDCSA-N 2 0 404.986 4.374 20 0 HIADRP COc1ccc(CCC[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1OC ZINC000539378173 938851568 /nfs/dbraw/zinc/85/15/68/938851568.db2.gz YKKFWFRVBIRDLR-OAQYLSRUSA-N 2 0 410.558 4.214 20 0 HIADRP CC(=O)N1CC[C@@H]([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c2ccccc21 ZINC000539408054 938856254 /nfs/dbraw/zinc/85/62/54/938856254.db2.gz VEKPWVWMRAHOMZ-FGZHOGPDSA-N 2 0 405.542 4.062 20 0 HIADRP Cc1cc2cc(C[NH2+]Cc3ccc(C(=O)NCC[NH+]4CCCC4)cc3)oc2cc1C ZINC000539703251 938907468 /nfs/dbraw/zinc/90/74/68/938907468.db2.gz KZKAUNJGGRVLSM-UHFFFAOYSA-N 2 0 405.542 4.165 20 0 HIADRP COCCOCc1ccc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000563564200 945216037 /nfs/dbraw/zinc/21/60/37/945216037.db2.gz HYMZEPATNBSPIU-JIMJEQGWSA-N 2 0 408.586 4.240 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](CC2=Cc3cc(Br)ccc3OC2)CC1 ZINC000539862248 938960827 /nfs/dbraw/zinc/96/08/27/938960827.db2.gz QHUXPWDGPXOVKJ-UHFFFAOYSA-N 2 0 423.395 4.048 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cc(O)cc(C(F)(F)F)c3)CC2)CC1 ZINC000563575797 945222766 /nfs/dbraw/zinc/22/27/66/945222766.db2.gz OASMZROZAYCWCK-UHFFFAOYSA-N 2 0 413.528 4.039 20 0 HIADRP C[C@@H](C(=O)Nc1ccc(F)cc1Cl)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540046939 939049321 /nfs/dbraw/zinc/04/93/21/939049321.db2.gz HUJXYQIVNKTCFQ-INIZCTEOSA-N 2 0 418.944 4.440 20 0 HIADRP COc1ccc(OCc2ccccn2)c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000540067958 939057120 /nfs/dbraw/zinc/05/71/20/939057120.db2.gz HQBHCKRYJZNRJP-UHFFFAOYSA-N 2 0 418.541 4.070 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H](c3cccs3)C3CCCC3)c2)C1 ZINC000540087368 939065566 /nfs/dbraw/zinc/06/55/66/939065566.db2.gz ZSDKIJMNFKLQCW-GMAHTHKFSA-N 2 0 411.615 4.467 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000540138001 939087431 /nfs/dbraw/zinc/08/74/31/939087431.db2.gz XYXIJJVVOANATG-MRXNPFEDSA-N 2 0 420.479 4.324 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000540172378 939102639 /nfs/dbraw/zinc/10/26/39/939102639.db2.gz BIFATFPXKJODTA-KRWDZBQOSA-N 2 0 419.491 4.382 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc(-n2ccnc2)cc1 ZINC000540192732 939117707 /nfs/dbraw/zinc/11/77/07/939117707.db2.gz OJJDXTRBBKHXEW-QFIPXVFZSA-N 2 0 403.574 4.125 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@H]1CCCN(Cc3ccccc3)C1)c1ccccc1O2 ZINC000540461017 939261480 /nfs/dbraw/zinc/26/14/80/939261480.db2.gz IRDYJCJBYUSGPZ-UPVQGACJSA-N 2 0 405.586 4.229 20 0 HIADRP C[C@@H](Nc1cccc(C[NH+]2CCSCC2)c1)[C@H](c1ccccc1)N1CCOCC1 ZINC000540787122 939372016 /nfs/dbraw/zinc/37/20/16/939372016.db2.gz CCZIQYUOYYDSPI-HYBUGGRVSA-N 2 0 411.615 4.109 20 0 HIADRP COC(=O)c1ccc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)[nH]1 ZINC000540997427 939427792 /nfs/dbraw/zinc/42/77/92/939427792.db2.gz JXNMDJFDOONHAB-UHFFFAOYSA-N 2 0 403.526 4.354 20 0 HIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)N(C[C@H]1CC[N@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000541573547 939558442 /nfs/dbraw/zinc/55/84/42/939558442.db2.gz NCKHXQGVBGINTF-MJGOQNOKSA-N 2 0 413.528 4.066 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1ccc(-c2ccccc2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541601865 939565672 /nfs/dbraw/zinc/56/56/72/939565672.db2.gz SXVWBBRQKKCEJZ-ZWSUVBHBSA-N 2 0 408.586 4.336 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H]3CCCc4c(Cl)cccc43)c2)C1 ZINC000541744619 939618924 /nfs/dbraw/zinc/61/89/24/939618924.db2.gz UCZLLOPCLUXHNP-AUSIDOKSSA-N 2 0 411.977 4.205 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000541914748 939652147 /nfs/dbraw/zinc/65/21/47/939652147.db2.gz JEHSYTUIXATPAL-FCHUYYIVSA-N 2 0 415.375 4.257 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cccc(Br)c1 ZINC000541915761 939652706 /nfs/dbraw/zinc/65/27/06/939652706.db2.gz YZEYFPFKFNLESR-RTWAWAEBSA-N 2 0 403.364 4.257 20 0 HIADRP CO[C@H](c1ccc(Br)cc1)[C@H](C)[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000542307742 939793721 /nfs/dbraw/zinc/79/37/21/939793721.db2.gz UBNFQRMWGHTOKD-YWZLYKJASA-N 2 0 415.335 4.204 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000542465859 939827749 /nfs/dbraw/zinc/82/77/49/939827749.db2.gz MTEOLQZVSMAXPP-CQSZACIVSA-N 2 0 407.465 4.431 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+]([C@H]3CCCc4ccc(Br)cc43)CC2)CC1 ZINC000542591811 939847023 /nfs/dbraw/zinc/84/70/23/939847023.db2.gz NGJPBXBMMLKAHP-NRFANRHFSA-N 2 0 420.439 4.176 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc(Cl)ccc1OC(F)F ZINC000542850171 939863101 /nfs/dbraw/zinc/86/31/01/939863101.db2.gz UPOUJFNLGXDZNP-RDTXWAMCSA-N 2 0 410.892 4.359 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1 ZINC000542852321 939863217 /nfs/dbraw/zinc/86/32/17/939863217.db2.gz YRBNACNTIMDHQF-NTKDMRAZSA-N 2 0 424.589 4.024 20 0 HIADRP CC1(C(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)CC[NH+](Cc2ccccc2)CC1 ZINC000543416782 940058531 /nfs/dbraw/zinc/05/85/31/940058531.db2.gz DQDRJXNCXFRALB-NRFANRHFSA-N 2 0 411.615 4.304 20 0 HIADRP COc1ccc(Oc2ccc(C[NH2+]Cc3ccccc3C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000544178255 940345494 /nfs/dbraw/zinc/34/54/94/940345494.db2.gz HMOIEQNSSGBLAP-QHCPKHFHSA-N 2 0 418.537 4.344 20 0 HIADRP CC1(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)CC[NH+](Cc2ccccc2)CC1 ZINC000544373280 940404912 /nfs/dbraw/zinc/40/49/12/940404912.db2.gz YDPLCWTUNRTWBR-JOCHJYFZSA-N 2 0 409.574 4.225 20 0 HIADRP COc1c(C)cnc(CN2CCC([N@H+](C)CCCOCc3ccccc3)CC2)c1C ZINC000544399143 940411879 /nfs/dbraw/zinc/41/18/79/940411879.db2.gz JFQFLAXLERJSDE-UHFFFAOYSA-N 2 0 411.590 4.210 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(-c4ccccc4F)s3)CC2)CC1 ZINC000544600773 940488398 /nfs/dbraw/zinc/48/83/98/940488398.db2.gz LWITVHDTVKDOOX-UHFFFAOYSA-N 2 0 401.595 4.404 20 0 HIADRP C[NH+](C)Cc1cc(-c2noc([C@H]3CCC[N@H+](Cc4cccc(F)c4)C3)n2)ccc1F ZINC000545024076 940534476 /nfs/dbraw/zinc/53/44/76/940534476.db2.gz NJKVXRMHGKSUTK-SFHVURJKSA-N 2 0 412.484 4.456 20 0 HIADRP c1ccc2c(c1)CO[C@]21CC[NH+](CCCC[N@@H+]2CC[C@@]3(C2)OCc2ccccc23)C1 ZINC000545329011 940562041 /nfs/dbraw/zinc/56/20/41/940562041.db2.gz QVQKYAJOMMIYIF-UIOOFZCWSA-N 2 0 404.554 4.029 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(c2nc(-c3ccc(C[NH+]4CCCC4)cc3)no2)CC1 ZINC000546242958 940744192 /nfs/dbraw/zinc/74/41/92/940744192.db2.gz WCHMTFLGLZIECH-UHFFFAOYSA-N 2 0 403.530 4.420 20 0 HIADRP COc1ccc(CC[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC(F)F ZINC000547504554 941066054 /nfs/dbraw/zinc/06/60/54/941066054.db2.gz OPCBJSLIOAKIJF-PXNSSMCTSA-N 2 0 404.501 4.339 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(COC2CCOCC2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483859 941108146 /nfs/dbraw/zinc/10/81/46/941108146.db2.gz KNXUBLIFVWAQEL-PXDATVDWSA-N 2 0 408.586 4.382 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+]Cc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 ZINC000548922576 941129303 /nfs/dbraw/zinc/12/93/03/941129303.db2.gz ONNCCPREMGDZKC-UHFFFAOYSA-N 2 0 413.418 4.233 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000549380448 941184362 /nfs/dbraw/zinc/18/43/62/941184362.db2.gz SWWMIJRZIMYCAW-HHHXNRCGSA-N 2 0 417.597 4.411 20 0 HIADRP CC[NH+](CC)CCCNC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549454095 941191670 /nfs/dbraw/zinc/19/16/70/941191670.db2.gz LFESMFBGPUTGDN-VCWGRIPDSA-N 2 0 421.029 4.285 20 0 HIADRP Cc1ccc2[nH+]ccc(NC[C@@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)c2c1 ZINC000549617222 941201505 /nfs/dbraw/zinc/20/15/05/941201505.db2.gz QHPBKNQBLSYDMI-JOCHJYFZSA-N 2 0 401.554 4.306 20 0 HIADRP CC(C)Cc1ncc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)s1 ZINC000549867704 941220791 /nfs/dbraw/zinc/22/07/91/941220791.db2.gz BDCOJKALDCXFKC-OAQYLSRUSA-N 2 0 413.631 4.360 20 0 HIADRP COC(=O)CCC[C@H]1CCC[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000550218578 941300538 /nfs/dbraw/zinc/30/05/38/941300538.db2.gz RGMBZWGLCMSDPT-CTNGQTDRSA-N 2 0 402.579 4.151 20 0 HIADRP O[C@@H](C[NH2+]Cc1ccccc1C[NH+]1CCCCC1)COc1cccc2ccccc21 ZINC000550597997 941344257 /nfs/dbraw/zinc/34/42/57/941344257.db2.gz DAGQVBNZNSCMRW-DEOSSOPVSA-N 2 0 404.554 4.355 20 0 HIADRP CC(C)CO[C@@H]1C[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1(C)C ZINC000550882006 941378724 /nfs/dbraw/zinc/37/87/24/941378724.db2.gz HFBFDQYOVLQXKH-KMDXXIMOSA-N 2 0 414.634 4.345 20 0 HIADRP COc1ccccc1C[C@@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550885984 941378995 /nfs/dbraw/zinc/37/89/95/941378995.db2.gz LSSPVCCWZRKLKO-ZJSXRUAMSA-N 2 0 408.586 4.145 20 0 HIADRP C[C@H](c1ccc(F)cc1)N1CCC[C@@H]([NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)C1=O ZINC000551273337 941441024 /nfs/dbraw/zinc/44/10/24/941441024.db2.gz VXSJCGKBJOFMJR-OKHDYOJBSA-N 2 0 423.576 4.378 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)C(=O)Nc1ccc(F)cc1F ZINC000551283105 941442510 /nfs/dbraw/zinc/44/25/10/941442510.db2.gz HXZPLHXRFYLQIV-KRWDZBQOSA-N 2 0 401.501 4.314 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(Cl)c1OC ZINC000551617538 941513276 /nfs/dbraw/zinc/51/32/76/941513276.db2.gz SYVFEZUPUXQLIH-UHFFFAOYSA-N 2 0 404.938 4.120 20 0 HIADRP COc1ccc(C[C@@H](C)C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1F ZINC000551827073 941554134 /nfs/dbraw/zinc/55/41/34/941554134.db2.gz QDCGQZHYZXXPSO-GOSISDBHSA-N 2 0 400.538 4.276 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000552050722 941574463 /nfs/dbraw/zinc/57/44/63/941574463.db2.gz PYSRZORKLKOMIT-OTWHNJEPSA-N 2 0 407.558 4.346 20 0 HIADRP O=C([C@H]1CCC[N@@H+]1Cc1ccccc1)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000552518291 941693363 /nfs/dbraw/zinc/69/33/63/941693363.db2.gz ZFNLPPWGSQKYOL-RUZDIDTESA-N 2 0 417.597 4.166 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(OCC(F)(F)F)nc1 ZINC000552784229 941762146 /nfs/dbraw/zinc/76/21/46/941762146.db2.gz RWLJHDVQJSXCOS-UHFFFAOYSA-N 2 0 408.468 4.156 20 0 HIADRP COCCC[NH+]1CCC([NH2+][C@H]2c3cc(Br)ccc3SC[C@@H]2C)CC1 ZINC000553293924 941862382 /nfs/dbraw/zinc/86/23/82/941862382.db2.gz QCROPVWMJZSKCW-IFXJQAMLSA-N 2 0 413.425 4.323 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)C[C@H](c1ncc[nH]1)c1ccccc1 ZINC000553497731 941896418 /nfs/dbraw/zinc/89/64/18/941896418.db2.gz HGLFZSONWPWYKO-UPVQGACJSA-N 2 0 416.569 4.302 20 0 HIADRP CSC1(C[NH2+][C@H](c2ccc(Br)cc2F)C2CC2)CC[NH+](C)CC1 ZINC000554998938 942349780 /nfs/dbraw/zinc/34/97/80/942349780.db2.gz XVNJPMFSOKNQSZ-KRWDZBQOSA-N 2 0 401.389 4.456 20 0 HIADRP CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(C(=O)OC)cc1 ZINC000556076142 942801582 /nfs/dbraw/zinc/80/15/82/942801582.db2.gz KFYQMXLHYUOQJI-VGSWGCGISA-N 2 0 413.537 4.166 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCCC[C@H]3[C@H]3CCOC3)C3(C2)CCOCC3)cc1 ZINC000556229403 942822336 /nfs/dbraw/zinc/82/23/36/942822336.db2.gz HNSFCHIDGWZVIK-OJJQZRKESA-N 2 0 412.618 4.100 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCCC[C@@H]3[C@@H]3CCOC3)C3(C2)CCOCC3)cc1 ZINC000556229405 942822533 /nfs/dbraw/zinc/82/25/33/942822533.db2.gz HNSFCHIDGWZVIK-ZFFYZDHPSA-N 2 0 412.618 4.100 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCCC[C@@H]3[C@H]3CCOC3)C3(C2)CCOCC3)cc1 ZINC000556229402 942822602 /nfs/dbraw/zinc/82/26/02/942822602.db2.gz HNSFCHIDGWZVIK-CXSMSNRLSA-N 2 0 412.618 4.100 20 0 HIADRP COc1ccc(C[C@@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000556233804 942824217 /nfs/dbraw/zinc/82/42/17/942824217.db2.gz SVNGKMDRCHVFGJ-ZJSXRUAMSA-N 2 0 408.586 4.145 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C3CCC(C(=O)OC(C)(C)C)CC3)cc2)CC1 ZINC000556404056 942858330 /nfs/dbraw/zinc/85/83/30/942858330.db2.gz NBQGFICMSMQMHR-UHFFFAOYSA-N 2 0 402.579 4.150 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]CCCOCC4CCOCC4)[C@H]3C2)cc1 ZINC000556870771 942945909 /nfs/dbraw/zinc/94/59/09/942945909.db2.gz JAYFZMMRIYHJMI-SDHOMARFSA-N 2 0 400.607 4.100 20 0 HIADRP c1csc(N2CCC([NH2+][C@H]3CCCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)CC2)n1 ZINC000556887634 942952072 /nfs/dbraw/zinc/95/20/72/942952072.db2.gz ZOKCXPPSPRLIIW-WWNPGLIZSA-N 2 0 410.631 4.392 20 0 HIADRP CN1CC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000557337026 943076819 /nfs/dbraw/zinc/07/68/19/943076819.db2.gz ZDABOOFQVPSRPU-AHKZPQOWSA-N 2 0 421.629 4.483 20 0 HIADRP C/C(=C/c1ccccc1OC(F)F)C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000557550353 943203899 /nfs/dbraw/zinc/20/38/99/943203899.db2.gz BSJIEZVBBCIRBJ-MNDPQUGUSA-N 2 0 407.549 4.041 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)c1ccc(Cl)cc1 ZINC000557810115 943298946 /nfs/dbraw/zinc/29/89/46/943298946.db2.gz XCJNBNXCPDLBNI-HXUWFJFHSA-N 2 0 409.018 4.285 20 0 HIADRP CSc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)s1 ZINC000559326342 943896958 /nfs/dbraw/zinc/89/69/58/943896958.db2.gz HDBGSAAVDBIWAM-LJQANCHMSA-N 2 0 402.629 4.488 20 0 HIADRP COc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)cc1 ZINC000559860974 944070270 /nfs/dbraw/zinc/07/02/70/944070270.db2.gz RSKHZMDLFXTEOC-HXUWFJFHSA-N 2 0 404.558 4.368 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C3(C2)CCOCC3)cc1 ZINC000559891095 944076401 /nfs/dbraw/zinc/07/64/01/944076401.db2.gz NMAWUJLREXRTMM-JWQCQUIFSA-N 2 0 405.586 4.441 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C3(C2)CCOCC3)cc1 ZINC000559891094 944076798 /nfs/dbraw/zinc/07/67/98/944076798.db2.gz NMAWUJLREXRTMM-DQEYMECFSA-N 2 0 405.586 4.441 20 0 HIADRP COc1ccc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c(OC)c1OC ZINC000560527693 944243141 /nfs/dbraw/zinc/24/31/41/944243141.db2.gz NSLRIHLQTLCTNR-UHFFFAOYSA-N 2 0 412.574 4.288 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+]Cc3cnc(-c4ccc(Cl)cc4)s3)CC2)CC1 ZINC000561288887 944541372 /nfs/dbraw/zinc/54/13/72/944541372.db2.gz JPQPDANIHNKQJR-UHFFFAOYSA-N 2 0 405.011 4.112 20 0 HIADRP Nc1c(Br)cc(Br)cc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000561315184 944548178 /nfs/dbraw/zinc/54/81/78/944548178.db2.gz OFNHSYGFPBPKQW-UHFFFAOYSA-N 2 0 419.205 4.150 20 0 HIADRP COC(=O)[C@H](C)Oc1ccc(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000562213171 945022118 /nfs/dbraw/zinc/02/21/18/945022118.db2.gz DAFAIQPPCLLTHG-REWPJTCUSA-N 2 0 410.558 4.019 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(OC)c(OC)c2C)CC1 ZINC000564247719 945462786 /nfs/dbraw/zinc/46/27/86/945462786.db2.gz HWVYLTUWGJYTGO-GOSISDBHSA-N 2 0 415.553 4.144 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cc1O ZINC000564419345 945571852 /nfs/dbraw/zinc/57/18/52/945571852.db2.gz IIBDXVYZDQGXKZ-HNNXBMFYSA-N 2 0 423.479 4.022 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000566996704 946207094 /nfs/dbraw/zinc/20/70/94/946207094.db2.gz LLJVFOMKMYDOOB-OXQOHEQNSA-N 2 0 420.395 4.134 20 0 HIADRP CC(C)Oc1ccc([C@@H](CNC(=O)c2oc3ccccc3c2C[NH+](C)C)[NH+](C)C)cc1 ZINC000567641735 946389691 /nfs/dbraw/zinc/38/96/91/946389691.db2.gz DPLXEHXPZJRBPW-JOCHJYFZSA-N 2 0 423.557 4.314 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000568304696 946496095 /nfs/dbraw/zinc/49/60/95/946496095.db2.gz FPVDBYRWIAOEDZ-URXFXBBRSA-N 3 0 407.602 4.160 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H]1CCSc2ccc(Br)cc21 ZINC000568744114 946678557 /nfs/dbraw/zinc/67/85/57/946678557.db2.gz YKLRZFJQZBWEAS-QGZVFWFLSA-N 2 0 422.392 4.111 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H](CO)Cc2cc(F)c(F)c(F)c2)CC1 ZINC000571174517 947533557 /nfs/dbraw/zinc/53/35/57/947533557.db2.gz BFJIQCRHRCZJGB-QNGMFEMESA-N 2 0 420.519 4.288 20 0 HIADRP COc1ccc2c(c1F)CC[C@@H]2[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000572439756 947906113 /nfs/dbraw/zinc/90/61/13/947906113.db2.gz FPNCDTAMDALSAH-QRWLVFNGSA-N 2 0 401.501 4.063 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(=O)N(C)Cc1cccc(F)c1 ZINC000572867383 948025345 /nfs/dbraw/zinc/02/53/45/948025345.db2.gz OOLICMNIDHWZBQ-UXHICEINSA-N 2 0 411.565 4.194 20 0 HIADRP CC[C@@H](C(=O)Nc1cc(C[NH+]2CCSCC2)ccc1C)[N@H+](C)Cc1ccccc1 ZINC000574305538 948407393 /nfs/dbraw/zinc/40/73/93/948407393.db2.gz QSMOSSWNQDRBKK-QHCPKHFHSA-N 2 0 411.615 4.393 20 0 HIADRP c1csc(-c2noc(CCC[N@@H+]3C[C@H]4CC[NH+](Cc5ccccc5)C[C@@H]4C3)n2)c1 ZINC000575840377 948735156 /nfs/dbraw/zinc/73/51/56/948735156.db2.gz QRRNJNNXSAUQEJ-UXHICEINSA-N 2 0 408.571 4.185 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3C[C@@H]4c5ccccc5[C@@H](OCC5CC5)[C@@H]4C3)c2)CC1 ZINC001164975180 722171776 /nfs/dbraw/zinc/17/17/76/722171776.db2.gz HUCCNYMLULUTOI-DGWZTRNLSA-N 2 0 419.569 4.256 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3CC[C@H](OCC4CC4)[C@@H]3Cc3ccccc3)c2)CC1 ZINC001165006228 722271994 /nfs/dbraw/zinc/27/19/94/722271994.db2.gz MFZATZKQXZVMNO-DQEYMECFSA-N 2 0 421.585 4.171 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cnn(Cc4ccc(F)cc4)c3)CC2)cc1 ZINC000436275090 861583736 /nfs/dbraw/zinc/58/37/36/861583736.db2.gz OGAWIZHBTUZNEG-UHFFFAOYSA-N 2 0 422.548 4.081 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000030907236 847795180 /nfs/dbraw/zinc/79/51/80/847795180.db2.gz SSTYLZUGDZIAGI-OAQYLSRUSA-N 2 0 416.569 4.181 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)C3CC[NH+](Cc4ccccc4)CC3)cc2)CC1 ZINC000038831180 848180576 /nfs/dbraw/zinc/18/05/76/848180576.db2.gz XCHAXBWCPPFLFJ-UHFFFAOYSA-N 2 0 419.613 4.447 20 0 HIADRP CC[NH+]1CCC(C[NH2+]Cc2cc(Br)c(OC)c(Br)c2)CC1 ZINC000044517773 848564370 /nfs/dbraw/zinc/56/43/70/848564370.db2.gz MYTYPGUHUZPKDQ-UHFFFAOYSA-N 2 0 420.189 4.042 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC(C[NH+]2CCCC2)CC1 ZINC000045780814 848727647 /nfs/dbraw/zinc/72/76/47/848727647.db2.gz GAUHAXLHDSBRFE-OAQYLSRUSA-N 2 0 412.622 4.078 20 0 HIADRP O=C(NCCC[NH2+]C1CCCCC1)NCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000060566492 851149627 /nfs/dbraw/zinc/14/96/27/851149627.db2.gz YJEODEMVPFMPQE-UHFFFAOYSA-N 2 0 400.611 4.174 20 0 HIADRP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000437037893 862227464 /nfs/dbraw/zinc/22/74/64/862227464.db2.gz JWJCVYHERJWOJG-RPWUZVMVSA-N 2 0 423.576 4.018 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)cc1 ZINC000061141871 851304806 /nfs/dbraw/zinc/30/48/06/851304806.db2.gz BBTUKEYTSUUZGI-OFNKIYASSA-N 2 0 424.589 4.290 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCSCC2)cc1)c1ccc(C[NH+]2CCCC2)cc1 ZINC000061288494 851339622 /nfs/dbraw/zinc/33/96/22/851339622.db2.gz SRHZGFWKWLHWPL-UHFFFAOYSA-N 2 0 409.599 4.126 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NCc2ccccc2C[NH+]2CCC[C@@H](C)C2)c1 ZINC000061860623 851461357 /nfs/dbraw/zinc/46/13/57/851461357.db2.gz PDLBJSZMVMNSPJ-OAQYLSRUSA-N 2 0 422.617 4.370 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCC2)c1)NC1CC[NH+](CC2CCCCC2)CC1 ZINC000062528629 851570198 /nfs/dbraw/zinc/57/01/98/851570198.db2.gz HYRGGTBOOGOXKF-UHFFFAOYSA-N 2 0 412.622 4.126 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000063144320 851620431 /nfs/dbraw/zinc/62/04/31/851620431.db2.gz TZVKQQPRPDVVOL-XMMPIXPASA-N 2 0 424.658 4.198 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCc2cccc(C[NH+]3CCCC3)c2)[NH+]2CCCC2)cc1 ZINC000064237258 851855297 /nfs/dbraw/zinc/85/52/97/851855297.db2.gz DFBWHMKTXLOKEO-VWLOTQADSA-N 2 0 420.601 4.227 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)[NH+](C)C)cc1 ZINC000065415345 852124378 /nfs/dbraw/zinc/12/43/78/852124378.db2.gz AVGHQDPUQLMQRP-XMMPIXPASA-N 2 0 408.590 4.448 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000071823134 852412514 /nfs/dbraw/zinc/41/25/14/852412514.db2.gz ADKRTPMSFMRTKF-UHFFFAOYSA-N 2 0 420.601 4.136 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](CC(=O)N[C@H](C)c2ccc(Br)cc2)CC1 ZINC000071954574 852444746 /nfs/dbraw/zinc/44/47/46/852444746.db2.gz GDGFZXNSYOVZCW-QGZVFWFLSA-N 2 0 424.427 4.070 20 0 HIADRP COc1ccc([C@@H](CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccccc2)[NH+]2CCCCC2)cc1 ZINC000072015394 852466432 /nfs/dbraw/zinc/46/64/32/852466432.db2.gz IZOSNSQLILUUIK-JWQCQUIFSA-N 2 0 421.585 4.003 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)N1CCC[N@H+](CC2CCCCC2)CC1 ZINC000108413402 852848121 /nfs/dbraw/zinc/84/81/21/852848121.db2.gz BNEVMNBFCHNBJS-OAQYLSRUSA-N 2 0 418.651 4.183 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@@H](c2cccc(OC)c2)[NH+]2CCCC2)cc1)C(C)C ZINC000110165665 853068162 /nfs/dbraw/zinc/06/81/62/853068162.db2.gz MCNFJLNAFSTQBB-VWLOTQADSA-N 2 0 423.601 4.492 20 0 HIADRP O=C(C[NH+]1CCC(c2ccccc2)CC1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000110178487 853068416 /nfs/dbraw/zinc/06/84/16/853068416.db2.gz CLVQUESWNFYZNB-UHFFFAOYSA-N 2 0 409.599 4.054 20 0 HIADRP CC1CC[NH+](Cc2ccc(NC(=O)[C@@H]3CCC[N@H+](Cc4cccnc4)C3)cc2)CC1 ZINC000116393532 853301122 /nfs/dbraw/zinc/30/11/22/853301122.db2.gz XCEWBEUFNYPGEG-HSZRJFAPSA-N 2 0 406.574 4.164 20 0 HIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ncc(Br)cc1Br ZINC000135275592 853374308 /nfs/dbraw/zinc/37/43/08/853374308.db2.gz XTOZXOSIPFKMFG-GFCCVEGCSA-N 2 0 407.194 4.207 20 0 HIADRP CC1CC[NH+](CCCC[NH2+]Cc2nc(-c3cccc(Br)c3)c[nH]2)CC1 ZINC000236843886 853927710 /nfs/dbraw/zinc/92/77/10/853927710.db2.gz SVNGKZPNIAXRER-UHFFFAOYSA-N 2 0 405.384 4.441 20 0 HIADRP CC1CC[NH+](CCCC[NH2+]Cc2nc(-c3ccc(Br)cc3)c[nH]2)CC1 ZINC000236843844 853927748 /nfs/dbraw/zinc/92/77/48/853927748.db2.gz HMJCOWRAYRWKLN-UHFFFAOYSA-N 2 0 405.384 4.441 20 0 HIADRP CCOc1cccc(C[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)c1 ZINC000236907680 853935865 /nfs/dbraw/zinc/93/58/65/853935865.db2.gz ZIPSBPZGYSYKGW-UHFFFAOYSA-N 2 0 407.480 4.146 20 0 HIADRP CCCOc1cc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1OC ZINC000236925636 853938230 /nfs/dbraw/zinc/93/82/30/853938230.db2.gz JHIXOEQWWLSWFM-BGYRXZFFSA-N 2 0 412.574 4.383 20 0 HIADRP CCO[C@H](CC[NH+](C)C)C[NH2+]Cc1csc(-c2cccc(Br)c2)n1 ZINC000236938936 853940205 /nfs/dbraw/zinc/94/02/05/853940205.db2.gz FPZWXBWOAAVVLE-QGZVFWFLSA-N 2 0 412.397 4.019 20 0 HIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)ccc1F ZINC000237064607 853959124 /nfs/dbraw/zinc/95/91/24/853959124.db2.gz PLZWDEAJQCVUAC-UHFFFAOYSA-N 2 0 406.427 4.382 20 0 HIADRP COc1ccccc1-c1ccc(C[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1 ZINC000237094880 853963217 /nfs/dbraw/zinc/96/32/17/853963217.db2.gz BCCKCFJKBNCPGT-UHFFFAOYSA-N 2 0 407.602 4.402 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2cccc3cc[nH]c32)CC1 ZINC000237099902 853964344 /nfs/dbraw/zinc/96/43/44/853964344.db2.gz JVYJCBJBTAWFFT-UHFFFAOYSA-N 2 0 402.464 4.228 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc(Cl)c1OC ZINC000237216309 853984830 /nfs/dbraw/zinc/98/48/30/853984830.db2.gz UJTRPGZTZIOKIN-CALCHBBNSA-N 2 0 418.965 4.256 20 0 HIADRP C[C@@H](C[NH2+]Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)N1CC[NH+](C)CC1 ZINC000237405562 854025666 /nfs/dbraw/zinc/02/56/66/854025666.db2.gz HPAXCNWKDGERCM-KRWDZBQOSA-N 2 0 422.400 4.298 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cccc(Br)c2)C[C@@H](C)O1 ZINC000237412600 854026620 /nfs/dbraw/zinc/02/66/20/854026620.db2.gz HALZADLTUNSYOB-IAGOWNOFSA-N 2 0 403.364 4.348 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(OC(F)(F)F)cc2)C[C@@H](C)O1 ZINC000237412361 854026663 /nfs/dbraw/zinc/02/66/63/854026663.db2.gz QRDXPRBPNSKNBS-IAGOWNOFSA-N 2 0 408.464 4.484 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3csc(-c4ccccn4)n3)CC2)c1 ZINC000237856833 854109449 /nfs/dbraw/zinc/10/94/49/854109449.db2.gz NJWLDRAFPOYZHY-UHFFFAOYSA-N 2 0 421.614 4.206 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccc(-c4ccccc4)cc3)c2)C1 ZINC000237940273 854122840 /nfs/dbraw/zinc/12/28/40/854122840.db2.gz CTUQOTWGINUNGY-SANMLTNESA-N 2 0 413.565 4.341 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)[NH+]2CCCC2)o1 ZINC000303151861 854787473 /nfs/dbraw/zinc/78/74/73/854787473.db2.gz RQLJZCRRCMCQPP-QHCPKHFHSA-N 2 0 424.589 4.210 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)N3CCC[C@H]3C[NH+]3CCCCC3)cc2)CC1 ZINC000303241614 854831900 /nfs/dbraw/zinc/83/19/00/854831900.db2.gz KAVPMDUFSAQOIY-DEOSSOPVSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCCN(C(=O)OC(C)(C)C)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309807028 855365171 /nfs/dbraw/zinc/36/51/71/855365171.db2.gz UUZSGTMVZYRLTI-KSEOMHKRSA-N 2 0 401.595 4.276 20 0 HIADRP COc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1Br ZINC000310788937 855367381 /nfs/dbraw/zinc/36/73/81/855367381.db2.gz DEWAFJMDDKKIRN-APWZRJJASA-N 2 0 403.364 4.458 20 0 HIADRP C[C@@]1(C[NH2+]Cc2cc3c(c(Br)c2)OCO3)CC[N@H+](Cc2ccccc2)C1 ZINC000388300667 855446205 /nfs/dbraw/zinc/44/62/05/855446205.db2.gz AQRKCQYYPPLGBE-NRFANRHFSA-N 2 0 417.347 4.180 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000400511925 855478422 /nfs/dbraw/zinc/47/84/22/855478422.db2.gz JLXRJCWTGVPDHL-FPOVZHCZSA-N 2 0 401.595 4.134 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000410363443 855951749 /nfs/dbraw/zinc/95/17/49/855951749.db2.gz FZPBELJEJIDWEL-GBXCKJPGSA-N 2 0 408.590 4.163 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000410365476 855952697 /nfs/dbraw/zinc/95/26/97/855952697.db2.gz KTZUWKZDRCCERQ-NFBKMPQASA-N 2 0 424.589 4.290 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000410365478 855953054 /nfs/dbraw/zinc/95/30/54/855953054.db2.gz KTZUWKZDRCCERQ-REWPJTCUSA-N 2 0 424.589 4.290 20 0 HIADRP Cc1ccc2cc([C@H](C)[NH2+]Cc3cccc(C[N@@H+]4CCC[C@@H](C(N)=O)C4)c3)oc2c1 ZINC000426029711 856057046 /nfs/dbraw/zinc/05/70/46/856057046.db2.gz LKOPHAZPHHNUEC-PGRDOPGGSA-N 2 0 405.542 4.289 20 0 HIADRP Cn1c2ccccc2cc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1=O ZINC000426317238 856242428 /nfs/dbraw/zinc/24/24/28/856242428.db2.gz LWXUBOLLZRMRJZ-QLBJFCOMSA-N 2 0 415.581 4.319 20 0 HIADRP Cc1cc2c(cc1C)[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]3CCCC3)cc1)CCS2 ZINC000427697644 856914057 /nfs/dbraw/zinc/91/40/57/856914057.db2.gz NKWSOBDJGLFYMK-HSZRJFAPSA-N 2 0 423.626 4.456 20 0 HIADRP O=C(c1ccoc1)N1CCC([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000428224645 857118465 /nfs/dbraw/zinc/11/84/65/857118465.db2.gz XLCYXKHKXKNEEQ-IEZKXTBUSA-N 2 0 421.585 4.165 20 0 HIADRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1NC(C)=O ZINC000428246831 857125124 /nfs/dbraw/zinc/12/51/24/857125124.db2.gz ZCRGYUSESJKCKL-KMDXXIMOSA-N 2 0 421.585 4.434 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000428260418 857131364 /nfs/dbraw/zinc/13/13/64/857131364.db2.gz LJFCUEQWBUXPDY-SQJMNOBHSA-N 2 0 422.617 4.381 20 0 HIADRP CN(C(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000428531509 857245315 /nfs/dbraw/zinc/24/53/15/857245315.db2.gz YPFFYKBMUVNTSH-XMMPIXPASA-N 2 0 405.586 4.022 20 0 HIADRP C[N@H+](C[C@@H](O)Cc1ccc(C(F)(F)F)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000437582091 862898428 /nfs/dbraw/zinc/89/84/28/862898428.db2.gz UDIONTZHHDFNAX-IRLDBZIGSA-N 2 0 406.492 4.063 20 0 HIADRP C[C@@H]([NH2+]CCC[NH2+][C@@H](C)[C@H]1OCCc2sccc21)[C@H]1OCCc2sccc21 ZINC000429119978 857519095 /nfs/dbraw/zinc/51/90/95/857519095.db2.gz BFVOZXFLXQDLHZ-IALDWUNLSA-N 2 0 406.617 4.084 20 0 HIADRP COc1ccccc1-n1nccc1C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000430017276 857998845 /nfs/dbraw/zinc/99/88/45/857998845.db2.gz AYLRQUJJISYTHE-UHFFFAOYSA-N 2 0 404.558 4.403 20 0 HIADRP COc1ccccc1[C@@H](CNC(=O)C[C@@H](c1ccccc1)[NH+](C)C)[NH+]1CCCCC1 ZINC000431727881 858768119 /nfs/dbraw/zinc/76/81/19/858768119.db2.gz LVJOQYDUGRSOLC-XZOQPEGZSA-N 2 0 409.574 4.031 20 0 HIADRP COc1cc(C[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)ccc1OCc1ccc(F)cc1 ZINC000432353531 859117087 /nfs/dbraw/zinc/11/70/87/859117087.db2.gz MQGTZFYMZFRFEW-LJQANCHMSA-N 2 0 416.537 4.004 20 0 HIADRP C[C@H]1C[N@H+](CCC[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccs2)CCCO1 ZINC000432365668 859123910 /nfs/dbraw/zinc/12/39/10/859123910.db2.gz WODZQEMAEKISFS-FQEVSTJZSA-N 2 0 424.614 4.250 20 0 HIADRP COc1ccc(C[C@H]([NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)c2ccc(OC)cc2)cc1 ZINC000432416211 859155697 /nfs/dbraw/zinc/15/56/97/859155697.db2.gz QAHFWYFMGFTGBV-CPJSRVTESA-N 2 0 412.574 4.078 20 0 HIADRP COCCC[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(Br)cc1 ZINC000432439424 859165063 /nfs/dbraw/zinc/16/50/63/859165063.db2.gz GMWAGWPSGZQEKW-YLJYHZDGSA-N 2 0 413.400 4.007 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2CNc2cccc3c2OCC[C@H]3[NH+](C)C)CC1 ZINC000433174245 859554267 /nfs/dbraw/zinc/55/42/67/859554267.db2.gz KNJWFWBFRRLLBM-XMMPIXPASA-N 2 0 408.590 4.216 20 0 HIADRP CC(C)(C)C(=O)N1CCC(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)CC1 ZINC000433176913 859555485 /nfs/dbraw/zinc/55/54/85/859555485.db2.gz SZGNFGSKAZCQQX-UHFFFAOYSA-N 2 0 411.634 4.259 20 0 HIADRP Cc1ccc(F)cc1NC(=O)[C@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433214310 859570584 /nfs/dbraw/zinc/57/05/84/859570584.db2.gz SMUZJSCMGBQBAE-FQEVSTJZSA-N 2 0 409.549 4.449 20 0 HIADRP C[NH+](C)[C@H](CC(=O)NC[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1)c1ccccc1 ZINC000433359477 859659891 /nfs/dbraw/zinc/65/98/91/859659891.db2.gz BYRXRAWPMXZHII-AAIMPIBUSA-N 2 0 417.956 4.281 20 0 HIADRP C[NH+](C)[C@H](CC(=O)NC[C@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1)c1ccccc1 ZINC000433359481 859660592 /nfs/dbraw/zinc/66/05/92/859660592.db2.gz BYRXRAWPMXZHII-JMUQELJHSA-N 2 0 417.956 4.281 20 0 HIADRP C[C@H]([NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000467738100 881540551 /nfs/dbraw/zinc/54/05/51/881540551.db2.gz RFFQOPMAJFYUMV-RDJZCZTQSA-N 2 0 412.525 4.191 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NC[C@H]2CCC[NH+]2C2CCCCC2)[C@H]1c1cccs1 ZINC000438159582 863579690 /nfs/dbraw/zinc/57/96/90/863579690.db2.gz YITBVEIFQPXJSJ-UZKOGDIHSA-N 2 0 418.651 4.227 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(COC2CCCC2)cc1 ZINC000438302634 863782589 /nfs/dbraw/zinc/78/25/89/863782589.db2.gz LUFPTUXZMHKQBP-JOCHJYFZSA-N 2 0 416.610 4.026 20 0 HIADRP CCSCc1cccc(NC(=O)NCC2([NH+]3CCCCC3)CCN(C)CC2)c1 ZINC000438397705 863845992 /nfs/dbraw/zinc/84/59/92/863845992.db2.gz MFAHQIDXCGNIDF-UHFFFAOYSA-N 2 0 404.624 4.012 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cccc(Br)c1 ZINC000467864431 881719492 /nfs/dbraw/zinc/71/94/92/881719492.db2.gz BCYLRXLKDHMIDP-INIZCTEOSA-N 2 0 403.364 4.257 20 0 HIADRP c1cc(C[NH+]2CCC([C@H]3CCCO3)CC2)cc(C[NH+]2CCC([C@H]3CCCO3)CC2)c1 ZINC000439297629 864724550 /nfs/dbraw/zinc/72/45/50/864724550.db2.gz SNORHSBIQAIMEL-CLJLJLNGSA-N 2 0 412.618 4.469 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000439592500 864916179 /nfs/dbraw/zinc/91/61/79/864916179.db2.gz DVZCHOQHRRSTQL-JOCHJYFZSA-N 2 0 423.944 4.460 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000440537012 865809067 /nfs/dbraw/zinc/80/90/67/865809067.db2.gz OYXVTDWEACKLFP-DEOSSOPVSA-N 2 0 405.586 4.267 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(CCC(F)(F)F)c1 ZINC000441089532 866183718 /nfs/dbraw/zinc/18/37/18/866183718.db2.gz BJIBDHKMCQLSJG-IBGZPJMESA-N 2 0 414.516 4.061 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2CCCCOc1ccccc1C(F)(F)F ZINC000441188406 866261069 /nfs/dbraw/zinc/26/10/69/866261069.db2.gz KISKDRSLQPZLTB-IMFGXOCKSA-N 2 0 400.485 4.048 20 0 HIADRP O[C@H](COc1ccc(Oc2ccccc2)cc1)C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441412898 866484896 /nfs/dbraw/zinc/48/48/96/866484896.db2.gz PQWDMFDQNSXLFR-QTISVLPJSA-N 2 0 422.569 4.167 20 0 HIADRP O[C@@H](Cn1c2ccccc2c2ccccc21)C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441416134 866489773 /nfs/dbraw/zinc/48/97/73/866489773.db2.gz CHJGRLNCYFEIFT-ZYKOEDHHSA-N 2 0 403.570 4.104 20 0 HIADRP COCCC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(F)cc1 ZINC000442787436 867675505 /nfs/dbraw/zinc/67/55/05/867675505.db2.gz APRNOKAXPLYUDX-XMMPIXPASA-N 2 0 400.538 4.040 20 0 HIADRP CC[N@H+](CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)Cc1c[nH]c2ccccc12 ZINC000442890996 867723230 /nfs/dbraw/zinc/72/32/30/867723230.db2.gz QLXGLJNCGSLPQA-UHFFFAOYSA-N 2 0 422.598 4.177 20 0 HIADRP C[C@@H](C(=O)N1CCC[C@@H]1c1cccs1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443602541 868161460 /nfs/dbraw/zinc/16/14/60/868161460.db2.gz PNZURUTWGMXPQS-PZJWPPBQSA-N 2 0 403.636 4.388 20 0 HIADRP O=C(CC[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1)NC(c1ccccc1)c1ccccc1 ZINC000444205087 868664747 /nfs/dbraw/zinc/66/47/47/868664747.db2.gz KNADALBFEVKXRZ-JOCHJYFZSA-N 2 0 405.586 4.090 20 0 HIADRP Cc1cc(Cl)ccc1C[NH+]1CCC(C(=O)NCC[N@@H+](C)Cc2ccccc2)CC1 ZINC000468407003 882349151 /nfs/dbraw/zinc/34/91/51/882349151.db2.gz ZRRWVSWOSHPWIC-UHFFFAOYSA-N 2 0 413.993 4.109 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)Nc3ccccc3CC[NH+](C)C)cc2)C1 ZINC000446565643 870477417 /nfs/dbraw/zinc/47/74/17/870477417.db2.gz PVKHNHNFXDWHMQ-HXUWFJFHSA-N 2 0 408.590 4.344 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000446592098 870501143 /nfs/dbraw/zinc/50/11/43/870501143.db2.gz VOVNIXFCXWHJAZ-QFIPXVFZSA-N 2 0 414.981 4.403 20 0 HIADRP CC[C@H]([NH2+]C[C@@H](C)N1CC[NH+](CC)CC1)c1ccc(Br)cc1Cl ZINC000446757458 870669904 /nfs/dbraw/zinc/66/99/04/870669904.db2.gz UKYFERUBZKLOPY-KDOFPFPSSA-N 2 0 402.808 4.169 20 0 HIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H](NC[C@H]2C[NH+](Cc4ccccc4)CCCO2)C3)cc1 ZINC000447595502 871501170 /nfs/dbraw/zinc/50/11/70/871501170.db2.gz NYNXLSNGXVXRKC-NFGXINMFSA-N 2 0 419.613 4.063 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3nc(-c4ccccc4)c[nH]3)CC2)c1 ZINC000447829342 871756521 /nfs/dbraw/zinc/75/65/21/871756521.db2.gz HPHHTPVIZDHDCJ-UHFFFAOYSA-N 2 0 403.574 4.077 20 0 HIADRP CC(C)=CCOc1ccc(CC[C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000468546639 882587129 /nfs/dbraw/zinc/58/71/29/882587129.db2.gz DOJUDCDFNWPJOG-GGAORHGYSA-N 2 0 400.607 4.443 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)[C@@H](C)C1 ZINC000448461588 872420414 /nfs/dbraw/zinc/42/04/14/872420414.db2.gz MKENMWCUFRBYTG-YOEKFXIASA-N 2 0 414.638 4.036 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)[C@H](C)C1 ZINC000448461585 872421375 /nfs/dbraw/zinc/42/13/75/872421375.db2.gz MKENMWCUFRBYTG-CTVDGRRTSA-N 2 0 414.638 4.036 20 0 HIADRP C[NH+]1CCC(C[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)(N2CCCCC2)CC1 ZINC000462735778 875809011 /nfs/dbraw/zinc/80/90/11/875809011.db2.gz DPOPRTLSQIWCFJ-UHFFFAOYSA-N 2 0 424.416 4.309 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@@H]2CCO[C@]3(CCOC3)C2)c2ccc(F)cc2)CC1 ZINC000462802431 875849963 /nfs/dbraw/zinc/84/99/63/875849963.db2.gz NDAIDAYYLNXFSM-TZRRMPRUSA-N 2 0 404.570 4.307 20 0 HIADRP C[C@@H](CCN1CCOCC1)[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462817221 875859148 /nfs/dbraw/zinc/85/91/48/875859148.db2.gz NEPPSXLUEIXMCE-XUZZJYLKSA-N 2 0 405.602 4.079 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CCN(Cc3ccccc3Cl)CC2)[C@@H](C)C1 ZINC000463126180 876168933 /nfs/dbraw/zinc/16/89/33/876168933.db2.gz YXMWQCLAPKUYQT-CVDCTZTESA-N 2 0 408.030 4.031 20 0 HIADRP COc1ccccc1[C@@H](CNC1CC[NH+](CCc2ccccc2)CC1)[NH+]1CCCC1 ZINC000463135826 876185666 /nfs/dbraw/zinc/18/56/66/876185666.db2.gz ADERCQHUJSPESN-RUZDIDTESA-N 2 0 407.602 4.129 20 0 HIADRP c1ccc(CC[NH+]2CCC(NC3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)CC2)cc1 ZINC000463155547 876208041 /nfs/dbraw/zinc/20/80/41/876208041.db2.gz NYRVLYXVRVPGQR-COZMKHHLSA-N 2 0 403.614 4.479 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[C@@H]1CCCC[NH+]1CCC[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000463196949 876256620 /nfs/dbraw/zinc/25/66/20/876256620.db2.gz NOXXRQKJIXAVLP-YBTGXYGPSA-N 2 0 406.655 4.188 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1NC1CC[NH+](CCc2ccccc2)CC1 ZINC000463203656 876264360 /nfs/dbraw/zinc/26/43/60/876264360.db2.gz GSAWFHRPAKSCIQ-GOTSBHOMSA-N 2 0 405.630 4.440 20 0 HIADRP O=C(c1ccccc1Cl)N1CCC([NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)CC1 ZINC000463252883 876309278 /nfs/dbraw/zinc/30/92/78/876309278.db2.gz XQRAZKVFBKJOJE-FQEVSTJZSA-N 2 0 403.998 4.331 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000463298376 876360059 /nfs/dbraw/zinc/36/00/59/876360059.db2.gz CKCQOJCMDJPKSM-UXZIWUSFSA-N 2 0 404.602 4.077 20 0 HIADRP O=C(C[N@@H+]1CC[C@H](CSc2ccccc2)C1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000464763943 878007085 /nfs/dbraw/zinc/00/70/85/878007085.db2.gz DORGIIOOROOSDO-QHCPKHFHSA-N 2 0 423.626 4.013 20 0 HIADRP C[N@H+](C[C@@H](O)COc1ccc(Cl)cc1Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464834853 878094457 /nfs/dbraw/zinc/09/44/57/878094457.db2.gz HNICKRCXKSBKBP-AZUAARDMSA-N 2 0 423.384 4.187 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)[NH+]2CCCC2)o1 ZINC000503342914 912320295 /nfs/dbraw/zinc/32/02/95/912320295.db2.gz LILROMNKICBWCQ-FCHUYYIVSA-N 2 0 416.610 4.023 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)cc1 ZINC000464904792 878220107 /nfs/dbraw/zinc/22/01/07/878220107.db2.gz PFTQVVYSZRCKDU-JOCHJYFZSA-N 2 0 423.601 4.144 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)C1 ZINC000503389101 912370578 /nfs/dbraw/zinc/37/05/78/912370578.db2.gz QTBYSCHAWNQGRH-ZLNRFVROSA-N 2 0 406.659 4.042 20 0 HIADRP CCC(CC)[C@H](CNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCCC1 ZINC000465571644 879045150 /nfs/dbraw/zinc/04/51/50/879045150.db2.gz HKXDADNRGAMBLP-VWNXMTODSA-N 2 0 414.638 4.051 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000465574897 879049944 /nfs/dbraw/zinc/04/99/44/879049944.db2.gz SNAJYJXLKRWQOL-QFIPXVFZSA-N 2 0 422.617 4.289 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)C1 ZINC000465606025 879098621 /nfs/dbraw/zinc/09/86/21/879098621.db2.gz QMFDQFMVHDMQJG-ZLNRFVROSA-N 2 0 414.638 4.051 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NC[C@@H](c1ccccc1)[NH+]1CCC(C)CC1)CC2 ZINC000465727062 879305376 /nfs/dbraw/zinc/30/53/76/879305376.db2.gz QMCKQONDZVQWIK-SGNDLWITSA-N 2 0 412.622 4.116 20 0 HIADRP CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000465888948 879543705 /nfs/dbraw/zinc/54/37/05/879543705.db2.gz MORYELWURWOJNU-JTHBVZDNSA-N 2 0 414.638 4.051 20 0 HIADRP CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)NCc1ccccc1C[NH+]1CCCCCC1 ZINC000465926298 879590199 /nfs/dbraw/zinc/59/01/99/879590199.db2.gz POBADQNUOAPQBL-HSZRJFAPSA-N 2 0 400.611 4.078 20 0 HIADRP Brc1cncc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000466465030 880247758 /nfs/dbraw/zinc/24/77/58/880247758.db2.gz KZBMGRWZDRLDKR-UHFFFAOYSA-N 2 0 418.379 4.005 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000503505358 912553293 /nfs/dbraw/zinc/55/32/93/912553293.db2.gz TWXYLQJTACGLEE-NHCUHLMSSA-N 2 0 418.651 4.183 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccnn3-c3ccccc3)CC2)cc1 ZINC000467331892 881081310 /nfs/dbraw/zinc/08/13/10/881081310.db2.gz DZAWMLLUQFZHFZ-FQEVSTJZSA-N 2 0 404.558 4.444 20 0 HIADRP Cc1cccnc1[C@H]1CCC[C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C1 ZINC000467336093 881085876 /nfs/dbraw/zinc/08/58/76/881085876.db2.gz NSDUOBASHXPQDA-ZEQRLZLVSA-N 2 0 420.601 4.032 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)CC1 ZINC000467349618 881105627 /nfs/dbraw/zinc/10/56/27/881105627.db2.gz XXHUEHSTGBLXLP-CUXKYVRBSA-N 2 0 403.586 4.214 20 0 HIADRP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000467358138 881121558 /nfs/dbraw/zinc/12/15/58/881121558.db2.gz MDBLWQLZFQPLQZ-KRWDZBQOSA-N 2 0 406.492 4.383 20 0 HIADRP C[NH+](C)CCCCNC(=O)[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1 ZINC000469089549 883176985 /nfs/dbraw/zinc/17/69/85/883176985.db2.gz TXZHTZKAODKWJL-XZOQPEGZSA-N 2 0 413.993 4.014 20 0 HIADRP C[NH+](C)CCOc1ccc(NC(=O)c2oc3ccccc3c2C[NH+](C)C)cc1Cl ZINC000469898702 884089443 /nfs/dbraw/zinc/08/94/43/884089443.db2.gz IKOVOEWMPAKOMP-UHFFFAOYSA-N 2 0 415.921 4.341 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)N(CC[NH+](C)C)Cc1ccccc1F)c1ccccc1 ZINC000503707472 912805232 /nfs/dbraw/zinc/80/52/32/912805232.db2.gz IVYZKJDNRWWOFU-LJQANCHMSA-N 2 0 414.569 4.028 20 0 HIADRP CC(C)[NH+](CCCNC(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000470493551 884880299 /nfs/dbraw/zinc/88/02/99/884880299.db2.gz LFFWKFNSDMSTPR-FYYLOGMGSA-N 2 0 402.627 4.190 20 0 HIADRP CC(C)[NH+](CCCNC(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1)C(C)C ZINC000470503169 884891811 /nfs/dbraw/zinc/89/18/11/884891811.db2.gz DWQARNKGXSKFPD-UHFFFAOYSA-N 2 0 402.627 4.049 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(OCc2c(F)cccc2Cl)cc1 ZINC000472123483 886911796 /nfs/dbraw/zinc/91/17/96/886911796.db2.gz CRFRVHMNUGPLLQ-GOSISDBHSA-N 2 0 419.972 4.174 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1cccc(OCc2ccccc2Cl)c1 ZINC000472143577 886940287 /nfs/dbraw/zinc/94/02/87/886940287.db2.gz FAFDBYZPIHFCCH-LJQANCHMSA-N 2 0 401.982 4.035 20 0 HIADRP COc1ccsc1[C@H](C)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000472151795 886948781 /nfs/dbraw/zinc/94/87/81/886948781.db2.gz GNFUHSFBCLYDPW-KRWDZBQOSA-N 2 0 404.576 4.097 20 0 HIADRP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 ZINC000472157030 886955611 /nfs/dbraw/zinc/95/56/11/886955611.db2.gz NQCVRFFIXKVKOP-UHFFFAOYSA-N 2 0 409.496 4.471 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1NC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000472498717 887367079 /nfs/dbraw/zinc/36/70/79/887367079.db2.gz LJWWIXCJFLBLKF-VXKWHMMOSA-N 2 0 419.613 4.171 20 0 HIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000474467544 889331081 /nfs/dbraw/zinc/33/10/81/889331081.db2.gz BMKUWBLRSNPGCC-MOPGFXCFSA-N 2 0 408.615 4.326 20 0 HIADRP CCN(C(=O)NCc1ccc(C[NH+]2CCCC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475007914 889860848 /nfs/dbraw/zinc/86/08/48/889860848.db2.gz JWMQBNKKXHRQHO-RUZDIDTESA-N 2 0 420.601 4.088 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)C[NH2+][C@H](Cc1ccccc1)c1cccs1)c1ccccc1 ZINC000475142524 890009211 /nfs/dbraw/zinc/00/92/11/890009211.db2.gz ZGEVXTYVYKNBGG-FGZHOGPDSA-N 2 0 407.583 4.041 20 0 HIADRP COc1ccc(OCc2ccccn2)c(CNC[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000475274506 890170012 /nfs/dbraw/zinc/17/00/12/890170012.db2.gz NGNXIYUOPQGBMV-JOCHJYFZSA-N 2 0 417.553 4.281 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H](C)c2cc3cccc(F)c3o2)CC1 ZINC000475705186 890643855 /nfs/dbraw/zinc/64/38/55/890643855.db2.gz SQSXUCRDJRIXFN-SFHVURJKSA-N 2 0 423.532 4.312 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+](C3CCCCC3)CC2)[C@H]1c1cccs1 ZINC000475997095 890921328 /nfs/dbraw/zinc/92/13/28/890921328.db2.gz ULVCVTWFSVLXSK-AVRDEDQJSA-N 2 0 418.651 4.227 20 0 HIADRP CC[C@@H](C)[NH2+][C@@H](CNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)c1ccco1 ZINC000476847436 891820311 /nfs/dbraw/zinc/82/03/11/891820311.db2.gz RLZYIMOTNCGFER-KNQAVFIVSA-N 2 0 412.578 4.194 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000477615788 892712641 /nfs/dbraw/zinc/71/26/41/892712641.db2.gz ZYSWIPLLOYRGSZ-RBBKRZOGSA-N 2 0 416.610 4.103 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)[C@H](C)C1 ZINC000477917997 893001627 /nfs/dbraw/zinc/00/16/27/893001627.db2.gz OOOANYIVHGLNDS-RCZVLFRGSA-N 3 0 401.639 4.145 20 0 HIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)CC1 ZINC000477937776 893028951 /nfs/dbraw/zinc/02/89/51/893028951.db2.gz NDWCOTACWCIQOB-GJZUVCINSA-N 2 0 406.618 4.314 20 0 HIADRP COc1cc2c(cc1OC)[C@@H]([NH2+]CCCOC1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000479059551 894317391 /nfs/dbraw/zinc/31/73/91/894317391.db2.gz LWCGSUJSCVBIPO-DEOSSOPVSA-N 2 0 424.585 4.352 20 0 HIADRP CC[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479340807 894633586 /nfs/dbraw/zinc/63/35/86/894633586.db2.gz DLAXJJKAICXPJX-KRWDZBQOSA-N 2 0 422.333 4.146 20 0 HIADRP O=C([C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000505253857 913908525 /nfs/dbraw/zinc/90/85/25/913908525.db2.gz JBBVERGDMGAXAP-HSZRJFAPSA-N 2 0 415.597 4.152 20 0 HIADRP COc1cccc([C@H](CN[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)[NH+]2CCCC2)c1 ZINC000480083153 895440961 /nfs/dbraw/zinc/44/09/61/895440961.db2.gz ORJSVFMXUUPDLW-MZBJOSPHSA-N 2 0 407.602 4.332 20 0 HIADRP C[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(-c2ccc(Br)cc2)s1 ZINC000480168733 895558147 /nfs/dbraw/zinc/55/81/47/895558147.db2.gz VUYTVGXUFWXNHC-MRXNPFEDSA-N 2 0 422.436 4.466 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(-n2ccnc2)cc1 ZINC000480232588 895638126 /nfs/dbraw/zinc/63/81/26/895638126.db2.gz OQDZSCFBWJKNTQ-QHAWAJNXSA-N 2 0 404.558 4.332 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H]1CCCOc2c(Cl)c(Cl)ccc21)N1CC[NH+](C)CC1 ZINC000480520712 895883963 /nfs/dbraw/zinc/88/39/63/895883963.db2.gz CIKBTMPCVUKHTO-QZTJIDSGSA-N 2 0 400.394 4.069 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000480599715 895962239 /nfs/dbraw/zinc/96/22/39/895962239.db2.gz CNTPGOHCNMOLJB-RTBURBONSA-N 2 0 415.603 4.283 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000480601292 895964747 /nfs/dbraw/zinc/96/47/47/895964747.db2.gz MTOYVHHUUITPKV-DRLORSAXSA-N 2 0 406.618 4.456 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 ZINC000480604034 895969944 /nfs/dbraw/zinc/96/99/44/895969944.db2.gz FKEWZLSGRHGRFY-HOTGVXAUSA-N 2 0 407.027 4.449 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480645625 896014430 /nfs/dbraw/zinc/01/44/30/896014430.db2.gz SAUATXWGTFSBAT-RBUKOAKNSA-N 2 0 415.603 4.283 20 0 HIADRP C[C@@H](Nc1cccc2c1CC[N@H+](CC(C)(C)O)C2)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000480671425 896035164 /nfs/dbraw/zinc/03/51/64/896035164.db2.gz MSZZPWYFVAPQLK-IRLDBZIGSA-N 2 0 407.602 4.138 20 0 HIADRP Cc1ccccc1CN1CCC([NH2+][C@@H](C)[C@@H](c2ccccc2)N2CCOCC2)CC1 ZINC000480687286 896049364 /nfs/dbraw/zinc/04/93/64/896049364.db2.gz PWAGSTYISOKRTL-NVQXNPDNSA-N 2 0 407.602 4.011 20 0 HIADRP Cc1ccccc1OCCCC(=O)Nc1ccc(C[NH2+][C@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000480737744 896099072 /nfs/dbraw/zinc/09/90/72/896099072.db2.gz DTOOFWOWAVFEKN-REWPJTCUSA-N 2 0 409.574 4.223 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H]3CCCSc4ccc(Cl)cc43)ccn2)CC1 ZINC000480740010 896100049 /nfs/dbraw/zinc/10/00/49/896100049.db2.gz VAWWDPFLIKHKBY-IBGZPJMESA-N 2 0 402.995 4.204 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(OCCC(C)C)cc3)cn2)CC1 ZINC000480739352 896100690 /nfs/dbraw/zinc/10/06/90/896100690.db2.gz SFIRBEGEZUECHE-NRFANRHFSA-N 2 0 410.606 4.499 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000480770470 896134386 /nfs/dbraw/zinc/13/43/86/896134386.db2.gz KSPGFLYWWTXZLO-LJQANCHMSA-N 2 0 419.038 4.458 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000480780476 896146874 /nfs/dbraw/zinc/14/68/74/896146874.db2.gz QNSMISLEGOUSNH-HXUWFJFHSA-N 2 0 416.610 4.334 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccncc2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480897886 896254847 /nfs/dbraw/zinc/25/48/47/896254847.db2.gz LPRCVTRFRVESBT-IBGZPJMESA-N 2 0 418.541 4.125 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480910406 896265216 /nfs/dbraw/zinc/26/52/16/896265216.db2.gz KCTPWBNLRDUQTD-SFHVURJKSA-N 2 0 421.507 4.226 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CCSc4c(Cl)cccc43)cc2)CC1 ZINC000480921631 896278699 /nfs/dbraw/zinc/27/86/99/896278699.db2.gz RXYFQINEXFRKBP-NRFANRHFSA-N 2 0 402.007 4.414 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000481179090 896518492 /nfs/dbraw/zinc/51/84/92/896518492.db2.gz ULTALLRTGPXKBS-BLIXFSHQSA-N 2 0 423.384 4.233 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCCOc3cc(Br)ccc32)cc1 ZINC000481331563 896691479 /nfs/dbraw/zinc/69/14/79/896691479.db2.gz HHFRTUJNZNIBIT-FQEVSTJZSA-N 2 0 419.363 4.393 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3cc(OC)c(OC)cc3F)CC2)cc1 ZINC000481720893 897115898 /nfs/dbraw/zinc/11/58/98/897115898.db2.gz WAOJPPZVYRCOPV-QGZVFWFLSA-N 2 0 416.537 4.414 20 0 HIADRP COCCC[NH+]1CCC([NH2+][C@@H](C)c2cccc(OCc3cn4ccccc4n3)c2)CC1 ZINC000481912006 897293863 /nfs/dbraw/zinc/29/38/63/897293863.db2.gz HWQPRUZAMAOLPR-FQEVSTJZSA-N 2 0 422.573 4.065 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCN(c3cc(Cl)ccc3C)C2)[C@@H](C)C1 ZINC000482090958 897534691 /nfs/dbraw/zinc/53/46/91/897534691.db2.gz TXVOIWDGTHBMOS-ONTIZHBOSA-N 2 0 408.030 4.201 20 0 HIADRP C[C@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000482116733 897567684 /nfs/dbraw/zinc/56/76/84/897567684.db2.gz XUPKNJNQJRCJBB-NRFANRHFSA-N 2 0 401.558 4.007 20 0 HIADRP COc1ccc(-c2ccncc2)cc1C[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000482143127 897603777 /nfs/dbraw/zinc/60/37/77/897603777.db2.gz NTAUJHLPCMYWPT-UHFFFAOYSA-N 2 0 409.574 4.082 20 0 HIADRP COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000482232706 897713526 /nfs/dbraw/zinc/71/35/26/897713526.db2.gz UMXBMMOEPKALML-HXUWFJFHSA-N 2 0 412.574 4.344 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000482245271 897728178 /nfs/dbraw/zinc/72/81/78/897728178.db2.gz POHCWDGBTHAECO-QHCPKHFHSA-N 2 0 410.558 4.180 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cc(F)cc(F)c1 ZINC000482263916 897749452 /nfs/dbraw/zinc/74/94/52/897749452.db2.gz MGNGQGAWEILJSN-KRWDZBQOSA-N 2 0 404.501 4.305 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C3CCOCC3)c1)CCC2 ZINC000482265978 897750775 /nfs/dbraw/zinc/75/07/75/897750775.db2.gz WSNQQKQVXCDERD-AREMUKBSSA-N 2 0 424.585 4.352 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@H]2CCCOc3ccc(Cl)cc32)c1 ZINC000482267679 897752257 /nfs/dbraw/zinc/75/22/57/897752257.db2.gz QFCTWCZIMNSSAO-QFIPXVFZSA-N 2 0 418.965 4.301 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C[C@@H](C)CN1CC[NH+](C)CC1 ZINC000482450540 898015493 /nfs/dbraw/zinc/01/54/93/898015493.db2.gz QQGITUSMTYSJAF-HZPDHXFCSA-N 2 0 407.027 4.306 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CCc1ccc(OCC[NH+](C)C)cc1 ZINC000482548065 898138514 /nfs/dbraw/zinc/13/85/14/898138514.db2.gz LXUHKVJGXAWNEB-KRWDZBQOSA-N 2 0 410.587 4.347 20 0 HIADRP C[C@@H](C[NH2+][C@H](CCSc1ccccc1)c1ccc(F)cc1)N1CC[NH+](C)CC1 ZINC000482554218 898145351 /nfs/dbraw/zinc/14/53/51/898145351.db2.gz GVLGXZJWOYMWSB-WMZHIEFXSA-N 2 0 401.595 4.275 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482564073 898156004 /nfs/dbraw/zinc/15/60/04/898156004.db2.gz HEGKYDCGCZZZIR-IAGOWNOFSA-N 2 0 424.564 4.219 20 0 HIADRP O=C(NC1CC[NH+](C2CCCC2)CC1)N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000482613710 898214987 /nfs/dbraw/zinc/21/49/87/898214987.db2.gz DKYKMRFLXOKENE-RCZVLFRGSA-N 2 0 424.633 4.090 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000482630009 898233685 /nfs/dbraw/zinc/23/36/85/898233685.db2.gz MDUHYENVUAEBHJ-JXFKEZNVSA-N 2 0 419.491 4.254 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](CCSc1ccccc1)c1ccc(F)cc1 ZINC000482634130 898236440 /nfs/dbraw/zinc/23/64/40/898236440.db2.gz UEXXESMYBIKVEK-AUSIDOKSSA-N 2 0 401.595 4.275 20 0 HIADRP CCC[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(OC)cc1 ZINC000482642484 898246207 /nfs/dbraw/zinc/24/62/07/898246207.db2.gz MQYGVJGRBGYKAM-UPVQGACJSA-N 2 0 409.574 4.024 20 0 HIADRP C[C@H](c1nnc(-c2ccccc2F)s1)N1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000482678301 898280040 /nfs/dbraw/zinc/28/00/40/898280040.db2.gz CEWSLDLRAMCJGH-IXDOHACOSA-N 2 0 418.582 4.226 20 0 HIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccc(OCC[NH+](C)C)c1 ZINC000482866733 898480008 /nfs/dbraw/zinc/48/00/08/898480008.db2.gz MPYNKBHNJSFPTG-HTIDIIIKSA-N 3 0 407.602 4.473 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000482871260 898485010 /nfs/dbraw/zinc/48/50/10/898485010.db2.gz WXLYNKGEHOXTBG-QFBILLFUSA-N 2 0 403.567 4.153 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc(COC2CCOCC2)c1 ZINC000482876796 898489932 /nfs/dbraw/zinc/48/99/32/898489932.db2.gz PRPDGDNJUOUKQZ-LVXARBLLSA-N 2 0 408.586 4.382 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482892595 898511785 /nfs/dbraw/zinc/51/17/85/898511785.db2.gz BQGRUYYGVASMSP-SFHVURJKSA-N 2 0 407.558 4.242 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000482956092 898585151 /nfs/dbraw/zinc/58/51/51/898585151.db2.gz ZVEOTVMIIWZKJN-BKMJKUGQSA-N 2 0 406.618 4.458 20 0 HIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000483202138 898855415 /nfs/dbraw/zinc/85/54/15/898855415.db2.gz QTARVAVJGBPWDH-HMXCVIKNSA-N 2 0 415.528 4.367 20 0 HIADRP c1ccc(C[NH+]2CCC[C@H]3C[N@H+](CCc4nc(-c5ccccc5)no4)CC[C@H]32)cc1 ZINC000483467078 899108549 /nfs/dbraw/zinc/10/85/49/899108549.db2.gz KIMMZPNVKSNZNH-XZOQPEGZSA-N 2 0 402.542 4.266 20 0 HIADRP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](CCc4nc(-c5ccccc5)no4)CC[C@H]32)cc1 ZINC000483467071 899108810 /nfs/dbraw/zinc/10/88/10/899108810.db2.gz KIMMZPNVKSNZNH-DHIUTWEWSA-N 2 0 402.542 4.266 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)C[C@H]1C ZINC000483698035 899355357 /nfs/dbraw/zinc/35/53/57/899355357.db2.gz GEZBPYXAMGJYBA-HYBUGGRVSA-N 2 0 414.638 4.465 20 0 HIADRP COc1cccc2c1CC[C@H]2[NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000483727358 899387075 /nfs/dbraw/zinc/38/70/75/899387075.db2.gz GFEYDKRRQFNAFO-HXUWFJFHSA-N 2 0 419.491 4.243 20 0 HIADRP COc1ccc(C[C@H]([NH2+]CC2(O)CC[NH+](C)CC2)c2cc(Cl)ccc2Cl)cc1 ZINC000484174112 899792094 /nfs/dbraw/zinc/79/20/94/899792094.db2.gz KOUOCNOYOVGUBE-NRFANRHFSA-N 2 0 423.384 4.332 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1nc(-c2ccccc2)cs1 ZINC000484272695 899845050 /nfs/dbraw/zinc/84/50/50/899845050.db2.gz BDQBSRRVFXCAJS-KRWDZBQOSA-N 2 0 414.619 4.087 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(Cl)sc1Cl ZINC000484288516 899854227 /nfs/dbraw/zinc/85/42/27/899854227.db2.gz AQFBCTJFDHRKRC-LBPRGKRZSA-N 2 0 406.423 4.332 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)C(c1ccccc1)c1ccccc1 ZINC000484295992 899858984 /nfs/dbraw/zinc/85/89/84/899858984.db2.gz GPEUNKNPZXZYHT-OAQYLSRUSA-N 2 0 421.629 4.423 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000484487185 899980129 /nfs/dbraw/zinc/98/01/29/899980129.db2.gz MFZUWLHVTICTOM-HSZRJFAPSA-N 2 0 403.973 4.379 20 0 HIADRP Cc1ccc(C[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)c(OCC(F)(F)F)c1 ZINC000484646399 900091732 /nfs/dbraw/zinc/09/17/32/900091732.db2.gz XSYOHWZEURKNKE-FXAWDEMLSA-N 2 0 407.480 4.331 20 0 HIADRP Cc1cc(C)c(NC(=O)CCC[NH+]2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000485085467 900400096 /nfs/dbraw/zinc/40/00/96/900400096.db2.gz BWWSGFOLQGPJLA-VXKWHMMOSA-N 2 0 415.622 4.152 20 0 HIADRP COc1cccc(NC(=O)CC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000485300783 900579441 /nfs/dbraw/zinc/57/94/41/900579441.db2.gz FRUOGLQTTBBIFU-XUZZJYLKSA-N 2 0 407.558 4.010 20 0 HIADRP c1ccc(C[N@@H+]2CC[C@H](C3CCOCC3)C2)c(C[NH+]2CC[C@@H](C3CCOCC3)C2)c1 ZINC000485509253 900796030 /nfs/dbraw/zinc/79/60/30/900796030.db2.gz YFJGWHHIHGZHSA-WMPKNSHKSA-N 2 0 412.618 4.184 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000486273771 901456142 /nfs/dbraw/zinc/45/61/42/901456142.db2.gz YKDGYPGOANVKQY-BWKNWUBXSA-N 2 0 422.617 4.238 20 0 HIADRP COc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(SC)cc1OC ZINC000486504794 901655081 /nfs/dbraw/zinc/65/50/81/901655081.db2.gz KMUISNBSAQDZRC-IEBWSBKVSA-N 2 0 400.588 4.426 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)CC2CC[NH+](C)CC2)cc1)C[C@H]1CCCCO1 ZINC000486842410 901890128 /nfs/dbraw/zinc/89/01/28/901890128.db2.gz PZZWWZIKEDWKFL-HSZRJFAPSA-N 2 0 401.595 4.137 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](CCCc2cccc3ccccc32)CC1 ZINC000487876924 902421552 /nfs/dbraw/zinc/42/15/52/902421552.db2.gz RDBKFKWTAWNKCJ-UHFFFAOYSA-N 2 0 421.629 4.477 20 0 HIADRP c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c(C[NH+]2CCC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000487915697 902449576 /nfs/dbraw/zinc/44/95/76/902449576.db2.gz PTUQBMWUQWFGGJ-QEGGNFSNSA-N 2 0 412.618 4.184 20 0 HIADRP CC[C@@H](c1ccc(F)cc1F)[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000487980693 902502741 /nfs/dbraw/zinc/50/27/41/902502741.db2.gz UYEOZKLCVVMEOQ-QFIPXVFZSA-N 2 0 407.549 4.120 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CS[C@H](C(C)(C)C)C2)c1)C1CCOCC1 ZINC000488443353 902828526 /nfs/dbraw/zinc/82/85/26/902828526.db2.gz URTKWPPVKNQCBG-KNQAVFIVSA-N 2 0 406.636 4.186 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000488539467 902874756 /nfs/dbraw/zinc/87/47/56/902874756.db2.gz KCKYVWPZJOZKBX-IRXDYDNUSA-N 2 0 401.576 4.387 20 0 HIADRP C[C@H](NC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488607842 902897713 /nfs/dbraw/zinc/89/77/13/902897713.db2.gz GNLVNYWXDSTSQB-GVXSCFBNSA-N 2 0 420.601 4.033 20 0 HIADRP Cc1cc(-c2noc([C@@H](C)[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)n2)ccc1F ZINC000506027517 914710491 /nfs/dbraw/zinc/71/04/91/914710491.db2.gz MAQNWFHQPOIEOX-GOSISDBHSA-N 2 0 416.541 4.070 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000489520323 903433264 /nfs/dbraw/zinc/43/32/64/903433264.db2.gz YOSOCIQECMJZHY-URXFXBBRSA-N 2 0 414.638 4.051 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)CC1 ZINC000489995914 903715574 /nfs/dbraw/zinc/71/55/74/903715574.db2.gz VRCHVPJQQLZFJP-RUZDIDTESA-N 2 0 420.601 4.130 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@@H](c2ccccc2)c2ccccn2)[C@H](c2ccccc2)C1 ZINC000490119836 903776559 /nfs/dbraw/zinc/77/65/59/903776559.db2.gz QKGJLBIFQRSKHP-UIOOFZCWSA-N 2 0 400.570 4.139 20 0 HIADRP COc1ccc([C@@H]([NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c2ccc(F)cc2)cc1 ZINC000490119828 903776666 /nfs/dbraw/zinc/77/66/66/903776666.db2.gz QIVAAJAQQOVQEM-GLDPYIMESA-N 2 0 400.538 4.403 20 0 HIADRP c1ccc(CN2CC[NH+](CCCC[NH2+][C@H](c3ccccc3)c3ccccn3)CC2)cc1 ZINC000490129067 903782476 /nfs/dbraw/zinc/78/24/76/903782476.db2.gz CHKFJTYDIOILMF-HHHXNRCGSA-N 2 0 414.597 4.359 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H](c3ccccc3)c3ccc(Cl)cc3)ccn2)CC1 ZINC000490139359 903787533 /nfs/dbraw/zinc/78/75/33/903787533.db2.gz ZXZPJWQATPDNRF-XMMPIXPASA-N 2 0 406.961 4.366 20 0 HIADRP CCc1ccc([C@@H]([NH2+]CCC2CC[NH+](C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491018988 904372482 /nfs/dbraw/zinc/37/24/82/904372482.db2.gz JCFSVQKSFPFXLA-XMMPIXPASA-N 2 0 414.615 4.063 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000491020940 904373394 /nfs/dbraw/zinc/37/33/94/904373394.db2.gz NRERTWWCSADTFP-XXBNENTESA-N 2 0 417.544 4.241 20 0 HIADRP Cc1ccc(C)c([C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)c2ccccc2)c1 ZINC000491424988 904589929 /nfs/dbraw/zinc/58/99/29/904589929.db2.gz YJDBDYOYPNRIAR-AREMUKBSSA-N 2 0 400.570 4.329 20 0 HIADRP O=C(NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)C1CC[NH+](C2CC2)CC1 ZINC000492126129 904802645 /nfs/dbraw/zinc/80/26/45/904802645.db2.gz CGOQJLGYGIWAML-UHFFFAOYSA-N 2 0 417.597 4.440 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cn(-c3ccccc3)nc2C)CC1 ZINC000512388755 921124717 /nfs/dbraw/zinc/12/47/17/921124717.db2.gz YVNNRBMWVLSYCW-UHFFFAOYSA-N 2 0 403.574 4.003 20 0 HIADRP COc1cc(-c2ccccc2)ccc1C[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000512396465 921133148 /nfs/dbraw/zinc/13/31/48/921133148.db2.gz OJWGXBUIPMAVJX-UHFFFAOYSA-N 2 0 423.601 4.079 20 0 HIADRP COc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1OCc1cccnc1 ZINC000512402241 921137140 /nfs/dbraw/zinc/13/71/40/921137140.db2.gz XSENEPZCMRBBLQ-SIKLNZKXSA-N 2 0 409.574 4.412 20 0 HIADRP Cc1ccc(C)c([C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c2ccccc2)c1 ZINC000494055786 905393640 /nfs/dbraw/zinc/39/36/40/905393640.db2.gz JSMVUEFWILSLRO-SANMLTNESA-N 2 0 415.581 4.474 20 0 HIADRP CCC1(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)CCOCC1 ZINC000512421401 921148021 /nfs/dbraw/zinc/14/80/21/921148021.db2.gz JSJXXVOLZKPNNR-UHFFFAOYSA-N 2 0 407.602 4.305 20 0 HIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)cc1 ZINC000494608281 905860529 /nfs/dbraw/zinc/86/05/29/905860529.db2.gz IVOOLPXTNCVQBM-UHFFFAOYSA-N 2 0 402.464 4.302 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NCc1ccccc1C[NH+]1CCCCCC1)c1ccccc1 ZINC000494620248 905867352 /nfs/dbraw/zinc/86/73/52/905867352.db2.gz XBGMDWFORKLNHM-DEOSSOPVSA-N 2 0 408.590 4.165 20 0 HIADRP CC1(C)CC(NC(=O)NCc2ccccc2C[NH+]2CCCCCC2)CC(C)(C)[NH2+]1 ZINC000494653443 905885001 /nfs/dbraw/zinc/88/50/01/905885001.db2.gz ZRYUORJYYUWNJC-UHFFFAOYSA-N 2 0 400.611 4.171 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cc(Br)cs1 ZINC000494745280 905943856 /nfs/dbraw/zinc/94/38/56/905943856.db2.gz KTICHVOVVZLAFB-RDTXWAMCSA-N 2 0 409.393 4.318 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cc(Br)cs1 ZINC000494745278 905944937 /nfs/dbraw/zinc/94/49/37/905944937.db2.gz KTICHVOVVZLAFB-KDOFPFPSSA-N 2 0 409.393 4.318 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H](C[C@@H]3CCOC3)c3ccc(F)cc3)cc2)CC1 ZINC000495090531 906231905 /nfs/dbraw/zinc/23/19/05/906231905.db2.gz IKMYSOJQONLVRT-OFVILXPXSA-N 2 0 412.549 4.040 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H](Cc2ccccc2)c2ccccc2)c1 ZINC000495705195 906530833 /nfs/dbraw/zinc/53/08/33/906530833.db2.gz YUJYQYJJJNRDCO-VWLOTQADSA-N 2 0 401.554 4.052 20 0 HIADRP Cc1ccc([C@H](OC[C@@H](O)C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c2ccccc2)cc1 ZINC000512581661 921247905 /nfs/dbraw/zinc/24/79/05/921247905.db2.gz JGYVEMOWZHUNNL-CBZARRIZSA-N 2 0 408.586 4.019 20 0 HIADRP c1cn(Cc2ccccc2)c(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000512618658 921263615 /nfs/dbraw/zinc/26/36/15/921263615.db2.gz JMTWMQWDCAKYEF-JIMJEQGWSA-N 2 0 414.597 4.364 20 0 HIADRP Cc1cc(C)n(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)cn2)n1 ZINC000512625382 921266600 /nfs/dbraw/zinc/26/66/00/921266600.db2.gz NVRQIPLCPLQQTE-DSNGMDLFSA-N 2 0 415.585 4.274 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)cc1)C1CC1 ZINC000512625305 921266672 /nfs/dbraw/zinc/26/66/72/921266672.db2.gz OUZRHBXWLUMYRJ-HXUWFJFHSA-N 2 0 411.615 4.374 20 0 HIADRP Cc1cc(C)n(-c2ccc(C[NH2+][C@@H]3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)cn2)n1 ZINC000512625384 921266904 /nfs/dbraw/zinc/26/69/04/921266904.db2.gz NVRQIPLCPLQQTE-ISJGIBHGSA-N 2 0 415.585 4.274 20 0 HIADRP COc1ccccc1[C@H](C)NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000497292768 906829801 /nfs/dbraw/zinc/82/98/01/906829801.db2.gz JLGZYCKUIXPSQV-SFTDATJTSA-N 2 0 423.601 4.427 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CCC[C@H]2C[NH+](C)CC[C@H]21)C1CCCCC1 ZINC000497401561 906881818 /nfs/dbraw/zinc/88/18/18/906881818.db2.gz PEHXYEKUUXYYBU-LADGPHEKSA-N 2 0 412.622 4.077 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@@H]4CCOC5(CCSCC5)C4)[C@H]3C2)cc1 ZINC000512653970 921275661 /nfs/dbraw/zinc/27/56/61/921275661.db2.gz IHQZPTBLGMGLHP-BJESRGMDSA-N 2 0 400.632 4.322 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@H]4CCOC5(CCSCC5)C4)[C@@H]3C2)cc1 ZINC000512653971 921275991 /nfs/dbraw/zinc/27/59/91/921275991.db2.gz IHQZPTBLGMGLHP-GPJHCHHRSA-N 2 0 400.632 4.322 20 0 HIADRP O=C(NC1CC[NH+](CC2CCCC2)CC1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000497564094 907051053 /nfs/dbraw/zinc/05/10/53/907051053.db2.gz KPMANZCPIXJIIY-QILAJZQNSA-N 2 0 424.633 4.136 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]2C)CC1 ZINC000497631814 907112630 /nfs/dbraw/zinc/11/26/30/907112630.db2.gz DUVZYIABHNHUSW-DNRQZRRGSA-N 2 0 420.601 4.174 20 0 HIADRP CCS[C@@H]1CCCC[NH+](CC2(C[N@H+]3CCCC[C@H](SCC)C3)COC2)C1 ZINC000497849237 907329175 /nfs/dbraw/zinc/32/91/75/907329175.db2.gz WJRTZGPUBHOZEM-BGYRXZFFSA-N 2 0 400.698 4.218 20 0 HIADRP C[C@H](NC(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@@H](c1ccccc1)[NH+](C)C ZINC000498024366 907523767 /nfs/dbraw/zinc/52/37/67/907523767.db2.gz CSUWSBGPYVUENH-UDDWMFPDSA-N 2 0 414.619 4.122 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)N[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)C[C@@H]1C ZINC000498671864 908102545 /nfs/dbraw/zinc/10/25/45/908102545.db2.gz PFPYWQBTBWIEST-BYZLFZLASA-N 2 0 422.564 4.003 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)[C@@H]2C[N@@H+](C(C)(C)C)C[C@H]2C(F)(F)F)CC1 ZINC000498981702 908368937 /nfs/dbraw/zinc/36/89/37/908368937.db2.gz ZAIKLEKXJMQXSL-RTBURBONSA-N 2 0 419.576 4.256 20 0 HIADRP CC[NH+]1CCN(c2ccccc2N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499118750 908476264 /nfs/dbraw/zinc/47/62/64/908476264.db2.gz RQQKUTSOOBNYMU-BKFWDETESA-N 2 0 404.602 4.436 20 0 HIADRP c1cn(Cc2ccccc2)c(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000499138562 908495412 /nfs/dbraw/zinc/49/54/12/908495412.db2.gz FXMSHHSURLYQLV-QEIWAGNOSA-N 2 0 400.570 4.259 20 0 HIADRP Clc1cc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc2c1OCCO2 ZINC000499147110 908506110 /nfs/dbraw/zinc/50/61/10/908506110.db2.gz OSTITOYSWLEMFC-WKCHPHFGSA-N 2 0 412.961 4.439 20 0 HIADRP OC[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1cccc(OC(F)(F)F)c1 ZINC000512998880 921465135 /nfs/dbraw/zinc/46/51/35/921465135.db2.gz MDRXQBXFDDBNIG-GOSISDBHSA-N 2 0 414.512 4.123 20 0 HIADRP C[C@H](NC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1)[C@H](c1ccccc1)[NH+](C)C ZINC000500574459 909938496 /nfs/dbraw/zinc/93/84/96/909938496.db2.gz NSKRQYCACNEXRG-MALGCSLJSA-N 2 0 400.611 4.020 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(CNC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)cc2)C1 ZINC000500697042 910029328 /nfs/dbraw/zinc/02/93/28/910029328.db2.gz LTJMWNCVBJQKDS-KDURUIRLSA-N 2 0 414.638 4.273 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1ccsc1 ZINC000501027527 910244366 /nfs/dbraw/zinc/24/43/66/910244366.db2.gz ZVSXYUOTPCZQSP-UXHICEINSA-N 2 0 421.010 4.141 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1ccsc1 ZINC000501027528 910244592 /nfs/dbraw/zinc/24/45/92/910244592.db2.gz ZVSXYUOTPCZQSP-VQTJNVASSA-N 2 0 421.010 4.141 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CCCN1CC[NH+](C(C)C)CC1 ZINC000501028850 910246246 /nfs/dbraw/zinc/24/62/46/910246246.db2.gz KWQNMXHUCBCAHE-QGZVFWFLSA-N 2 0 404.599 4.324 20 0 HIADRP C[N@@H+](CC(=O)Nc1cccc(Cl)c1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501054533 910264927 /nfs/dbraw/zinc/26/49/27/910264927.db2.gz UHXCTYOKUOVGQQ-UHFFFAOYSA-N 2 0 407.345 4.175 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)CC1 ZINC000501054363 910265054 /nfs/dbraw/zinc/26/50/54/910265054.db2.gz YCBOEAIJWQWVKM-QFIPXVFZSA-N 2 0 421.029 4.288 20 0 HIADRP Cc1cc(-c2noc([C@@H](C)[N@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)n2)ccc1F ZINC000501078536 910278950 /nfs/dbraw/zinc/27/89/50/910278950.db2.gz JZLHQRMXIHNBDZ-QGZVFWFLSA-N 2 0 409.509 4.489 20 0 HIADRP CC(C)Cc1ccc(C(=O)C2CC[NH+](CCCN3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC000501137696 910319377 /nfs/dbraw/zinc/31/93/77/910319377.db2.gz WFLYAYSXYBDQPR-UHFFFAOYSA-N 2 0 413.650 4.196 20 0 HIADRP C[NH+](C)CCCC1CCN(C(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)CC1 ZINC000501374386 910503463 /nfs/dbraw/zinc/50/34/63/910503463.db2.gz ZGYYSJISUWGJSQ-UHFFFAOYSA-N 2 0 400.611 4.301 20 0 HIADRP C[N@H+](C[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513147837 921584116 /nfs/dbraw/zinc/58/41/16/921584116.db2.gz CVZQDTMUXYPMDR-DVMHTGGUSA-N 2 0 422.613 4.309 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2nc(-c3ccccc3C)no2)CC1 ZINC000501773185 910828390 /nfs/dbraw/zinc/82/83/90/910828390.db2.gz GRXCQGDVEJSRCR-IBGZPJMESA-N 2 0 400.567 4.176 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2coc(-c3ccc(F)c(F)c3)n2)CC1 ZINC000501819010 910867761 /nfs/dbraw/zinc/86/77/61/910867761.db2.gz QBHGHLDMFQGLQP-UHFFFAOYSA-N 2 0 407.505 4.190 20 0 HIADRP CSc1nnc(CCC[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)n1CC(C)C ZINC000513208703 921624304 /nfs/dbraw/zinc/62/43/04/921624304.db2.gz XJXJNJCNOFAAQZ-QUCCMNQESA-N 2 0 407.672 4.221 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)C1 ZINC000502509578 911513642 /nfs/dbraw/zinc/51/36/42/911513642.db2.gz LJZBHAGFKAALAK-FYJROPJGSA-N 2 0 412.622 4.164 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NCC2([NH+]3CCC(OC)CC3)CCCC2)cc1)C(C)C ZINC000502579418 911585257 /nfs/dbraw/zinc/58/52/57/911585257.db2.gz PKOHLKAWLSJXIQ-UHFFFAOYSA-N 2 0 415.622 4.070 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCC(C)(C)[NH2+][C@H](C)c2ccccc2)[NH+]2CCCC2)o1 ZINC000502781377 911805261 /nfs/dbraw/zinc/80/52/61/911805261.db2.gz LVCVENIZEXYACU-CTNGQTDRSA-N 2 0 412.578 4.154 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)CCCC1)c1ccccc1 ZINC000502914430 911900808 /nfs/dbraw/zinc/90/08/08/911900808.db2.gz ZRZQNBWRXJIMMX-WIYYLYMNSA-N 2 0 414.619 4.314 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1)c1ccccc1 ZINC000502930806 911917689 /nfs/dbraw/zinc/91/76/89/911917689.db2.gz AAKMYRXODUFHAA-REWPJTCUSA-N 2 0 408.590 4.252 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1)c1ccccc1 ZINC000503090212 912060094 /nfs/dbraw/zinc/06/00/94/912060094.db2.gz ODSIIRJNSNSVNK-JTAQYXEDSA-N 2 0 408.590 4.251 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)cc1 ZINC000513326909 921715839 /nfs/dbraw/zinc/71/58/39/921715839.db2.gz YOUMLBFRWDAWQE-UHFFFAOYSA-N 3 0 413.650 4.444 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCCCn2nnc(-c3ccccc3)n2)C1 ZINC000506475372 915076167 /nfs/dbraw/zinc/07/61/67/915076167.db2.gz VUYCTXFBAUCMEF-FGZHOGPDSA-N 2 0 410.610 4.097 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000506920284 915720542 /nfs/dbraw/zinc/72/05/42/915720542.db2.gz ZVJQQMWYEINFCF-BHIFYINESA-N 2 0 416.610 4.103 20 0 HIADRP C[N@H+](CCc1cccc2ccccc21)CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000507305513 916067517 /nfs/dbraw/zinc/06/75/17/916067517.db2.gz NWVRLDPIVJHTQB-UHFFFAOYSA-N 2 0 415.581 4.226 20 0 HIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCc4nnc(-c5ccc(F)cc5)n4C3)CC2)C1 ZINC000507604843 916361102 /nfs/dbraw/zinc/36/11/02/916361102.db2.gz IVLCEXFRDKHGMF-WTNAPCKOSA-N 2 0 411.569 4.032 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4c3cc(Cl)cc4Cl)cn2)CC1 ZINC000507845141 916660109 /nfs/dbraw/zinc/66/01/09/916660109.db2.gz QFNLWXXUHKGECJ-HXUWFJFHSA-N 2 0 405.373 4.307 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](CCC(=O)N[C@H](c2cccs2)c2ccccc2)CC1 ZINC000507964907 916818327 /nfs/dbraw/zinc/81/83/27/916818327.db2.gz IXENAWXPLGOLFF-DEOSSOPVSA-N 2 0 413.631 4.398 20 0 HIADRP C[C@H]([NH2+]CCc1nc(-c2ccc(Cl)cc2)no1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703105 917464368 /nfs/dbraw/zinc/46/43/68/917464368.db2.gz XMFYZJYAYYWMPR-PXNSSMCTSA-N 2 0 410.949 4.433 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]Cc3ccc(-c4cnn(C)c4)s3)cc2)C[C@@H](C)O1 ZINC000509533244 918181666 /nfs/dbraw/zinc/18/16/66/918181666.db2.gz POMOBFWZUGRBDU-QZTJIDSGSA-N 2 0 410.587 4.048 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2ccc(-c3ccccc3Br)cc2)CC1 ZINC000509533819 918183148 /nfs/dbraw/zinc/18/31/48/918183148.db2.gz UNMVSVXZYHKNAV-GOSISDBHSA-N 2 0 416.407 4.232 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CC[C@@H](C)[N@H+](Cc2ccccc2)CC1)c1ccco1 ZINC000509592572 918241224 /nfs/dbraw/zinc/24/12/24/918241224.db2.gz UFDPMCWYZWLMPH-TUNNFDKTSA-N 2 0 412.578 4.015 20 0 HIADRP CC[C@@H](C)[NH2+][C@H](CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)c1ccco1 ZINC000509595398 918244185 /nfs/dbraw/zinc/24/41/85/918244185.db2.gz HGHCAAWYLMTIIN-TZIWHRDSSA-N 2 0 404.599 4.006 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NCc1ccccc1C[NH+]1CCCCC1 ZINC000510357610 918850841 /nfs/dbraw/zinc/85/08/41/918850841.db2.gz YEJPAAHVNFHHQD-UHFFFAOYSA-N 2 0 405.542 4.410 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NC[C@H](c1ccc(C)o1)[NH+]1CCCC1 ZINC000510461895 918917351 /nfs/dbraw/zinc/91/73/51/918917351.db2.gz NPVKHWJXRZMYNQ-JOCHJYFZSA-N 2 0 412.578 4.066 20 0 HIADRP Cc1cc(OCCC[C@H](C)[NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)ccc1Cl ZINC000510731763 919178634 /nfs/dbraw/zinc/17/86/34/919178634.db2.gz IKNUSAXOWFJUAL-IBGZPJMESA-N 2 0 408.030 4.344 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCc2ccc(Br)cc21 ZINC000510943030 919471699 /nfs/dbraw/zinc/47/16/99/919471699.db2.gz HLUDRSNQIYJEQI-UNMCSNQZSA-N 2 0 415.375 4.183 20 0 HIADRP O=C(Nc1ccccc1)N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000511025786 919599586 /nfs/dbraw/zinc/59/95/86/919599586.db2.gz FXDHREUFJXMSMA-DDKRZIBASA-N 2 0 418.585 4.183 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH+]2CCC(C)(c3nc4ccccc4s3)CC2)CC1 ZINC000511140844 919759532 /nfs/dbraw/zinc/75/95/32/919759532.db2.gz UZCJXXGJPZYFSJ-UHFFFAOYSA-N 2 0 400.636 4.066 20 0 HIADRP C[C@@H](NC(=O)NCCC[NH+](Cc1ccccc1)Cc1ccccc1)C1=CC[N@H+](C)CC1 ZINC000511237014 919841261 /nfs/dbraw/zinc/84/12/61/919841261.db2.gz YPXHOYOHLDKFBE-JOCHJYFZSA-N 2 0 420.601 4.029 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)[NH+]2CCCC2)cc1 ZINC000511251966 919853889 /nfs/dbraw/zinc/85/38/89/919853889.db2.gz RGQZTYKLLVOMCM-SFLYRZDNSA-N 2 0 412.622 4.084 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@H](C)[C@H]2CCC[NH+](C3CCC3)C2)CC1)CC(C)C ZINC000511266760 919865035 /nfs/dbraw/zinc/86/50/35/919865035.db2.gz PWYCQWJVZPWTTG-GGAORHGYSA-N 2 0 420.686 4.429 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)c1 ZINC000511568385 920210859 /nfs/dbraw/zinc/21/08/59/920210859.db2.gz ZDMHOCXXAJHREI-DEOSSOPVSA-N 2 0 417.553 4.479 20 0 HIADRP C[N@@H+]1CC[C@H](NC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)CC2(C)C)[C@H]1c1ccccc1 ZINC000511742008 920416787 /nfs/dbraw/zinc/41/67/87/920416787.db2.gz JOJGVJAXVFCANC-RBZQAINGSA-N 2 0 420.601 4.032 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)N(C)Cc2c(F)cccc2Cl)CC1 ZINC000512247740 921006451 /nfs/dbraw/zinc/00/64/51/921006451.db2.gz AJHFKAJWLQTIMC-QGZVFWFLSA-N 2 0 411.993 4.270 20 0 HIADRP C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512318372 921068239 /nfs/dbraw/zinc/06/82/39/921068239.db2.gz OODZVCCZIQIQIK-QZTJIDSGSA-N 2 0 403.998 4.187 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512323556 921073761 /nfs/dbraw/zinc/07/37/61/921073761.db2.gz NOXQHMGBKYVGMR-IKGGRYGDSA-N 2 0 422.411 4.409 20 0 HIADRP Cc1ccccc1NC(=O)C[C@@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000513588093 921919667 /nfs/dbraw/zinc/91/96/67/921919667.db2.gz HTDHRCJPVQRDEO-NJYVYQBISA-N 2 0 409.574 4.111 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccccc3OCc3ccccc3)cc2)CC1 ZINC000513648278 921971621 /nfs/dbraw/zinc/97/16/21/921971621.db2.gz OTRDRVKXPFTGDX-UHFFFAOYSA-N 2 0 415.581 4.303 20 0 HIADRP CCCOc1c(Br)cc(C[N@H+](C)CC2CC[NH+](C)CC2)cc1OCC ZINC000513750100 922070446 /nfs/dbraw/zinc/07/04/46/922070446.db2.gz AMOMHLCZQGTDIE-UHFFFAOYSA-N 2 0 413.400 4.410 20 0 HIADRP CCCN(C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000513883830 922213757 /nfs/dbraw/zinc/21/37/57/922213757.db2.gz LJUAWWARHSRMMO-JOCHJYFZSA-N 2 0 414.638 4.382 20 0 HIADRP Cc1ccccc1[C@H](OC[C@@H](O)C[N@@H+](C)C1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000514005200 922327933 /nfs/dbraw/zinc/32/79/33/922327933.db2.gz DHJYFCVMTGQKBW-AZGAKELHSA-N 2 0 410.602 4.267 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)NCC2(CC)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000514030339 922352057 /nfs/dbraw/zinc/35/20/57/922352057.db2.gz DUJNHUYXRKTORF-HSZRJFAPSA-N 2 0 414.638 4.052 20 0 HIADRP CCCN(C(=O)NC1CC[NH+](CC(C)C)CC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000514061428 922385705 /nfs/dbraw/zinc/38/57/05/922385705.db2.gz GOHHZEOWWRPTFG-DEOSSOPVSA-N 2 0 414.638 4.193 20 0 HIADRP CSC1(C[NH2+][C@@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)CC[NH+](C)CC1 ZINC000514821213 922814705 /nfs/dbraw/zinc/81/47/05/922814705.db2.gz UMWOBTMDHPIUDO-HKUYNNGSSA-N 2 0 410.599 4.252 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)c1ccc(F)cc1 ZINC000515798143 923356293 /nfs/dbraw/zinc/35/62/93/923356293.db2.gz UEOPOZWCGCMHHZ-HSZRJFAPSA-N 2 0 412.553 4.279 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NCc2ccc(C[NH+](C)C)cc2)c2ccccc2)CC1 ZINC000516560295 923795410 /nfs/dbraw/zinc/79/54/10/923795410.db2.gz SDGMFQGJLSIBRJ-DEOSSOPVSA-N 2 0 408.590 4.021 20 0 HIADRP CCC[N@@H+]1CCC[C@H]1C(=O)N1CCC([NH+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000517680831 926786153 /nfs/dbraw/zinc/78/61/53/926786153.db2.gz IIPGTWCFKXUFFE-FQEVSTJZSA-N 2 0 411.512 4.003 20 0 HIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(CC)Cc2ccc(C[NH+](C)C)cc2)C1 ZINC000517703241 926803769 /nfs/dbraw/zinc/80/37/69/926803769.db2.gz RYJOWRRFTBTDQK-HXUWFJFHSA-N 2 0 402.627 4.180 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)c2ccccc2)CC1 ZINC000518363460 927221893 /nfs/dbraw/zinc/22/18/93/927221893.db2.gz KNYKLIAPVAUFBV-RTWAWAEBSA-N 2 0 414.619 4.123 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CC[C@@]2(C1)CCc1ccccc1O2)C1CC[NH+](C)CC1 ZINC000518848646 927551288 /nfs/dbraw/zinc/55/12/88/927551288.db2.gz RVBYFMBXODGLFU-AREMUKBSSA-N 2 0 405.586 4.187 20 0 HIADRP Fc1cncc([C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C2CC2)c1 ZINC000519192130 927819608 /nfs/dbraw/zinc/81/96/08/927819608.db2.gz ARQICTZXQUPAAP-ISKFKSNPSA-N 2 0 409.549 4.190 20 0 HIADRP COc1cc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)cc2c1OCCO2 ZINC000520228822 928401950 /nfs/dbraw/zinc/40/19/50/928401950.db2.gz MJTCMSGENGRYND-UHFFFAOYSA-N 2 0 416.949 4.122 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCSCC2)cc1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000520291502 928453493 /nfs/dbraw/zinc/45/34/93/928453493.db2.gz QKJISPHSYBGJFL-HSZRJFAPSA-N 2 0 423.626 4.129 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CC[C@H]([NH+]3CCCCC3)C2)cc1 ZINC000520756645 928802984 /nfs/dbraw/zinc/80/29/84/928802984.db2.gz QATYKMIAIYGCPN-DEOSSOPVSA-N 2 0 420.601 4.185 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000524878677 929869818 /nfs/dbraw/zinc/86/98/18/929869818.db2.gz OLSIOKDYDAMQOK-JOCHJYFZSA-N 2 0 423.601 4.144 20 0 HIADRP C[N@H+](C[C@H](O)COc1ccc2ccccc2c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525269546 930120321 /nfs/dbraw/zinc/12/03/21/930120321.db2.gz AQZFKSREXUNAID-DHLKQENFSA-N 2 0 404.554 4.033 20 0 HIADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)N[C@@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000525437336 930239757 /nfs/dbraw/zinc/23/97/57/930239757.db2.gz KMHIKYMZFRQXDU-VWLOTQADSA-N 2 0 418.585 4.064 20 0 HIADRP O=C(Nc1cccc(C[NH+]2CCSCC2)c1)[C@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000525484222 930272921 /nfs/dbraw/zinc/27/29/21/930272921.db2.gz ZPGLWLMVHLUWMJ-HSZRJFAPSA-N 2 0 409.599 4.229 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(CN3CC[NH+](C)CC3)cc1)CCCS2 ZINC000525858213 930469479 /nfs/dbraw/zinc/46/94/79/930469479.db2.gz RRZDYFWXKQCLLF-QHCPKHFHSA-N 2 0 411.615 4.159 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+][C@@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000525858342 930469546 /nfs/dbraw/zinc/46/95/46/930469546.db2.gz GDRUFPGPMGDUSX-LJQANCHMSA-N 2 0 414.819 4.169 20 0 HIADRP C[C@H]1CCc2ccc(Br)cc2[C@H]([NH2+]CCCC[NH+]2CCN(C)CC2)C1 ZINC000526041611 930512700 /nfs/dbraw/zinc/51/27/00/930512700.db2.gz BICCIZNOMKEBPP-LAUBAEHRSA-N 2 0 408.428 4.080 20 0 HIADRP C[C@@H]1CCc2ccc(Br)cc2[C@@H]([NH2+]CCCC[NH+]2CCN(C)CC2)C1 ZINC000526041612 930512871 /nfs/dbraw/zinc/51/28/71/930512871.db2.gz BICCIZNOMKEBPP-UTKZUKDTSA-N 2 0 408.428 4.080 20 0 HIADRP Brc1ccc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)nc1 ZINC000530903842 930854439 /nfs/dbraw/zinc/85/44/39/930854439.db2.gz MHDSPNMVQOPLGO-UHFFFAOYSA-N 2 0 418.379 4.005 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)CC(=O)Nc2ccccc2)CC1 ZINC000530906671 930855326 /nfs/dbraw/zinc/85/53/26/930855326.db2.gz ZCQPGTUOAICIFT-RTBURBONSA-N 2 0 412.553 4.036 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCC(C)CC2)CC1 ZINC000531204020 930963629 /nfs/dbraw/zinc/96/36/29/930963629.db2.gz PVPZCLISGSDKQF-VWLOTQADSA-N 2 0 420.601 4.196 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cc(-c4ccccc4)ccc3OC)cn2)CC1 ZINC000531535411 931095616 /nfs/dbraw/zinc/09/56/16/931095616.db2.gz WMKXZJDQEWAJFN-UHFFFAOYSA-N 2 0 416.569 4.189 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1OC(F)F ZINC000531597171 931115675 /nfs/dbraw/zinc/11/56/75/931115675.db2.gz ZHXYFARYFDETLO-UHFFFAOYSA-N 2 0 419.516 4.117 20 0 HIADRP COc1cc(C[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@H]2C)ccc1OCC(F)(F)F ZINC000531691797 931156229 /nfs/dbraw/zinc/15/62/29/931156229.db2.gz HBKLTURVKKMKOQ-VQIMIIECSA-N 2 0 423.479 4.032 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531694321 931157455 /nfs/dbraw/zinc/15/74/55/931157455.db2.gz ODRMOLJUUCDLOK-LJQANCHMSA-N 2 0 400.588 4.317 20 0 HIADRP COc1ccc(-c2ccccc2)cc1C[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000531789562 931197400 /nfs/dbraw/zinc/19/74/00/931197400.db2.gz NBQVJSPXXUUZBR-UHFFFAOYSA-N 2 0 423.601 4.079 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NC[C@@H]1CC[N@H+](CC(C)C)C1)c1cccc(C(F)(F)F)c1 ZINC000531800670 931203781 /nfs/dbraw/zinc/20/37/81/931203781.db2.gz VJAFJTOGWNAJGU-PXNSSMCTSA-N 2 0 413.528 4.182 20 0 HIADRP C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531966890 931269498 /nfs/dbraw/zinc/26/94/98/931269498.db2.gz WWSVHHVXXKBHGR-CQSZACIVSA-N 2 0 411.443 4.413 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC000531977779 931272937 /nfs/dbraw/zinc/27/29/37/931272937.db2.gz GDKWGYOEBDORQL-KRWDZBQOSA-N 2 0 410.002 4.413 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3c[nH]nc3-c3ccccc3F)CC2)c1 ZINC000532042561 931295138 /nfs/dbraw/zinc/29/51/38/931295138.db2.gz YMSMBYFYKBXCKA-UHFFFAOYSA-N 2 0 421.564 4.216 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000532195776 931344210 /nfs/dbraw/zinc/34/42/10/931344210.db2.gz CVMBYCVJNKNWNM-CQSZACIVSA-N 2 0 411.434 4.402 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(SCC(F)(F)F)cc1 ZINC000532197120 931345090 /nfs/dbraw/zinc/34/50/90/931345090.db2.gz GDAJMKZTQAKJAF-MRXNPFEDSA-N 2 0 424.536 4.339 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@H](C)c3ccc4c(c3)CCC(=O)N4)CC2)c1 ZINC000532200977 931346939 /nfs/dbraw/zinc/34/69/39/931346939.db2.gz ZDSJTSIGTYPRQO-OAQYLSRUSA-N 2 0 420.601 4.133 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(OC)c(Br)c2)[C@@H](C)C1 ZINC000532223227 931360805 /nfs/dbraw/zinc/36/08/05/931360805.db2.gz LSAMSZNWOGLLGC-BXWFABGCSA-N 2 0 413.400 4.245 20 0 HIADRP COc1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)c(-c2ccccc2)cc1OC ZINC000532270306 931378564 /nfs/dbraw/zinc/37/85/64/931378564.db2.gz ZGIMVMBUKSGAEY-BJKOFHAPSA-N 2 0 424.585 4.228 20 0 HIADRP C[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)Oc1ccccc1Cl ZINC000532358711 931407732 /nfs/dbraw/zinc/40/77/32/931407732.db2.gz XNJONTCXVBZWCJ-GOSISDBHSA-N 2 0 401.982 4.428 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccccc1OCC(F)(F)F)C1CC[NH+](C)CC1 ZINC000532361525 931409477 /nfs/dbraw/zinc/40/94/77/931409477.db2.gz FNIFIOQJLDGULM-UHFFFAOYSA-N 2 0 421.507 4.448 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CCCC[NH+]1CCN(C)CC1 ZINC000532451037 931439786 /nfs/dbraw/zinc/43/97/86/931439786.db2.gz SCQWVICKILSIBX-MRXNPFEDSA-N 2 0 407.027 4.450 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc2c(c1)OCCCO2 ZINC000532454430 931442535 /nfs/dbraw/zinc/44/25/35/931442535.db2.gz SBQIAXUMLUOXNM-ZCNNSNEGSA-N 2 0 410.558 4.308 20 0 HIADRP C[C@@H](NCc1ccccc1C[NH+]1CCCCC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000532457758 931443811 /nfs/dbraw/zinc/44/38/11/931443811.db2.gz QXDOUSOEGLDVHK-QGZVFWFLSA-N 2 0 404.551 4.066 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]Cc1ccccc1-n1ccnc1 ZINC000532465089 931446608 /nfs/dbraw/zinc/44/66/08/931446608.db2.gz DJYDEXRQXQWRFD-OAHLLOKOSA-N 2 0 418.419 4.278 20 0 HIADRP CC[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1OC(F)F ZINC000532481121 931455423 /nfs/dbraw/zinc/45/54/23/931455423.db2.gz OXLKUMSYHOTUKE-SFTDATJTSA-N 2 0 403.517 4.317 20 0 HIADRP C[C@H](CC[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1)[N@H+](C)Cc1ccccc1 ZINC000532522657 931473848 /nfs/dbraw/zinc/47/38/48/931473848.db2.gz XTMCJEUMPKNNKG-LJQANCHMSA-N 2 0 413.993 4.445 20 0 HIADRP O=C(c1ccccc1Cl)N1CCC([NH2+]C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000532548613 931518274 /nfs/dbraw/zinc/51/82/74/931518274.db2.gz LSTPQNYKHDZUED-UHFFFAOYSA-N 2 0 403.998 4.331 20 0 HIADRP C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000532977953 931723844 /nfs/dbraw/zinc/72/38/44/931723844.db2.gz XXSDKFSZELPPDC-UGKGYDQZSA-N 2 0 409.599 4.052 20 0 HIADRP O=C(CC[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1)N[C@@H](c1cccs1)c1ccccc1 ZINC000533293223 931830793 /nfs/dbraw/zinc/83/07/93/931830793.db2.gz CGCNSCAOVLQLEU-XUZZJYLKSA-N 2 0 411.615 4.294 20 0 HIADRP CC(C)[NH+]1CCN([C@H]2CC[N@@H+]([C@H](C)c3cccc(NC(=O)c4ccccc4)c3)C2)CC1 ZINC000533308220 931834852 /nfs/dbraw/zinc/83/48/52/931834852.db2.gz LYKYXPLVECEQDE-BWKNWUBXSA-N 2 0 420.601 4.100 20 0 HIADRP C[NH+](C)Cc1ccc(C[NH2+]CC2=Cc3cc(Br)ccc3OC2)cc1F ZINC000534240045 932358824 /nfs/dbraw/zinc/35/88/24/932358824.db2.gz MMLUAVGMXMSITL-UHFFFAOYSA-N 2 0 405.311 4.215 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCc3c2cc(Cl)cc3Br)CC1 ZINC000535506510 933199098 /nfs/dbraw/zinc/19/90/98/933199098.db2.gz FAQVKUPFIBNEDE-LJQANCHMSA-N 2 0 414.819 4.097 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)NC[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000535683631 933337896 /nfs/dbraw/zinc/33/78/96/933337896.db2.gz LANITUWAVVHCAH-LAUBAEHRSA-N 2 0 424.992 4.036 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000537293762 933700701 /nfs/dbraw/zinc/70/07/01/933700701.db2.gz FPCSJLVJGBZQHY-HOTGVXAUSA-N 2 0 408.384 4.120 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccncc2)C1 ZINC000537324944 933716512 /nfs/dbraw/zinc/71/65/12/933716512.db2.gz DNZJAIYPUBNCRS-OAQYLSRUSA-N 2 0 403.574 4.392 20 0 HIADRP CC(C)c1nn(-c2ccc(Br)cc2)cc1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000537343620 933726764 /nfs/dbraw/zinc/72/67/64/933726764.db2.gz LUZKFZGBHXLCMC-UHFFFAOYSA-N 2 0 403.368 4.110 20 0 HIADRP CSc1cccc([C@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2cc(F)ccc2F)c1 ZINC000537607084 938332281 /nfs/dbraw/zinc/33/22/81/938332281.db2.gz ONYUFZPKXMSNQS-QHCPKHFHSA-N 2 0 419.585 4.393 20 0 HIADRP CC(C)(C)c1nn(-c2ccccc2)cc1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000537618960 938335586 /nfs/dbraw/zinc/33/55/86/938335586.db2.gz RFRRAYONMBBEKS-UHFFFAOYSA-N 2 0 410.606 4.247 20 0 HIADRP COc1ccc(C[NH+]2CCC(CC[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)cc1OC(F)F ZINC000537660039 938348551 /nfs/dbraw/zinc/34/85/51/938348551.db2.gz UVXXFGJETFRWSB-IAGOWNOFSA-N 2 0 412.521 4.008 20 0 HIADRP CSc1ccccc1NC(=O)[C@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537847032 938388966 /nfs/dbraw/zinc/38/89/66/938388966.db2.gz QTJCUNGGTNRYSF-SFHVURJKSA-N 2 0 412.603 4.369 20 0 HIADRP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)C[N@@H+]1Cc1ccccc1 ZINC000537940333 938425378 /nfs/dbraw/zinc/42/53/78/938425378.db2.gz FMLUBHJBJKFMRS-YNIBOWSTSA-N 2 0 406.618 4.182 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000537959212 938434356 /nfs/dbraw/zinc/43/43/56/938434356.db2.gz YDMRKLRLZNRMIG-CEWLAPEOSA-N 2 0 415.578 4.294 20 0 HIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1F ZINC000537962435 938436370 /nfs/dbraw/zinc/43/63/70/938436370.db2.gz ZKWXDXKQWCTZHQ-KZKAQZJJSA-N 2 0 404.570 4.218 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1cnn(Cc2ccccc2)c1 ZINC000537991964 938453066 /nfs/dbraw/zinc/45/30/66/938453066.db2.gz UUMVXNIIYDFZTE-QHCPKHFHSA-N 2 0 417.601 4.184 20 0 HIADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000563314346 945175935 /nfs/dbraw/zinc/17/59/35/945175935.db2.gz IXNHOWFOEUZFSX-CTNGQTDRSA-N 2 0 415.603 4.011 20 0 HIADRP CC(C)[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000538116457 938506285 /nfs/dbraw/zinc/50/62/85/938506285.db2.gz LARRYVHGEZYREJ-DEOSSOPVSA-N 2 0 422.573 4.423 20 0 HIADRP O=C(C[NH2+]C1(c2ccccc2)CCCC1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000538191955 938547401 /nfs/dbraw/zinc/54/74/01/938547401.db2.gz YQBHVFWZDQMSHQ-UHFFFAOYSA-N 2 0 409.599 4.233 20 0 HIADRP CCN(CC)C(=O)c1ccc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000538274973 938581105 /nfs/dbraw/zinc/58/11/05/938581105.db2.gz PDGVOXRQFQZALQ-HSZRJFAPSA-N 2 0 421.585 4.246 20 0 HIADRP C[C@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2sccc2C1 ZINC000538276829 938581708 /nfs/dbraw/zinc/58/17/08/938581708.db2.gz SHQWQXGGCBVZSV-WIYYLYMNSA-N 2 0 411.615 4.073 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCNc1ncc(Cl)cc1Cl)c1ccccc1O2 ZINC000538293667 938584979 /nfs/dbraw/zinc/58/49/79/938584979.db2.gz MJAVLWCRRPRYJS-GOSISDBHSA-N 2 0 421.372 4.378 20 0 HIADRP Cc1ccccc1[C@H]([NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)C1CC1 ZINC000538390467 938609512 /nfs/dbraw/zinc/60/95/12/938609512.db2.gz ALIZXOIYSFMFPR-NBGIEHNGSA-N 2 0 405.586 4.205 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H](CC3CCC3)c3ccccc3)c2)C1 ZINC000538396289 938610811 /nfs/dbraw/zinc/61/08/11/938610811.db2.gz YKCSVOUOSNJIMV-RPBOFIJWSA-N 2 0 405.586 4.405 20 0 HIADRP CC(C)N1CC[C@@H](NC(=O)c2ccc(C[NH+](C)C)cc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000538624216 938664752 /nfs/dbraw/zinc/66/47/52/938664752.db2.gz NMMNZQZFRRHGDI-FGZHOGPDSA-N 2 0 417.956 4.495 20 0 HIADRP C[NH+](C)CCOc1ccccc1N1CC[NH+](Cc2cccc(-c3cccnc3)c2)CC1 ZINC000538733162 938695502 /nfs/dbraw/zinc/69/55/02/938695502.db2.gz VTALGPMLSPGUOS-UHFFFAOYSA-N 2 0 416.569 4.011 20 0 HIADRP Cn1cc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c(-c2cccs2)n1 ZINC000538759094 938703606 /nfs/dbraw/zinc/70/36/06/938703606.db2.gz DBKAMZMHEXOWLM-UHFFFAOYSA-N 2 0 424.614 4.310 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNCc1c(Cl)cccc1N1CC[NH+](C)CC1 ZINC000538849806 938724679 /nfs/dbraw/zinc/72/46/79/938724679.db2.gz URPGNQAOMGNJNE-UHFFFAOYSA-N 2 0 415.025 4.222 20 0 HIADRP C[NH+](C)CCCOc1cccc(NCc2c(Cl)cccc2N2CC[NH+](C)CC2)c1 ZINC000538874695 938729166 /nfs/dbraw/zinc/72/91/66/938729166.db2.gz WRRJUDMCMWOELE-UHFFFAOYSA-N 2 0 416.997 4.034 20 0 HIADRP C[C@@H](NC(=O)[C@@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000538945300 938743357 /nfs/dbraw/zinc/74/33/57/938743357.db2.gz YSUUPTZSYWJHKK-RTBURBONSA-N 2 0 412.553 4.025 20 0 HIADRP COc1ccc(NC(=O)C[C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c(OC)c1 ZINC000539041182 938779007 /nfs/dbraw/zinc/77/90/07/938779007.db2.gz UKSOGEVAAXVGGT-XEVCZEQESA-N 2 0 417.594 4.054 20 0 HIADRP Cc1cc(C[C@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)n(-c2ccccc2)n1 ZINC000539048806 938782583 /nfs/dbraw/zinc/78/25/83/938782583.db2.gz VMBAGXQQVWVALS-FPOVZHCZSA-N 2 0 406.574 4.403 20 0 HIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1 ZINC000539063474 938789367 /nfs/dbraw/zinc/78/93/67/938789367.db2.gz GWOWBBUPBVHVHM-RAKLQZGLSA-N 2 0 401.378 4.117 20 0 HIADRP C[C@H]1C[N@H+](CCOc2ccc(CC[NH2+]C3CC[NH+](C(C)(C)C)CC3)cc2)C[C@H]1C ZINC000539298510 938836120 /nfs/dbraw/zinc/83/61/20/938836120.db2.gz QZQLAZSJKMFAAW-OYRHEFFESA-N 3 0 401.639 4.048 20 0 HIADRP COc1ccccc1N1CC[C@@H](C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C1 ZINC000539362918 938848853 /nfs/dbraw/zinc/84/88/53/938848853.db2.gz JLBQNCLJULXSTB-UNMCSNQZSA-N 2 0 421.585 4.099 20 0 HIADRP CC(C)Oc1ccc([C@H]2CCC[C@H]2[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)cc1 ZINC000539609425 938887651 /nfs/dbraw/zinc/88/76/51/938887651.db2.gz GXDZGKACNAGTGV-JWQCQUIFSA-N 2 0 423.601 4.191 20 0 HIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2cccc(Br)c2OC(F)F)C[C@H](C)O1 ZINC000539634052 938891130 /nfs/dbraw/zinc/89/11/30/938891130.db2.gz CHOMJVXWMKNEJS-KBPBESRZSA-N 2 0 421.326 4.030 20 0 HIADRP CC(C)[NH+]1CCN(c2cccc(N[C@H](C)[C@H](c3ccccc3)[NH+]3CCOCC3)c2)CC1 ZINC000539645256 938893146 /nfs/dbraw/zinc/89/31/46/938893146.db2.gz MHNZBKFVEFWSOG-ATIYNZHBSA-N 2 0 422.617 4.091 20 0 HIADRP CCn1c2ccccc2c2cc(C[N@@H+]3CC[C@H](N4CC[NH+](C(C)C)CC4)C3)ccc21 ZINC000539861696 938959842 /nfs/dbraw/zinc/95/98/42/938959842.db2.gz IHKYEVJBWSEPTM-QFIPXVFZSA-N 2 0 404.602 4.415 20 0 HIADRP Cc1ccc(-n2cc(C[N@H+]3CC[C@@H](N4CC[NH+](C(C)C)CC4)C3)c(C(C)(C)C)n2)cc1 ZINC000539862941 938960515 /nfs/dbraw/zinc/96/05/15/938960515.db2.gz OKSLNKZNEXMWSB-XMMPIXPASA-N 2 0 423.649 4.079 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)NC3CC[NH+](C4CCCC4)CC3)c2)CC1 ZINC000539872080 938962769 /nfs/dbraw/zinc/96/27/69/938962769.db2.gz FZXRSUXDZHICDG-UHFFFAOYSA-N 2 0 412.622 4.490 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCOc1ccc(C(F)(F)F)cn1)c1ccccc1O2 ZINC000540495431 939275477 /nfs/dbraw/zinc/27/54/77/939275477.db2.gz ZYFHRIHCYVZGKT-SFHVURJKSA-N 2 0 421.463 4.057 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]C1CCC(C(=O)OC(C)(C)C)CC1)c1ccccc1O2 ZINC000540507147 939280978 /nfs/dbraw/zinc/28/09/78/939280978.db2.gz WKWWRYXYJOYHQQ-GZNCHQMQSA-N 2 0 414.590 4.465 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2c(C)nn(C(C)(C)C)c2C)CC1 ZINC000540609559 939318492 /nfs/dbraw/zinc/31/84/92/939318492.db2.gz UXBFKNYMDLUMLJ-QGZVFWFLSA-N 2 0 415.601 4.387 20 0 HIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)ccc1OC(F)F ZINC000540990655 939426696 /nfs/dbraw/zinc/42/66/96/939426696.db2.gz SMGLPFZMBOVLMN-OXQOHEQNSA-N 2 0 420.500 4.104 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCCN(Cc2ccc(F)cc2Cl)C1 ZINC000541389621 939503545 /nfs/dbraw/zinc/50/35/45/939503545.db2.gz RRPLHOLYRCUHFT-FQEVSTJZSA-N 2 0 413.928 4.122 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000541543231 939548475 /nfs/dbraw/zinc/54/84/75/939548475.db2.gz FVNPFNSZUIORKS-HXUWFJFHSA-N 2 0 410.558 4.321 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000541548818 939551426 /nfs/dbraw/zinc/55/14/26/939551426.db2.gz IEQPLUMKDCEZQT-UXHICEINSA-N 2 0 410.558 4.464 20 0 HIADRP C[C@H](CCN[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)[NH2+][C@@H](C)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000541602859 939566070 /nfs/dbraw/zinc/56/60/70/939566070.db2.gz BZHRZFIHKPMYKJ-GNADVCDUSA-N 3 0 418.714 4.250 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000541744983 939619281 /nfs/dbraw/zinc/61/92/81/939619281.db2.gz BJBNOVJQAQMBRS-GOTSBHOMSA-N 2 0 406.636 4.182 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cccc(Br)c1 ZINC000541918049 939653773 /nfs/dbraw/zinc/65/37/73/939653773.db2.gz MBEGQWCUCWFSQK-IERDGZPVSA-N 2 0 403.364 4.257 20 0 HIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c1 ZINC000541917992 939653985 /nfs/dbraw/zinc/65/39/85/939653985.db2.gz KDKQDNBTZODGDT-PXNSSMCTSA-N 2 0 404.501 4.404 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000542302720 939791829 /nfs/dbraw/zinc/79/18/29/939791829.db2.gz BVWIPRWIDXBIQW-KRWDZBQOSA-N 2 0 412.497 4.074 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000542306988 939793119 /nfs/dbraw/zinc/79/31/19/939793119.db2.gz LQAOGQMVRWHJIV-JTSKRJEESA-N 2 0 413.928 4.151 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000542473146 939828933 /nfs/dbraw/zinc/82/89/33/939828933.db2.gz TUAKBBGVBGLYQR-FQEVSTJZSA-N 2 0 410.558 4.465 20 0 HIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCCc2nc(-c3ccc(F)cc3)no2)CC1 ZINC000542483609 939831308 /nfs/dbraw/zinc/83/13/08/939831308.db2.gz QSEAAGXLYMPENH-UWJYYQICSA-N 2 0 400.542 4.441 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000542847226 939862634 /nfs/dbraw/zinc/86/26/34/939862634.db2.gz OPYQYGZEHSIJQQ-SIKLNZKXSA-N 2 0 400.950 4.300 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cnn1-c1ccc(F)cc1 ZINC000542849010 939862774 /nfs/dbraw/zinc/86/27/74/939862774.db2.gz JALHYIHVIODYEX-KOSHJBKYSA-N 2 0 422.548 4.127 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)Cc2ccn(C(C)C)n2)CC1 ZINC000543075847 939927391 /nfs/dbraw/zinc/92/73/91/939927391.db2.gz RDWYBDXNGPSBKA-RTBURBONSA-N 2 0 401.574 4.027 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000543408216 940055171 /nfs/dbraw/zinc/05/51/71/940055171.db2.gz AHEFAPUYOAMNOB-UXHICEINSA-N 2 0 410.558 4.464 20 0 HIADRP CC1(C(=O)Nc2cccc(C[NH+]3CCSCC3)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000543432106 940062855 /nfs/dbraw/zinc/06/28/55/940062855.db2.gz CHZAWWHWQNINCM-UHFFFAOYSA-N 2 0 423.626 4.476 20 0 HIADRP C[C@@H]1[NH+](Cc2ccccc2C[N@@H+]2CCC3(CCOCC3)[C@@H]2C)CCC12CCOCC2 ZINC000543575682 940116336 /nfs/dbraw/zinc/11/63/36/940116336.db2.gz ZMSMYYIDCIHFLX-VXKWHMMOSA-N 2 0 412.618 4.469 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(OC(F)F)cc1 ZINC000543775248 940182529 /nfs/dbraw/zinc/18/25/29/940182529.db2.gz JJWOAWHNGKARFO-IFMALSPDSA-N 2 0 404.501 4.486 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2ccc(NC(C)=O)cc2)CC1 ZINC000543776660 940183695 /nfs/dbraw/zinc/18/36/95/940183695.db2.gz ZQGXMIFHYJOHDD-QZTJIDSGSA-N 2 0 412.553 4.338 20 0 HIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000543998488 940291399 /nfs/dbraw/zinc/29/13/99/940291399.db2.gz LRSMYSQYOJSIPK-UONOGXRCSA-N 2 0 405.892 4.397 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3c(Br)cccc32)CC1 ZINC000544043700 940308412 /nfs/dbraw/zinc/30/84/12/940308412.db2.gz ODUFIXLBYAFLKM-NJDAHSKKSA-N 2 0 407.396 4.184 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CCC[C@@H]2C[NH+]2CCCCC2)c1 ZINC000544236577 940363983 /nfs/dbraw/zinc/36/39/83/940363983.db2.gz VPWQPOPFDAUXKU-RUZDIDTESA-N 2 0 405.586 4.409 20 0 HIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ncc(Br)cc2Br)C1 ZINC000544407137 940415299 /nfs/dbraw/zinc/41/52/99/940415299.db2.gz MMQJUYOXJKEFFX-ZDUSSCGKSA-N 2 0 419.205 4.208 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+][C@@H]2CCO[C@H](c3ccc(F)cc3)C2)CC1 ZINC000544596899 940487061 /nfs/dbraw/zinc/48/70/61/940487061.db2.gz ZKWQWQPQLOWAPL-NOZRDPDXSA-N 2 0 411.565 4.368 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+][C@H]2CCO[C@@H](c3ccc(F)cc3)C2)CC1 ZINC000544596900 940487087 /nfs/dbraw/zinc/48/70/87/940487087.db2.gz ZKWQWQPQLOWAPL-UKILVPOCSA-N 2 0 411.565 4.368 20 0 HIADRP CC(C)C[C@H](CNC(=O)N(C)[C@@H](C)C1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000544650516 940498365 /nfs/dbraw/zinc/49/83/65/940498365.db2.gz PBVICVUCJGAXKF-SXWKCWPCSA-N 2 0 402.627 4.124 20 0 HIADRP C[C@H]([NH2+]Cc1cc(Cl)ccc1N1CCOCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547393207 941060388 /nfs/dbraw/zinc/06/03/88/941060388.db2.gz FMFLBEJMIKSLLS-PZJWPPBQSA-N 2 0 413.993 4.177 20 0 HIADRP C[C@@H]([NH2+]Cc1cc(Cl)ccc1N1CCOCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547393205 941060411 /nfs/dbraw/zinc/06/04/11/941060411.db2.gz FMFLBEJMIKSLLS-CTNGQTDRSA-N 2 0 413.993 4.177 20 0 HIADRP C[C@H]([NH2+]Cc1cc(Cl)ccc1N1CCOCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547393206 941060450 /nfs/dbraw/zinc/06/04/50/941060450.db2.gz FMFLBEJMIKSLLS-FPOVZHCZSA-N 2 0 413.993 4.177 20 0 HIADRP C[C@H]([NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547504801 941066079 /nfs/dbraw/zinc/06/60/79/941066079.db2.gz JUUROCZHWKTYEX-SIKLNZKXSA-N 2 0 413.556 4.429 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1cccc(Cl)c1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547827715 941077310 /nfs/dbraw/zinc/07/73/10/941077310.db2.gz XCGNEORNQOMSFL-YTQUADARSA-N 2 0 423.384 4.233 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547827977 941077338 /nfs/dbraw/zinc/07/73/38/941077338.db2.gz VSSPQUKBCVZYRV-HYBUGGRVSA-N 2 0 414.553 4.334 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1cccc(Cl)c1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547827703 941077413 /nfs/dbraw/zinc/07/74/13/941077413.db2.gz XCGNEORNQOMSFL-QXAKKESOSA-N 2 0 423.384 4.233 20 0 HIADRP C[C@H]([NH2+]C[C@H](CO)Cc1ccc(C(F)(F)F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548154131 941089444 /nfs/dbraw/zinc/08/94/44/941089444.db2.gz FDLVCFMFHADPDV-BWAGFHJFSA-N 2 0 420.519 4.357 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)N[C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[NH+]3C)CC[N@@H+]1C ZINC000548970935 941136091 /nfs/dbraw/zinc/13/60/91/941136091.db2.gz KIWNMOQHKPYGQE-LKIWGRCWSA-N 2 0 419.013 4.036 20 0 HIADRP C[C@H](c1ccc(F)cc1)N1CC[C@H]([N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)C1=O ZINC000549536969 941198536 /nfs/dbraw/zinc/19/85/36/941198536.db2.gz PSUOUPOHQCKOEP-DVECYGJZSA-N 2 0 424.564 4.121 20 0 HIADRP CC(C)[N@@H+]1CCCC[C@H]1CSc1nnc(CN2CCCC2)n1Cc1ccccc1 ZINC000549618627 941201574 /nfs/dbraw/zinc/20/15/74/941201574.db2.gz RKOXXYJOCAZPEI-NRFANRHFSA-N 2 0 413.635 4.277 20 0 HIADRP COc1ccc(C[N@@H+](Cc2cn(-c3cc[nH+]cc3)nc2C)CC2CCC2)c(OC)c1 ZINC000549823595 941208627 /nfs/dbraw/zinc/20/86/27/941208627.db2.gz CVRHNOFBDPOJIN-UHFFFAOYSA-N 2 0 406.530 4.395 20 0 HIADRP COc1ccc2c(c1)C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CC2 ZINC000549868345 941220912 /nfs/dbraw/zinc/22/09/12/941220912.db2.gz UIVRFMBSICOAIK-RPBOFIJWSA-N 2 0 420.597 4.071 20 0 HIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000549877311 941224024 /nfs/dbraw/zinc/22/40/24/941224024.db2.gz ITLURZBKUVXJIT-HSZRJFAPSA-N 2 0 424.633 4.273 20 0 HIADRP COc1ccc2oc(C[NH2+]C[C@@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)cc2c1 ZINC000550262705 941305248 /nfs/dbraw/zinc/30/52/48/941305248.db2.gz ONSZNKJNRRVXJS-JOCHJYFZSA-N 2 0 420.553 4.460 20 0 HIADRP COc1cc(CC[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)ccc1Cl ZINC000550931596 941383293 /nfs/dbraw/zinc/38/32/93/941383293.db2.gz FMTUKZLKIFQMHT-FQEVSTJZSA-N 2 0 400.950 4.469 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC[C@H]1C[N@H+](Cc2ccccc2)CCCO1 ZINC000551397033 941469356 /nfs/dbraw/zinc/46/93/56/941469356.db2.gz YHHLXHGYSIICCN-PLXFJCCSSA-N 2 0 421.629 4.024 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC1 ZINC000552063947 941577258 /nfs/dbraw/zinc/57/72/58/941577258.db2.gz SMHZIJABNLRBDN-HBMCJLEFSA-N 2 0 412.496 4.394 20 0 HIADRP Cc1ccc(S(=O)(=O)C[C@@H](C)[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000552066523 941578554 /nfs/dbraw/zinc/57/85/54/941578554.db2.gz MGIGYGCUPIQAJS-RDABAPPSSA-N 2 0 414.615 4.190 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccccc2C[NH+]2CCC[C@H]2CO)CC1 ZINC000552280268 941621672 /nfs/dbraw/zinc/62/16/72/941621672.db2.gz AXQNLYUIVCJJPZ-RCSZBHJWSA-N 3 0 421.629 4.176 20 0 HIADRP C[C@H]([NH2+]CC(=O)NC1CC[NH+](C2CC2)CC1)c1ccccc1-c1ccc(Cl)cc1 ZINC000552980244 941811657 /nfs/dbraw/zinc/81/16/57/941811657.db2.gz RVZAJEZNFKROHH-KRWDZBQOSA-N 2 0 411.977 4.401 20 0 HIADRP CC[C@@H]([NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)c1ccc(Cl)cc1 ZINC000553231275 941853445 /nfs/dbraw/zinc/85/34/45/941853445.db2.gz BEPYRFKQSHJJJQ-HSZRJFAPSA-N 2 0 413.993 4.470 20 0 HIADRP COCCC[NH+]1CCC([NH2+][C@@H]2c3cc(Br)ccc3SC[C@@H]2C)CC1 ZINC000553293926 941862183 /nfs/dbraw/zinc/86/21/83/941862183.db2.gz QCROPVWMJZSKCW-LIRRHRJNSA-N 2 0 413.425 4.323 20 0 HIADRP C[NH+](C)C[C@H](NC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)c1ccc(F)cc1 ZINC000554167361 942054618 /nfs/dbraw/zinc/05/46/18/942054618.db2.gz CSHJRQUIGNLTEY-QHCPKHFHSA-N 2 0 412.553 4.279 20 0 HIADRP Fc1ccc(/C=C\C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c(F)c1 ZINC000555612620 942668859 /nfs/dbraw/zinc/66/88/59/942668859.db2.gz WLOMNVXEKIWVSQ-FDQBOKQBSA-N 2 0 412.524 4.496 20 0 HIADRP Fc1ccc(/C=C/C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c(F)c1 ZINC000555612623 942669296 /nfs/dbraw/zinc/66/92/96/942669296.db2.gz WLOMNVXEKIWVSQ-ZMTJCJBESA-N 2 0 412.524 4.496 20 0 HIADRP CN1CC[C@@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000556057912 942798541 /nfs/dbraw/zinc/79/85/41/942798541.db2.gz YMWNGEZPXVDLCB-AOYPEHQESA-N 3 0 406.618 4.014 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCc2sc(Br)cc21 ZINC000556169810 942814138 /nfs/dbraw/zinc/81/41/38/942814138.db2.gz FVQIRPVQUNYBMU-SJLPKXTDSA-N 2 0 421.404 4.244 20 0 HIADRP COc1ccc2c(c1F)CC[C@@H]2[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230709 942822939 /nfs/dbraw/zinc/82/29/39/942822939.db2.gz AGKPVHGSUWZUQT-REWPJTCUSA-N 2 0 424.560 4.340 20 0 HIADRP Cc1cc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)no1 ZINC000556236592 942824239 /nfs/dbraw/zinc/82/42/39/942824239.db2.gz SJDHDNVEQRZAKZ-QGZVFWFLSA-N 2 0 410.484 4.255 20 0 HIADRP CCOc1ccccc1NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000556244656 942825625 /nfs/dbraw/zinc/82/56/25/942825625.db2.gz GQDOXARLDGTTMS-FQEVSTJZSA-N 2 0 409.574 4.434 20 0 HIADRP C[C@H](C[NH2+][C@@H](c1sccc1Br)C1CCCCC1)N1CC[NH+](C)CC1 ZINC000556584293 942906332 /nfs/dbraw/zinc/90/63/32/942906332.db2.gz UCCUCUJVQDBUKU-CRAIPNDOSA-N 2 0 414.457 4.358 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](CCC(=O)Nc2ccccc2C(=O)c2ccccc2)CC1 ZINC000556800924 942934132 /nfs/dbraw/zinc/93/41/32/942934132.db2.gz WQIUCZNLGQMLTI-UHFFFAOYSA-N 2 0 421.585 4.298 20 0 HIADRP CCOc1ccccc1[C@@H](CC)[NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000557494526 943167803 /nfs/dbraw/zinc/16/78/03/943167803.db2.gz LDSHXJCPJUUJLH-XMMPIXPASA-N 2 0 423.601 4.215 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]CCc1c[nH]c2cccc(Br)c12 ZINC000557528456 943192451 /nfs/dbraw/zinc/19/24/51/943192451.db2.gz CGBYATYMNPCDQL-UHFFFAOYSA-N 2 0 410.319 4.152 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(-c4c(F)cccc4F)o3)CC2)CC1 ZINC000558447110 943561084 /nfs/dbraw/zinc/56/10/84/943561084.db2.gz COIOEZJQVXTQLP-UHFFFAOYSA-N 2 0 403.517 4.074 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1ccc(Cl)cc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000558482674 943571126 /nfs/dbraw/zinc/57/11/26/943571126.db2.gz ZMOLJYHXGDIOJT-XKGZKEIXSA-N 2 0 423.384 4.233 20 0 HIADRP C[NH+](C)CCOc1cccc(NC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000558742278 943637541 /nfs/dbraw/zinc/63/75/41/943637541.db2.gz LLDGWNLSADGOPA-HSZRJFAPSA-N 2 0 424.589 4.049 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CNC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000558893289 943724880 /nfs/dbraw/zinc/72/48/80/943724880.db2.gz XUZRSARVIZDZSI-UAHLEYORSA-N 2 0 419.013 4.037 20 0 HIADRP C[C@@H](c1ccc(F)cc1)N1CC[C@@H]([NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1=O ZINC000559071607 943824126 /nfs/dbraw/zinc/82/41/26/943824126.db2.gz UOZGGDXJRDSUNM-NBGIEHNGSA-N 2 0 423.576 4.332 20 0 HIADRP C[C@@H](c1ccc(F)cc1)N1CC[C@H]([NH+]2CCC(CCC[NH+]3CCCC3)CC2)C1=O ZINC000559145598 943853500 /nfs/dbraw/zinc/85/35/00/943853500.db2.gz MVHOYFOEMIFVEY-CVDCTZTESA-N 2 0 401.570 4.076 20 0 HIADRP COc1cccc2c1CC[C@@H]2[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000559892323 944078098 /nfs/dbraw/zinc/07/80/98/944078098.db2.gz ICGREYYMYZHYPB-URXFXBBRSA-N 2 0 406.570 4.201 20 0 HIADRP CCOC(=O)[C@H]1CC[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000560266726 944211844 /nfs/dbraw/zinc/21/18/44/944211844.db2.gz PUKYZIUFDYUZAN-LOSJGSFVSA-N 2 0 422.569 4.431 20 0 HIADRP C[S@](=O)Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000560558435 944254752 /nfs/dbraw/zinc/25/47/52/944254752.db2.gz QNVLAYIGXPPGLC-RTAAPDIRSA-N 2 0 410.627 4.346 20 0 HIADRP CCC[C@@H](NC(=O)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000560822720 944345795 /nfs/dbraw/zinc/34/57/95/944345795.db2.gz FWKPHBBIWACZGT-XMMPIXPASA-N 2 0 408.590 4.278 20 0 HIADRP CC(C)C[C@@H]([NH2+]CC(=O)NC1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000561126225 944467863 /nfs/dbraw/zinc/46/78/63/944467863.db2.gz RLQLUSJPZAIWBG-HXUWFJFHSA-N 2 0 411.512 4.125 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]Cc1ccccc1Cn1ccnc1)c1ccccc1O2 ZINC000561224993 944518388 /nfs/dbraw/zinc/51/83/88/944518388.db2.gz VEWUUEGUSRRILT-HSZRJFAPSA-N 2 0 402.542 4.009 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000561297679 944543219 /nfs/dbraw/zinc/54/32/19/944543219.db2.gz HPIXHGAJVHNYTP-LEWJYISDSA-N 2 0 418.507 4.278 20 0 HIADRP C[C@@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000561502691 944639985 /nfs/dbraw/zinc/63/99/85/944639985.db2.gz SORSEMMPOMZLPR-YKSBVNFPSA-N 2 0 412.622 4.219 20 0 HIADRP CCC[N@H+](C)[C@@H](CNC(=O)NC1CC([NH+]2CCCCC2)C1)c1ccc(Cl)cc1 ZINC000561765832 944787308 /nfs/dbraw/zinc/78/73/08/944787308.db2.gz LOGFELNCJFWZBZ-CBNMVNINSA-N 2 0 407.002 4.039 20 0 HIADRP CCC[NH+](C)[C@@H](CNC(=O)N1CC[C@@H](C[N@@H+](C)CCC)C1)c1ccc(Cl)cc1 ZINC000561872227 944829757 /nfs/dbraw/zinc/82/97/57/944829757.db2.gz ZPEDLAYDJAOEHD-RXVVDRJESA-N 2 0 409.018 4.096 20 0 HIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccc(Oc5cnccn5)cc4)C[C@@H]3C2)cc1 ZINC000562214337 945023234 /nfs/dbraw/zinc/02/32/34/945023234.db2.gz PLYQFTHSJHDNLS-PKTZIBPZSA-N 2 0 400.526 4.223 20 0 HIADRP COc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)CC3 ZINC000564233943 945449522 /nfs/dbraw/zinc/44/95/22/945449522.db2.gz PVSYRMIHUQRSAY-IBGZPJMESA-N 2 0 419.569 4.297 20 0 HIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000564757571 945750999 /nfs/dbraw/zinc/75/09/99/945750999.db2.gz QTLFKRITOLORIR-XDJHFCHBSA-N 2 0 409.540 4.458 20 0 HIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000565379156 945819540 /nfs/dbraw/zinc/81/95/40/945819540.db2.gz WTEXCWAUGYJPQH-XUVXKRRUSA-N 2 0 400.485 4.394 20 0 HIADRP C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000565902775 945909590 /nfs/dbraw/zinc/90/95/90/945909590.db2.gz BINMQIKTSREGRY-WFRUXNIVSA-N 2 0 403.998 4.243 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H]1CC(C)(C)c2ccc(Br)cc21 ZINC000565918055 945920553 /nfs/dbraw/zinc/92/05/53/945920553.db2.gz SVHKRPWCVQAQKF-LJQANCHMSA-N 2 0 418.379 4.297 20 0 HIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000569158489 946827416 /nfs/dbraw/zinc/82/74/16/946827416.db2.gz MULMCENKEZAAAB-XGHSKXIFSA-N 2 0 415.528 4.270 20 0 HIADRP CC(C)(C)[C@@H](CN1CCc2ccccc2C1)[NH2+]C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000569711681 946952652 /nfs/dbraw/zinc/95/26/52/946952652.db2.gz KGGDURHGKGMCQZ-SQJMNOBHSA-N 2 0 419.613 4.211 20 0 HIADRP O[C@@H](C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)COc1cccc2ccccc21 ZINC000571152432 947529778 /nfs/dbraw/zinc/52/97/78/947529778.db2.gz LGOURMJZEGTEEV-DEOSSOPVSA-N 2 0 404.554 4.355 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000571322580 947593367 /nfs/dbraw/zinc/59/33/67/947593367.db2.gz MWSUYEIMKXTSJA-IBGZPJMESA-N 2 0 409.452 4.088 20 0 HIADRP COc1ncc([C@@H](C)[NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)cc1Cl ZINC000572742324 947997931 /nfs/dbraw/zinc/99/79/31/947997931.db2.gz KDUUKPBRCSFDTN-QGZVFWFLSA-N 2 0 403.954 4.112 20 0 HIADRP COCCOCc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000573248564 948123006 /nfs/dbraw/zinc/12/30/06/948123006.db2.gz YEJSWTRNEGFJTQ-UHFFFAOYSA-N 2 0 408.586 4.338 20 0 HIADRP CN1CC[C@@H]([NH2+]CCCCC[NH2+][C@H]2CCN(C)[C@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000574945315 948561956 /nfs/dbraw/zinc/56/19/56/948561956.db2.gz BKQZDQKIIBDBIX-XUJYPJAKSA-N 2 0 420.645 4.227 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c2ccccc2C1 ZINC000575031743 948578136 /nfs/dbraw/zinc/57/81/36/948578136.db2.gz WICHTXXKIJNVDY-BVAGGSTKSA-N 2 0 405.586 4.372 20 0 HIADRP COC[C@H]1CC2(C[N@@H+]1Cc1ccccn1)CCN(c1[nH+]c(C)cc3ccccc31)CC2 ZINC001164713607 720128964 /nfs/dbraw/zinc/12/89/64/720128964.db2.gz STJGAKQUBKWEFV-HSZRJFAPSA-N 2 0 416.569 4.446 20 0 HIADRP COc1ccc([C@H](CNC(=O)C[N@@H+]2CCC[C@@H]2c2ccccc2)[NH+]2CCCCC2)cc1 ZINC000022549356 846585806 /nfs/dbraw/zinc/58/58/06/846585806.db2.gz SMQCZVHIRFGYEW-RPBOFIJWSA-N 2 0 421.585 4.176 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C(=O)Nc1cccc2ncccc21 ZINC000026985290 847230876 /nfs/dbraw/zinc/23/08/76/847230876.db2.gz LWAXTNDXXKPNLE-IBGZPJMESA-N 2 0 402.542 4.338 20 0 HIADRP COc1cc(C[NH2+]Cc2cccc(C[NH+](C)C)c2)ccc1OCc1c(C)noc1C ZINC000027219637 847268912 /nfs/dbraw/zinc/26/89/12/847268912.db2.gz NOEVHJGWLPOWFR-UHFFFAOYSA-N 2 0 409.530 4.230 20 0 HIADRP COc1cccc([C@H](CNC(=O)c2ccc(C[NH+]3CCCCC3)cc2)[NH+]2CCCC2)c1 ZINC000027341974 847286514 /nfs/dbraw/zinc/28/65/14/847286514.db2.gz XICYPNZBQRMRLO-VWLOTQADSA-N 2 0 421.585 4.248 20 0 HIADRP Cc1cc(O)c(C(C)C)cc1C(=O)N(C)[C@@H]1CCCC[C@H]1[N@H+](C)C1CCN(C)CC1 ZINC000436632175 861875927 /nfs/dbraw/zinc/87/59/27/861875927.db2.gz VRUNLBBZKKBJMD-DHIUTWEWSA-N 2 0 415.622 4.233 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)c1 ZINC000044277409 848539223 /nfs/dbraw/zinc/53/92/23/848539223.db2.gz BJVMZCIWNFFTLT-UHFFFAOYSA-N 2 0 400.954 4.188 20 0 HIADRP COc1ccc([C@@H](CNC(=O)Nc2cccc(C[NH+](C)C)c2)[NH+]2CCCCC2)cc1 ZINC000044293539 848540299 /nfs/dbraw/zinc/54/02/99/848540299.db2.gz LXSGLLYAWRLVQU-HSZRJFAPSA-N 2 0 410.562 4.106 20 0 HIADRP CCOc1c(Br)cc(C[NH2+]CC2CC[NH+](C)CC2)cc1Br ZINC000044516499 848564479 /nfs/dbraw/zinc/56/44/79/848564479.db2.gz UXAQEYNQRDXJRI-UHFFFAOYSA-N 2 0 420.189 4.042 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)N3CCC([NH+]4CCCCC4)CC3)cc2)CC1 ZINC000045777241 848726644 /nfs/dbraw/zinc/72/66/44/848726644.db2.gz HXKUOLUYHMLQMB-UHFFFAOYSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2cc(Cl)c3c(c2)OCCO3)C[C@H](C)O1 ZINC000048816700 849270759 /nfs/dbraw/zinc/27/07/59/849270759.db2.gz CFLUMCQGISLKMW-CALCHBBNSA-N 2 0 416.949 4.010 20 0 HIADRP Cc1ccc([C@H](OC[C@@H](O)C[NH+]2CCC(CC[NH+](C)C)CC2)c2ccccc2)cc1 ZINC000056523036 850382546 /nfs/dbraw/zinc/38/25/46/850382546.db2.gz PFTXPUBFPCYMBV-IZZNHLLZSA-N 2 0 410.602 4.126 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)c1ccsc1 ZINC000056764256 850472331 /nfs/dbraw/zinc/47/23/31/850472331.db2.gz HCEONPRKKPHWKW-NRFANRHFSA-N 2 0 400.592 4.201 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000060954478 851257542 /nfs/dbraw/zinc/25/75/42/851257542.db2.gz FZPBELJEJIDWEL-YKSBVNFPSA-N 2 0 408.590 4.163 20 0 HIADRP C[C@H](CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)[N@@H+]1CCCC[C@@H]1C ZINC000061722250 851425782 /nfs/dbraw/zinc/42/57/82/851425782.db2.gz ASFAHOQZGYVSMZ-LEWJYISDSA-N 2 0 422.617 4.477 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)NCc3cccc(C[NH+](C)C)c3)cc2)C1 ZINC000061928227 851473384 /nfs/dbraw/zinc/47/33/84/851473384.db2.gz GINMCOZCNVXCKJ-SFTDATJTSA-N 2 0 422.617 4.226 20 0 HIADRP FC(F)(F)CN1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000437071735 862268234 /nfs/dbraw/zinc/26/82/34/862268234.db2.gz IMLCHUXXXYFHOS-YPAWHYETSA-N 2 0 409.540 4.151 20 0 HIADRP O[C@@H](COc1cccc(C(F)(F)F)c1)C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000063500420 851704475 /nfs/dbraw/zinc/70/44/75/851704475.db2.gz ZUDPGKLBFYMFHC-HXUWFJFHSA-N 2 0 414.512 4.033 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc(Br)c2c(c1)OCCCO2 ZINC000065931912 852322150 /nfs/dbraw/zinc/32/21/50/852322150.db2.gz LGOZELAUUTZEML-INIZCTEOSA-N 2 0 411.384 4.355 20 0 HIADRP O=C(NC1CC[NH+](CC2CCCCC2)CC1)NC1CC[NH+](CC2CCCCC2)CC1 ZINC000065985763 852341490 /nfs/dbraw/zinc/34/14/90/852341490.db2.gz VPWWLOZXGIEMQF-UHFFFAOYSA-N 2 0 418.670 4.375 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)CC1 ZINC000071922968 852431031 /nfs/dbraw/zinc/43/10/31/852431031.db2.gz IAIOOLSKXXPUAJ-QHCPKHFHSA-N 2 0 424.589 4.079 20 0 HIADRP c1c(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000097474494 852615852 /nfs/dbraw/zinc/61/58/52/852615852.db2.gz VQXXHXVIRRQTKE-UHFFFAOYSA-N 2 0 416.569 4.084 20 0 HIADRP c1ccc(C(OCC[NH+]2CCN(CCC[NH+]3CCCCC3)CC2)c2ccccc2)cc1 ZINC000214990873 853831813 /nfs/dbraw/zinc/83/18/13/853831813.db2.gz YVCWEWHFEPVTCZ-UHFFFAOYSA-N 2 0 421.629 4.286 20 0 HIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000236621680 853904013 /nfs/dbraw/zinc/90/40/13/853904013.db2.gz AYTLTTDEQFPXFF-QFIPXVFZSA-N 2 0 403.574 4.203 20 0 HIADRP CC(C)CC(=O)Nc1cccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000236653659 853908496 /nfs/dbraw/zinc/90/84/96/853908496.db2.gz WGOZKTJOOIQBGS-UHFFFAOYSA-N 2 0 422.617 4.491 20 0 HIADRP c1oc(-c2ccccc2)nc1C[NH2+]CCCC[NH+]1CCN(Cc2ccccc2)CC1 ZINC000236698947 853913398 /nfs/dbraw/zinc/91/33/98/853913398.db2.gz CURVHSZQPUHUPW-UHFFFAOYSA-N 2 0 404.558 4.029 20 0 HIADRP CCCOc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1OC ZINC000236948962 853941152 /nfs/dbraw/zinc/94/11/52/853941152.db2.gz SXTVEVFYOVVMBL-WOJBJXKFSA-N 2 0 412.574 4.383 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2ccc(-c3ccc(Br)cc3)s2)CC1 ZINC000236977202 853945255 /nfs/dbraw/zinc/94/52/55/853945255.db2.gz PCJZNJLEMIPURJ-MRXNPFEDSA-N 2 0 422.436 4.293 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2ccccc2C(F)(F)F)c1)C1CCOCC1 ZINC000237203662 853981073 /nfs/dbraw/zinc/98/10/73/853981073.db2.gz XJRFCCUNGCQQOA-UHFFFAOYSA-N 2 0 422.491 4.485 20 0 HIADRP COc1cc(Br)cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1O ZINC000237216660 853984156 /nfs/dbraw/zinc/98/41/56/853984156.db2.gz KAHNZFMETYVYRP-UHFFFAOYSA-N 2 0 407.352 4.293 20 0 HIADRP COc1ccc(C[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)cc1Cl ZINC000237264184 853992795 /nfs/dbraw/zinc/99/27/95/853992795.db2.gz BVHOEMRNBVNKKS-UHFFFAOYSA-N 2 0 418.965 4.128 20 0 HIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000237403755 854024679 /nfs/dbraw/zinc/02/46/79/854024679.db2.gz CKMWQFZRULJCCB-IAGOWNOFSA-N 2 0 404.986 4.122 20 0 HIADRP C[C@H](C[NH2+]Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)N1CC[NH+](C)CC1 ZINC000237576233 854057434 /nfs/dbraw/zinc/05/74/34/854057434.db2.gz HPAXCNWKDGERCM-QGZVFWFLSA-N 2 0 422.400 4.298 20 0 HIADRP C[C@H](C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccnc1)C[NH+]1CCCCC1 ZINC000237587896 854059188 /nfs/dbraw/zinc/05/91/88/854059188.db2.gz XIWVLZJZKVNBKI-OAQYLSRUSA-N 2 0 403.574 4.205 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cccc(-c4ccccc4)c3)c2)C1 ZINC000237924288 854120094 /nfs/dbraw/zinc/12/00/94/854120094.db2.gz FVGHMDDOCVFZHT-AREMUKBSSA-N 2 0 413.565 4.341 20 0 HIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000251673415 854200282 /nfs/dbraw/zinc/20/02/82/854200282.db2.gz LTINTSUNAQJXEK-BRWVUGGUSA-N 2 0 400.485 4.467 20 0 HIADRP Cc1[nH+]c2ccccc2c(NCc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c1C ZINC000302084254 854528527 /nfs/dbraw/zinc/52/85/27/854528527.db2.gz MTJKHYIUHWHZAC-NRFANRHFSA-N 2 0 402.542 4.161 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC000303135682 854778605 /nfs/dbraw/zinc/77/86/05/854778605.db2.gz AEGPQJCJMFTYSE-DEOSSOPVSA-N 2 0 414.638 4.182 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1)c1ccccc1 ZINC000303178926 854803720 /nfs/dbraw/zinc/80/37/20/854803720.db2.gz COVQNFFGMGNGBX-HSZRJFAPSA-N 2 0 411.615 4.300 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)CC(C)C ZINC000303452909 854952415 /nfs/dbraw/zinc/95/24/15/854952415.db2.gz JAWYSGFHDOWHMS-UCBGAZFYSA-N 2 0 414.638 4.238 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[NH+](C)C)cc1 ZINC000303500472 854988994 /nfs/dbraw/zinc/98/89/94/854988994.db2.gz UXCRNXRZCQORFZ-AAZCMCCISA-N 2 0 420.601 4.093 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NC2CC[NH+]([C@H](C)c3ccccc3)CC2)[NH+]2CCCC2)o1 ZINC000303623611 855083676 /nfs/dbraw/zinc/08/36/76/855083676.db2.gz DOUCMQVIJGALDX-OFNKIYASSA-N 2 0 424.589 4.250 20 0 HIADRP CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]([NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC000309674719 855363311 /nfs/dbraw/zinc/36/33/11/855363311.db2.gz VUBHEALTJFETLG-ZFGGDYGUSA-N 2 0 401.595 4.324 20 0 HIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381878470 855432638 /nfs/dbraw/zinc/43/26/38/855432638.db2.gz NVHSSGIKOSMSSM-PFPLVKHPSA-N 2 0 413.606 4.417 20 0 HIADRP COc1cc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc(Br)c1O ZINC000388633294 855447788 /nfs/dbraw/zinc/44/77/88/855447788.db2.gz ILIXMUBFQZOFQF-QAPCUYQASA-N 2 0 419.363 4.164 20 0 HIADRP CC(C)(C)OC(=O)N1CCC[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000397493415 855471921 /nfs/dbraw/zinc/47/19/21/855471921.db2.gz BQIBQEPRFKZCSA-QFIPXVFZSA-N 2 0 401.595 4.278 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000410330805 855933195 /nfs/dbraw/zinc/93/31/95/855933195.db2.gz QCIREKNDIVPKPP-OYRHEFFESA-N 2 0 414.638 4.017 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)CC1 ZINC000410336068 855935135 /nfs/dbraw/zinc/93/51/35/855935135.db2.gz CDZXNUVRTINJHW-OAQYLSRUSA-N 2 0 414.638 4.324 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)NCc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)C1 ZINC000410337762 855936306 /nfs/dbraw/zinc/93/63/06/855936306.db2.gz PSCNBOBLAYSWRI-VXKWHMMOSA-N 2 0 414.638 4.372 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)Nc2cccc(OCC[NH+](C)C)c2)cc1 ZINC000410347505 855941416 /nfs/dbraw/zinc/94/14/16/855941416.db2.gz OMKRZTLWDKYQMG-FQEVSTJZSA-N 2 0 424.589 4.323 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)CC1 ZINC000410348513 855942461 /nfs/dbraw/zinc/94/24/61/855942461.db2.gz YDXBHKZEEIORQP-JOCHJYFZSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)C1 ZINC000410369055 855956398 /nfs/dbraw/zinc/95/63/98/855956398.db2.gz QXNQEGFIZCHAQQ-XMSQKQJNSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C[C@H](C)O1 ZINC000425960572 856018266 /nfs/dbraw/zinc/01/82/66/856018266.db2.gz XVCPTKCGMICMCD-SELNLUPBSA-N 2 0 401.982 4.498 20 0 HIADRP C[C@H]1CCN(C(=O)[C@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000437461966 862825296 /nfs/dbraw/zinc/82/52/96/862825296.db2.gz MFRQAUSGUFOXBS-URXFXBBRSA-N 2 0 423.576 4.161 20 0 HIADRP Cc1cc2c(cc1C)[C@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c1)CCS2 ZINC000427693752 856911657 /nfs/dbraw/zinc/91/16/57/856911657.db2.gz GTOHOGAYHCNSFD-FYYLOGMGSA-N 2 0 423.626 4.327 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)NCc2ccccc2C[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000428110198 857075018 /nfs/dbraw/zinc/07/50/18/857075018.db2.gz GAEJNLZKCGHPFH-PXDATVDWSA-N 2 0 420.601 4.135 20 0 HIADRP CN(C)C(=O)c1cccc(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000428229585 857119557 /nfs/dbraw/zinc/11/95/57/857119557.db2.gz OZGIDQPMDQTTNR-UODIDJSMSA-N 2 0 419.613 4.211 20 0 HIADRP CC(=O)Nc1ccc(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000428229369 857120174 /nfs/dbraw/zinc/12/01/74/857120174.db2.gz OPEJBCOQARVWNK-SKBVVQJISA-N 2 0 405.586 4.468 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@@H]([NH2+]C4CCN(c5ccccn5)CC4)[C@H]3C2)cc1 ZINC000428243439 857124255 /nfs/dbraw/zinc/12/42/55/857124255.db2.gz BTXPUQPNLDRGHG-ZKMPZPQNSA-N 2 0 404.602 4.331 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H]2c3cc(Br)ccc3CC2(C)C)CC1 ZINC000429287682 857592275 /nfs/dbraw/zinc/59/22/75/857592275.db2.gz AKVDEOAQYSIUGD-HXUWFJFHSA-N 2 0 408.428 4.078 20 0 HIADRP COc1ccccc1-c1ncc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cn1 ZINC000430241954 858094437 /nfs/dbraw/zinc/09/44/37/858094437.db2.gz RVRJLXXSUGDJAB-UHFFFAOYSA-N 2 0 416.569 4.496 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3coc(-c4ccc(F)cc4)n3)CC2)CC1 ZINC000430927563 858372523 /nfs/dbraw/zinc/37/25/23/858372523.db2.gz IUQIPVXMPIUKEA-UHFFFAOYSA-N 2 0 414.569 4.109 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000431039340 858413693 /nfs/dbraw/zinc/41/36/93/858413693.db2.gz HVPGMVZKWRAPME-DVECYGJZSA-N 2 0 400.526 4.030 20 0 HIADRP C[C@H]1C[C@H](NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000431039342 858413734 /nfs/dbraw/zinc/41/37/34/858413734.db2.gz HVPGMVZKWRAPME-YADARESESA-N 2 0 400.526 4.030 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)CC1 ZINC000431647956 858710818 /nfs/dbraw/zinc/71/08/18/858710818.db2.gz GTJDJQAAZOKDCD-UHFFFAOYSA-N 2 0 414.638 4.051 20 0 HIADRP CC[NH+](CC)Cc1cccc(NC(=O)c2cnn(CC[NH+](C)C)c2-c2ccccc2)c1 ZINC000431905234 858863677 /nfs/dbraw/zinc/86/36/77/858863677.db2.gz ZREMEJXBSLKNNT-UHFFFAOYSA-N 2 0 419.573 4.206 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NCc1ccccc1C[NH+](C)C)c1cccc(C(F)(F)F)c1 ZINC000467535938 881356835 /nfs/dbraw/zinc/35/68/35/881356835.db2.gz CATZMOXBGLPWGP-OAQYLSRUSA-N 2 0 421.507 4.466 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC1 ZINC000467548433 881370048 /nfs/dbraw/zinc/37/00/48/881370048.db2.gz ZORTZNHUTADTKS-LJQANCHMSA-N 2 0 400.526 4.203 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CC(c3cccc(Br)c3)C2)[C@H](C)C1 ZINC000432414985 859154311 /nfs/dbraw/zinc/15/43/11/859154311.db2.gz UMUJEDPNQGUDTF-XPVQEHEOSA-N 2 0 409.412 4.422 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3nc4ccc(F)cc4s3)CC2)CC1 ZINC000432732927 859325286 /nfs/dbraw/zinc/32/52/86/859325286.db2.gz XZWMOGOQJWEHIK-UHFFFAOYSA-N 2 0 404.599 4.064 20 0 HIADRP CCOc1ccccc1NC(=O)CC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433043215 859496048 /nfs/dbraw/zinc/49/60/48/859496048.db2.gz CFJBXHXLRSMWCR-UHFFFAOYSA-N 2 0 421.585 4.402 20 0 HIADRP C[C@@H](C(=O)c1c[nH]c2ncccc12)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433043476 859497380 /nfs/dbraw/zinc/49/73/80/859497380.db2.gz FDZYRISYXHAXMI-IBGZPJMESA-N 2 0 402.542 4.122 20 0 HIADRP FC(F)(F)C(F)(F)COCC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433066877 859507462 /nfs/dbraw/zinc/50/74/62/859507462.db2.gz IUHZPOHWOGWCRQ-UHFFFAOYSA-N 2 0 406.439 4.189 20 0 HIADRP CN(c1ccccc1CNc1cccc2c1OCC[C@H]2[NH+](C)C)C1CC[NH+](C)CC1 ZINC000433180265 859558218 /nfs/dbraw/zinc/55/82/18/859558218.db2.gz XMPNITPQCIVSOK-XMMPIXPASA-N 2 0 408.590 4.214 20 0 HIADRP C[NH+](C)[C@H](CC(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccccc1 ZINC000433350475 859658940 /nfs/dbraw/zinc/65/89/40/859658940.db2.gz FSNNRBVSMSCDSF-HSZRJFAPSA-N 2 0 413.993 4.361 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)[C@H]2CCCC[NH+]2C2CCCC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000433368633 859661884 /nfs/dbraw/zinc/66/18/84/859661884.db2.gz UOEBDDXJKMSGDH-ZPMCFJSWSA-N 2 0 421.988 4.385 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cc2sc(C)nc2cc1Cl ZINC000435182518 860683375 /nfs/dbraw/zinc/68/33/75/860683375.db2.gz RPDBPSWLQFZLAI-OAHLLOKOSA-N 2 0 424.014 4.138 20 0 HIADRP CN(c1ccccc1)c1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cn1 ZINC000435789089 861061468 /nfs/dbraw/zinc/06/14/68/861061468.db2.gz DDFRZROSOOHUQT-UHFFFAOYSA-N 2 0 416.569 4.096 20 0 HIADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1OC ZINC000467856985 881706672 /nfs/dbraw/zinc/70/66/72/881706672.db2.gz UCHSKQQZWPQGIG-SJORKVTESA-N 2 0 401.526 4.007 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)[C@]1(C(F)(F)F)CC[N@H+](Cc2ccccc2)C1 ZINC000438563893 863997566 /nfs/dbraw/zinc/99/75/66/863997566.db2.gz PKMJMVVHEGYGJD-QFIPXVFZSA-N 2 0 419.491 4.184 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H](c2ccc(Br)s2)C2CC2)ccn1 ZINC000439138353 864571297 /nfs/dbraw/zinc/57/12/97/864571297.db2.gz VCDJAEBNRTWPEM-GOSISDBHSA-N 2 0 410.381 4.087 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](CC(C)C)[NH2+][C@H](C)c2ccccc2)C[C@H]1C ZINC000468025569 881859908 /nfs/dbraw/zinc/85/99/08/881859908.db2.gz IZUFQEQHUOIBMT-SCPDWHHUSA-N 2 0 402.627 4.266 20 0 HIADRP Cc1ccc([C@H](OC[C@@H](O)C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)c2ccccc2)cc1 ZINC000441365456 866434531 /nfs/dbraw/zinc/43/45/31/866434531.db2.gz PZLFIQCCZDJUHU-KKUQBAQOSA-N 2 0 410.602 4.268 20 0 HIADRP O[C@H](COc1ccc(-c2ccccc2)cc1)C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441408711 866482066 /nfs/dbraw/zinc/48/20/66/866482066.db2.gz XOEDILFAFKTFSF-GVUKDKGQSA-N 2 0 406.570 4.042 20 0 HIADRP O[C@@H](Cn1c2ccccc2c2ccccc21)C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441416133 866489622 /nfs/dbraw/zinc/48/96/22/866489622.db2.gz CHJGRLNCYFEIFT-ZILOHOTNSA-N 2 0 403.570 4.104 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1(C)C ZINC000442864812 867704392 /nfs/dbraw/zinc/70/43/92/867704392.db2.gz DOJPQOJXOHMDID-XMMPIXPASA-N 2 0 406.549 4.079 20 0 HIADRP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Br)cc1C(F)(F)F ZINC000442868651 867707129 /nfs/dbraw/zinc/70/71/29/867707129.db2.gz HGTAEGXYKRTVKA-CYBMUJFWSA-N 2 0 422.333 4.145 20 0 HIADRP C[C@@H](NC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)C(C)(C)C[NH+](C)C ZINC000443248862 867885685 /nfs/dbraw/zinc/88/56/85/867885685.db2.gz SAJKNZRRCCCAKP-LJQANCHMSA-N 2 0 410.606 4.191 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000443996038 868518421 /nfs/dbraw/zinc/51/84/21/868518421.db2.gz OWKHDWJZSSASPX-HSZRJFAPSA-N 2 0 406.501 4.474 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2cccc(C[NH+]3CCC(O)CC3)c2)cc1)C(C)C ZINC000444453176 868833710 /nfs/dbraw/zinc/83/37/10/868833710.db2.gz GZLKPWMCYPFHDF-UHFFFAOYSA-N 2 0 409.574 4.126 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2cccc(C[NH+]3CCC(O)CC3)c2)cc1 ZINC000444458023 868835686 /nfs/dbraw/zinc/83/56/86/868835686.db2.gz ZJAAXBYYSAKDLR-UHFFFAOYSA-N 2 0 409.574 4.128 20 0 HIADRP C[C@H](CC1CCOCC1)[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000468357105 882296199 /nfs/dbraw/zinc/29/61/99/882296199.db2.gz OVPNOLUMTYAGGC-JOCHJYFZSA-N 2 0 407.602 4.304 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000446562731 870474187 /nfs/dbraw/zinc/47/41/87/870474187.db2.gz CYPMXMCRQXNHFX-ILBGXUMGSA-N 2 0 420.601 4.309 20 0 HIADRP CCN(C(=O)Nc1ccccc1CC[NH+](C)C)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000446588197 870496181 /nfs/dbraw/zinc/49/61/81/870496181.db2.gz YGZUJPLAGAPEFX-OFNKIYASSA-N 2 0 408.590 4.480 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000446592097 870500948 /nfs/dbraw/zinc/50/09/48/870500948.db2.gz VOVNIXFCXWHJAZ-JOCHJYFZSA-N 2 0 414.981 4.403 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cc2ccccc2s1 ZINC000446819622 870734727 /nfs/dbraw/zinc/73/47/27/870734727.db2.gz YTQPARBWXVCPBP-LAUBAEHRSA-N 2 0 407.583 4.449 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(Br)cc1F ZINC000446881173 870802159 /nfs/dbraw/zinc/80/21/59/870802159.db2.gz NRHMNEBIMGAIMG-KBXCAEBGSA-N 2 0 407.327 4.006 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)N3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)c2)CC1 ZINC000448208188 872102767 /nfs/dbraw/zinc/10/27/67/872102767.db2.gz FQGIEXUQWKKFHO-NOZRDPDXSA-N 2 0 424.633 4.077 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](CNC(=O)N(C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000448474356 872458084 /nfs/dbraw/zinc/45/80/84/872458084.db2.gz VVVBKTISIVXQKB-QTJGBDASSA-N 2 0 414.638 4.049 20 0 HIADRP C[C@@H](C[NH2+]Cc1ccccc1Oc1ccc(F)cc1Cl)CN1CC[NH+](C)CC1 ZINC000461412479 874428926 /nfs/dbraw/zinc/42/89/26/874428926.db2.gz COQJWKBHAUSVPA-KRWDZBQOSA-N 2 0 405.945 4.245 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2C[C@H]3CC[NH+](Cc4ccccc4)C[C@@H]3C2)cc1)C1CC1 ZINC000461444505 874501226 /nfs/dbraw/zinc/50/12/26/874501226.db2.gz LJQVZUJUNIMDDS-JWQCQUIFSA-N 2 0 417.597 4.265 20 0 HIADRP C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N1CCC([NH+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000461999106 875120437 /nfs/dbraw/zinc/12/04/37/875120437.db2.gz BMSBLBCBWWZFEC-CALCHBBNSA-N 2 0 411.512 4.001 20 0 HIADRP CC[NH+]1CCN(c2ccc(NC(=O)[C@@H]3CCCC[N@@H+]3Cc3ccccc3)c(C)c2)CC1 ZINC000462046057 875157846 /nfs/dbraw/zinc/15/78/46/875157846.db2.gz RBMGHQATSHRIET-VWLOTQADSA-N 2 0 420.601 4.130 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000462748624 875817126 /nfs/dbraw/zinc/81/71/26/875817126.db2.gz DSJNESSKORAPHH-XMMPIXPASA-N 2 0 414.638 4.052 20 0 HIADRP C[NH+](C)CC1CCC([NH2+]Cc2cc(Br)cc(Br)c2N)CC1 ZINC000463234338 876290383 /nfs/dbraw/zinc/29/03/83/876290383.db2.gz SIPLAXZLWCOTMU-UHFFFAOYSA-N 2 0 419.205 4.004 20 0 HIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc(Br)cc(Br)c1N ZINC000463245163 876301465 /nfs/dbraw/zinc/30/14/65/876301465.db2.gz XNSDNVBGZOGMMX-GFCCVEGCSA-N 2 0 421.221 4.394 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1CCC(F)(F)F ZINC000465245197 878666929 /nfs/dbraw/zinc/66/69/29/878666929.db2.gz UNUPQKADBJTOKT-GOSISDBHSA-N 2 0 414.516 4.061 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1CCC(F)(F)F ZINC000465245198 878667080 /nfs/dbraw/zinc/66/70/80/878667080.db2.gz UNUPQKADBJTOKT-SFHVURJKSA-N 2 0 414.516 4.061 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NC[C@@H](c1cccs1)[NH+]1CCC(C)CC1)CC2 ZINC000465419067 878848862 /nfs/dbraw/zinc/84/88/62/878848862.db2.gz AICLKVOEBLPJCT-HKBOAZHASA-N 2 0 418.651 4.178 20 0 HIADRP C[N@H+](CCCNC(=O)NC[C@@H]1CCC[NH+](C)[C@@H]1c1cccs1)C1CCCCC1 ZINC000465541849 879003460 /nfs/dbraw/zinc/00/34/60/879003460.db2.gz MMPSRBABCYNGMW-RXVVDRJESA-N 2 0 406.640 4.085 20 0 HIADRP C[C@@H]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000465590277 879072004 /nfs/dbraw/zinc/07/20/04/879072004.db2.gz AMHSBAMOGASWSK-JOCHJYFZSA-N 2 0 420.601 4.088 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCC[NH+]1CCCC[C@H]1C ZINC000465602789 879091888 /nfs/dbraw/zinc/09/18/88/879091888.db2.gz PYJFKEHDKVAZCD-VWNXMTODSA-N 2 0 414.638 4.195 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000465723887 879299864 /nfs/dbraw/zinc/29/98/64/879299864.db2.gz RVGLZPGQPMHLOV-AUSIDOKSSA-N 2 0 400.611 4.075 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@H](C)c1cccc(Cl)c1Cl ZINC000465981048 879653014 /nfs/dbraw/zinc/65/30/14/879653014.db2.gz GEECFUXYAJJLJR-HZPDHXFCSA-N 2 0 415.409 4.112 20 0 HIADRP CCCN(C(=O)NC1C[C@H]2CCC[C@@H](C1)[NH+]2C)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000466166628 879868812 /nfs/dbraw/zinc/86/88/12/879868812.db2.gz NJYKIBMXIMVYQP-UCBGAZFYSA-N 2 0 412.622 4.088 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCC2)cc1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000503475007 912514224 /nfs/dbraw/zinc/51/42/24/912514224.db2.gz YOTYLSGKJFSRHV-XMMPIXPASA-N 2 0 412.622 4.080 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000466507553 880281833 /nfs/dbraw/zinc/28/18/33/880281833.db2.gz XDZGUJNIEOTSQM-OTPAQWSUSA-N 2 0 420.601 4.174 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)NCc3ccc(CC[NH+](C)C)cc3)cc2)C1 ZINC000466976238 880779002 /nfs/dbraw/zinc/77/90/02/880779002.db2.gz TZOZXTBTBSBLFN-NRFANRHFSA-N 2 0 422.617 4.022 20 0 HIADRP O=C(Nc1ccccc1)c1cccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1 ZINC000467212274 880942414 /nfs/dbraw/zinc/94/24/14/880942414.db2.gz VEDNKOYKHOSSCF-UHFFFAOYSA-N 2 0 407.558 4.016 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H]2CCc3cc(F)c(OC)cc32)CC1 ZINC000467349722 881104444 /nfs/dbraw/zinc/10/44/44/881104444.db2.gz YJRVLGLPEWIGGE-ZHRRBRCNSA-N 2 0 415.528 4.453 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)Nc2cccc3c2OCC[C@H]3[NH+](C)C)cc1 ZINC000469319067 883422567 /nfs/dbraw/zinc/42/25/67/883422567.db2.gz YTAOPQBJPKYJEF-JOCHJYFZSA-N 2 0 411.546 4.045 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N(CC[NH+](C)C)Cc1ccc(F)cc1)c1ccccc1 ZINC000503725048 912810356 /nfs/dbraw/zinc/81/03/56/912810356.db2.gz JUXUUEMADDAZIR-IBGZPJMESA-N 2 0 414.569 4.028 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@@H]([NH+]2CCCCC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000503723965 912810639 /nfs/dbraw/zinc/81/06/39/912810639.db2.gz HFVPURVVGLFEND-RBBKRZOGSA-N 2 0 400.611 4.166 20 0 HIADRP O[C@H](C(F)F)[C@H](Cc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000470253987 884591166 /nfs/dbraw/zinc/59/11/66/884591166.db2.gz GOKQWKWHABRRDQ-HVXWDBPDSA-N 2 0 400.513 4.009 20 0 HIADRP CC(C)[NH+](CCCNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)C(C)C ZINC000470464803 884859036 /nfs/dbraw/zinc/85/90/36/884859036.db2.gz FHHJNRRNUYTPSO-UHFFFAOYSA-N 2 0 409.018 4.113 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000471596429 886309193 /nfs/dbraw/zinc/30/91/93/886309193.db2.gz LKNHTTCWSMEPOV-LPHOPBHVSA-N 2 0 419.038 4.457 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2cccc(Br)c2)s1 ZINC000472148282 886947151 /nfs/dbraw/zinc/94/71/51/886947151.db2.gz YVQBVGDQEZTYMR-INIZCTEOSA-N 2 0 422.436 4.293 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000472498709 887367235 /nfs/dbraw/zinc/36/72/35/887367235.db2.gz LJWWIXCJFLBLKF-FGZHOGPDSA-N 2 0 419.613 4.171 20 0 HIADRP C[C@H]([NH2+][C@H]1CCC[C@H]1Cc1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000472601399 887472888 /nfs/dbraw/zinc/47/28/88/887472888.db2.gz YHNXQNWVLFYSJK-CVJWPJSTSA-N 2 0 419.613 4.157 20 0 HIADRP CCN(C(=O)NC1CC[NH+](C2CCCC2)CC1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473740205 888522364 /nfs/dbraw/zinc/52/23/64/888522364.db2.gz POPPFNSLYGMSCM-RDPSFJRHSA-N 2 0 412.622 4.260 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)C1CCC(F)(F)CC1 ZINC000474053503 888891813 /nfs/dbraw/zinc/89/18/13/888891813.db2.gz PFNMECJTEAZKNA-SFHVURJKSA-N 2 0 410.549 4.480 20 0 HIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000474468279 889332710 /nfs/dbraw/zinc/33/27/10/889332710.db2.gz JZPXLVQBIFSGMD-NHCUHLMSSA-N 2 0 404.558 4.080 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)C1CCOCC1 ZINC000474478514 889338967 /nfs/dbraw/zinc/33/89/67/889338967.db2.gz PNFOJACHNGQFJQ-GOSISDBHSA-N 2 0 413.528 4.012 20 0 HIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccccc1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000474610880 889475272 /nfs/dbraw/zinc/47/52/72/889475272.db2.gz DOIGNAAHUOKSEA-OYRHEFFESA-N 2 0 404.558 4.080 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](CCCCc3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000474932311 889791462 /nfs/dbraw/zinc/79/14/62/889791462.db2.gz JRKNQYYXFIIYAK-UHFFFAOYSA-N 2 0 411.556 4.378 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000475107736 889955414 /nfs/dbraw/zinc/95/54/14/889955414.db2.gz GOVVDASTRACYKM-UHFFFAOYSA-N 2 0 400.611 4.123 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000475109694 889959544 /nfs/dbraw/zinc/95/95/44/889959544.db2.gz AARHCMFOWTVDJU-SQJMNOBHSA-N 2 0 420.601 4.128 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000475139244 890006224 /nfs/dbraw/zinc/00/62/24/890006224.db2.gz OPYQYVVBCKPZRF-QHCPKHFHSA-N 2 0 400.611 4.166 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000475950852 890872279 /nfs/dbraw/zinc/87/22/79/890872279.db2.gz CCTGRESQMMRJHL-OAQYLSRUSA-N 2 0 418.626 4.190 20 0 HIADRP CN(C(=O)NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000475997678 890920944 /nfs/dbraw/zinc/92/09/44/890920944.db2.gz NFFXTNXOZSCGND-DEOSSOPVSA-N 2 0 412.622 4.090 20 0 HIADRP Cc1nc([C@@H](C)[NH+]2CCC(C[NH+]3CCOCC3)CC2)oc1-c1ccc(Cl)cc1 ZINC000477145728 892071155 /nfs/dbraw/zinc/07/11/55/892071155.db2.gz WTQXYNYXRVANET-QGZVFWFLSA-N 2 0 403.954 4.409 20 0 HIADRP CC[NH+](CC)CCN(CC(C)C)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000477322942 892289177 /nfs/dbraw/zinc/28/91/77/892289177.db2.gz XAAOLAGKVAPELV-CWAQXLGLSA-N 2 0 414.638 4.191 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000477615789 892714796 /nfs/dbraw/zinc/71/47/96/892714796.db2.gz ZYSWIPLLOYRGSZ-UNMCSNQZSA-N 2 0 416.610 4.103 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2cccc(C[NH+]3CCC(CO)CC3)c2)cc1)C(C)C ZINC000477746231 892840405 /nfs/dbraw/zinc/84/04/05/892840405.db2.gz UPEGBABMRFDJQC-UHFFFAOYSA-N 2 0 423.601 4.374 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)Nc2cccc(OCC[NH+](C)C)c2)CC1 ZINC000478245240 893413326 /nfs/dbraw/zinc/41/33/26/893413326.db2.gz AXNNGHIGYKAYHW-FQEVSTJZSA-N 2 0 416.610 4.135 20 0 HIADRP CC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479069482 894333186 /nfs/dbraw/zinc/33/31/86/894333186.db2.gz YOFVEENBXVUFHF-SUMWQHHRSA-N 2 0 422.333 4.145 20 0 HIADRP C[C@@H](C[NH2+][C@H](c1ccccc1)c1ccc(Br)cc1)CN1CC[NH+](C)CC1 ZINC000479269307 894542290 /nfs/dbraw/zinc/54/22/90/894542290.db2.gz KIPRULGLERJUSE-PGRDOPGGSA-N 2 0 416.407 4.012 20 0 HIADRP C[C@@H](C[NH2+][C@@H](c1ccccc1)c1ccc(Br)cc1)CN1CC[NH+](C)CC1 ZINC000479269305 894543121 /nfs/dbraw/zinc/54/31/21/894543121.db2.gz KIPRULGLERJUSE-AVRDEDQJSA-N 2 0 416.407 4.012 20 0 HIADRP C[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479276589 894552858 /nfs/dbraw/zinc/55/28/58/894552858.db2.gz XPPJUXUAKRCDHO-UONOGXRCSA-N 2 0 422.333 4.002 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H](c2ccc(Br)cc2F)C2CC2)ccn1 ZINC000479417564 894727624 /nfs/dbraw/zinc/72/76/24/894727624.db2.gz XEGUTTATNNXWBH-FQEVSTJZSA-N 2 0 422.342 4.165 20 0 HIADRP COc1cc([C@@H](C)[NH2+]C2CC(N3CCC(C(F)(F)F)CC3)C2)cc(OC)c1OC ZINC000479482174 894804651 /nfs/dbraw/zinc/80/46/51/894804651.db2.gz XOUUQDFBTGSVGK-NVPAJSRCSA-N 2 0 416.484 4.168 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NCCCCC[NH+]2CCCCC2)CC1 ZINC000479539055 894843112 /nfs/dbraw/zinc/84/31/12/894843112.db2.gz DCDQNNRJBQCPSL-QFIPXVFZSA-N 2 0 406.659 4.329 20 0 HIADRP CCS(=O)(=O)c1c(Cl)cccc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000479558789 894856446 /nfs/dbraw/zinc/85/64/46/894856446.db2.gz PCULNOPPPYNCTI-UHFFFAOYSA-N 2 0 421.006 4.135 20 0 HIADRP COc1cccc([C@H](CN[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)[NH+]2CCCC2)c1 ZINC000480083154 895440497 /nfs/dbraw/zinc/44/04/97/895440497.db2.gz ORJSVFMXUUPDLW-NYMACZPPSA-N 2 0 407.602 4.332 20 0 HIADRP COc1cc(F)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)cc1OC ZINC000480247238 895658627 /nfs/dbraw/zinc/65/86/27/895658627.db2.gz ZSQGOZCJWFTPQQ-KURKYZTESA-N 2 0 416.537 4.303 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480270266 895679146 /nfs/dbraw/zinc/67/91/46/895679146.db2.gz YSPOHEQQELIMSW-GOSISDBHSA-N 2 0 400.588 4.315 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cc(Br)c(Cl)s2)C1 ZINC000480284089 895688765 /nfs/dbraw/zinc/68/87/65/895688765.db2.gz MXJHKVANFSANCD-CQSZACIVSA-N 2 0 415.784 4.020 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc1 ZINC000480424417 895819659 /nfs/dbraw/zinc/81/96/59/895819659.db2.gz FGUMFXCLTNAWOY-LJQANCHMSA-N 2 0 415.603 4.285 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)N1CC[NH+](C)CC1 ZINC000480559802 895920082 /nfs/dbraw/zinc/92/00/82/895920082.db2.gz UFHGZOSWUWKFNL-PZJWPPBQSA-N 2 0 416.610 4.188 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480605295 895970123 /nfs/dbraw/zinc/97/01/23/895970123.db2.gz ZOWZDVKMCQFCKZ-MOPGFXCFSA-N 2 0 415.603 4.141 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(-c4cccc(F)c4F)o3)cn2)CC1 ZINC000480637922 896007117 /nfs/dbraw/zinc/00/71/17/896007117.db2.gz GJCOEPLWJMXRGN-UHFFFAOYSA-N 2 0 412.484 4.052 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)[C@H](c1ccccc1)N1CCOCC1 ZINC000480671145 896034561 /nfs/dbraw/zinc/03/45/61/896034561.db2.gz BBZPTHDAFZXVFA-GBXCKJPGSA-N 2 0 413.631 4.012 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)[C@@H](c1ccccc1)N1CCOCC1 ZINC000480671147 896034751 /nfs/dbraw/zinc/03/47/51/896034751.db2.gz BBZPTHDAFZXVFA-RDPSFJRHSA-N 2 0 413.631 4.012 20 0 HIADRP C[C@@H](Nc1cccc2c1CC[N@H+](CC(C)(C)O)C2)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000480671421 896035061 /nfs/dbraw/zinc/03/50/61/896035061.db2.gz MSZZPWYFVAPQLK-IFMALSPDSA-N 2 0 407.602 4.138 20 0 HIADRP Cc1ccccc1CN1CCC([NH2+][C@@H](C)[C@H](c2ccccc2)N2CCOCC2)CC1 ZINC000480687284 896049034 /nfs/dbraw/zinc/04/90/34/896049034.db2.gz PWAGSTYISOKRTL-BKMJKUGQSA-N 2 0 407.602 4.011 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCSc4ccc(Cl)cc43)cn2)CC1 ZINC000480692980 896054404 /nfs/dbraw/zinc/05/44/04/896054404.db2.gz HOMLDNFWBCUTGJ-LJQANCHMSA-N 2 0 402.995 4.204 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480693321 896056402 /nfs/dbraw/zinc/05/64/02/896056402.db2.gz BJBOUHQZZDKCEC-QZTJIDSGSA-N 2 0 410.562 4.323 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(-c4ccncc4)cc3)cn2)CC1 ZINC000480700892 896061710 /nfs/dbraw/zinc/06/17/10/896061710.db2.gz RRHHUFQCHXTFEH-HXUWFJFHSA-N 2 0 401.558 4.136 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(-c4ccncc4)cc3)cn2)CC1 ZINC000480700891 896062094 /nfs/dbraw/zinc/06/20/94/896062094.db2.gz RRHHUFQCHXTFEH-FQEVSTJZSA-N 2 0 401.558 4.136 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000480780475 896147086 /nfs/dbraw/zinc/14/70/86/896147086.db2.gz QNSMISLEGOUSNH-FQEVSTJZSA-N 2 0 416.610 4.334 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccccn2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480883094 896238635 /nfs/dbraw/zinc/23/86/35/896238635.db2.gz PMBCEJQJHXDVSS-IBGZPJMESA-N 2 0 418.541 4.125 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccccc1OC(F)(F)F ZINC000480894446 896250394 /nfs/dbraw/zinc/25/03/94/896250394.db2.gz DULWMSRNSBRMJG-QGZVFWFLSA-N 2 0 407.480 4.183 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000480904236 896258659 /nfs/dbraw/zinc/25/86/59/896258659.db2.gz FIKCEFFOAYEFJJ-GOSISDBHSA-N 2 0 421.614 4.112 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3cccc(Cl)c3)CCOCC2)[C@H](C)C1 ZINC000481053913 896375988 /nfs/dbraw/zinc/37/59/88/896375988.db2.gz QMZISANPASQLTL-KNQAVFIVSA-N 2 0 409.014 4.115 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCCOc3cc(Br)ccc32)c1 ZINC000481321008 896675064 /nfs/dbraw/zinc/67/50/64/896675064.db2.gz JACVEVQHSSLBRE-HXUWFJFHSA-N 2 0 419.363 4.393 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc(NS(=O)(=O)CC)cc2)c1 ZINC000481325942 896684024 /nfs/dbraw/zinc/68/40/24/896684024.db2.gz WOXMUUYLNDQNGA-GOSISDBHSA-N 2 0 403.592 4.141 20 0 HIADRP COc1ccc(C2(C[NH2+][C@@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C)CCOCC2)cc1 ZINC000481557088 896928463 /nfs/dbraw/zinc/92/84/63/896928463.db2.gz LCOQYFWKWPILBV-SQJMNOBHSA-N 2 0 408.586 4.244 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000481721616 897115785 /nfs/dbraw/zinc/11/57/85/897115785.db2.gz XYEZOGKJJUQZHM-IBGZPJMESA-N 3 0 401.620 4.251 20 0 HIADRP C[C@H]1C[C@@H](N(C)C(=O)NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000481776396 897160566 /nfs/dbraw/zinc/16/05/66/897160566.db2.gz IICAAANVCPFZKS-DHLKQENFSA-N 2 0 422.617 4.203 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482115154 897565686 /nfs/dbraw/zinc/56/56/86/897565686.db2.gz QCBSEZPFLGVUPR-IBGZPJMESA-N 2 0 418.541 4.125 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000482117417 897569728 /nfs/dbraw/zinc/56/97/28/897569728.db2.gz CYJYYAHZPXKLDC-IBGZPJMESA-N 2 0 418.541 4.125 20 0 HIADRP C[C@@H]([NH2+]C[C@@H]1CCCN(Cc2cccs2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000482122405 897576688 /nfs/dbraw/zinc/57/66/88/897576688.db2.gz NAJCKMKXDHVODB-UXHICEINSA-N 2 0 401.620 4.251 20 0 HIADRP Clc1cccc2c1SCC[C@@H]2[NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000482131459 897588999 /nfs/dbraw/zinc/58/89/99/897588999.db2.gz WRUVCUBDRGIBOQ-FQEVSTJZSA-N 2 0 402.995 4.074 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)c1 ZINC000482237687 897718181 /nfs/dbraw/zinc/71/81/81/897718181.db2.gz XDCUVTTZIDXNOY-IBGZPJMESA-N 2 0 406.357 4.062 20 0 HIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC1CC[NH+](CCN(C)C)CC1 ZINC000482347846 897858514 /nfs/dbraw/zinc/85/85/14/897858514.db2.gz DPCOLBNGCKPOHV-SFHVURJKSA-N 2 0 400.636 4.351 20 0 HIADRP Cc1cc2cc([C@H](C)[NH2+]CCCC[NH+]3CCN(c4ncccn4)CC3)oc2cc1C ZINC000482442321 898003050 /nfs/dbraw/zinc/00/30/50/898003050.db2.gz WGDBPWVQTSAXJM-FQEVSTJZSA-N 2 0 407.562 4.093 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C[C@H](C)CN1CC[NH+](C)CC1 ZINC000482450539 898015319 /nfs/dbraw/zinc/01/53/19/898015319.db2.gz QQGITUSMTYSJAF-HOTGVXAUSA-N 2 0 407.027 4.306 20 0 HIADRP OCC[NH+]1CCC(C[NH2+][C@H](CCSc2ccccc2)c2ccc(F)cc2)CC1 ZINC000482545900 898134885 /nfs/dbraw/zinc/13/48/85/898134885.db2.gz AGNYHJJRDBIBNC-HSZRJFAPSA-N 2 0 402.579 4.343 20 0 HIADRP COc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(OC)c1 ZINC000482551204 898142259 /nfs/dbraw/zinc/14/22/59/898142259.db2.gz QOSCVKHTIMUYMC-IAGOWNOFSA-N 2 0 401.526 4.007 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CCCN1CCC[N@H+](C)CC1 ZINC000482560136 898150733 /nfs/dbraw/zinc/15/07/33/898150733.db2.gz UAUQBGBMOPRYFX-INIZCTEOSA-N 2 0 407.027 4.450 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2ccc(OC)cc2OC)CC1 ZINC000482570413 898165754 /nfs/dbraw/zinc/16/57/54/898165754.db2.gz WNNIAMORQMADQT-QZTJIDSGSA-N 2 0 415.553 4.397 20 0 HIADRP C[C@H](C[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)N1CC[NH+](C)CC1 ZINC000482570441 898165846 /nfs/dbraw/zinc/16/58/46/898165846.db2.gz WUXUHQZKPXZDAI-CRAIPNDOSA-N 2 0 405.011 4.066 20 0 HIADRP Cc1ccc(C[NH+](C)C)cc1NC(=O)CCCC(=O)Nc1cc(C[NH+](C)C)ccc1C ZINC000482581143 898177387 /nfs/dbraw/zinc/17/73/87/898177387.db2.gz KSYOAZDZODGFSI-UHFFFAOYSA-N 2 0 424.589 4.174 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cc2c(s1)CCCC2 ZINC000482648950 898253248 /nfs/dbraw/zinc/25/32/48/898253248.db2.gz GOJQZFMSWBNHAR-UWJYYQICSA-N 2 0 411.615 4.175 20 0 HIADRP CC1(C(=O)NC2CC[NH+](CCc3ccccc3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000482855728 898465167 /nfs/dbraw/zinc/46/51/67/898465167.db2.gz IVJHKYYNMFODIH-UHFFFAOYSA-N 2 0 419.613 4.112 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000482890320 898507969 /nfs/dbraw/zinc/50/79/69/898507969.db2.gz VVLLHXXFJUAUGU-OALUTQOASA-N 2 0 403.567 4.153 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cccc(NS(C)(=O)=O)c1 ZINC000482944271 898568603 /nfs/dbraw/zinc/56/86/03/898568603.db2.gz HVXVASBXQISTFZ-IBGZPJMESA-N 2 0 415.603 4.285 20 0 HIADRP CC1(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000482949737 898578048 /nfs/dbraw/zinc/57/80/48/898578048.db2.gz RAYQNQQNGXDLJG-UHFFFAOYSA-N 2 0 405.586 4.201 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(F)c(Br)c2)[C@H](C)C1 ZINC000483123131 898809823 /nfs/dbraw/zinc/80/98/23/898809823.db2.gz DJARNAQPDZFGSF-CLCXKQKWSA-N 2 0 401.364 4.376 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2sc(-c3cccnc3)nc2C)[C@@H](C)C1 ZINC000483141196 898820554 /nfs/dbraw/zinc/82/05/54/898820554.db2.gz RVZDOTQBNBIINL-ZWOKBUDYSA-N 2 0 402.608 4.301 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(I)cc1 ZINC000483142495 898821412 /nfs/dbraw/zinc/82/14/12/898821412.db2.gz JGFQJLQLZAJFOC-CYBMUJFWSA-N 2 0 412.290 4.343 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)[C@H](C)C1 ZINC000483158052 898830309 /nfs/dbraw/zinc/83/03/09/898830309.db2.gz PRGVOYYZUFRRQH-UIAACRFSSA-N 2 0 400.485 4.299 20 0 HIADRP CCOc1ccc(-c2nc(CN3CC[C@@H]4[C@@H](CCC[N@@H+]4C)C3)cs2)cc1OC ZINC000483481710 899127471 /nfs/dbraw/zinc/12/74/71/899127471.db2.gz IQHOXHKUCSBPGP-PKOBYXMFSA-N 2 0 401.576 4.134 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)C[C@@H]1C ZINC000483698034 899354790 /nfs/dbraw/zinc/35/47/90/899354790.db2.gz GEZBPYXAMGJYBA-GBXCKJPGSA-N 2 0 414.638 4.465 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3CCCC[C@H]3C)cc2)C[C@@H]1C ZINC000483697258 899354967 /nfs/dbraw/zinc/35/49/67/899354967.db2.gz DZZCQXHWOBLYQO-QTEQDKRBSA-N 2 0 400.611 4.075 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)NC3CC[NH+](C4CCCC4)CC3)c2)CC1 ZINC000483726298 899385856 /nfs/dbraw/zinc/38/58/56/899385856.db2.gz MAPZHAFXDLYOCK-UHFFFAOYSA-N 2 0 412.622 4.125 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CCCN(C)[C@H]1c1cccs1)c1cccc(OCC[NH+](C)C)c1 ZINC000483728950 899389403 /nfs/dbraw/zinc/38/94/03/899389403.db2.gz PKKSEARZACGBHL-GREBRCKQSA-N 2 0 401.620 4.422 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccccc3Br)CC2)[C@H](C)C1 ZINC000484138685 899759219 /nfs/dbraw/zinc/75/92/19/899759219.db2.gz FEENLGLGEIOTJI-YLJYHZDGSA-N 2 0 409.412 4.207 20 0 HIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccc([S@@](C)=O)cc1 ZINC000484475684 899969444 /nfs/dbraw/zinc/96/94/44/899969444.db2.gz MPIGWNKQGVQEFH-ACSYHNTCSA-N 2 0 414.615 4.146 20 0 HIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000485008656 900358687 /nfs/dbraw/zinc/35/86/87/900358687.db2.gz MUJPOGBNIVLDFD-FQEVSTJZSA-N 2 0 419.569 4.481 20 0 HIADRP COc1cccc(NC(=O)CC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000485300785 900579056 /nfs/dbraw/zinc/57/90/56/900579056.db2.gz FRUOGLQTTBBIFU-ZJSXRUAMSA-N 2 0 407.558 4.010 20 0 HIADRP COc1ccccc1[C@H](C)N(C)C(=O)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000489635644 903510160 /nfs/dbraw/zinc/51/01/60/903510160.db2.gz QHOSNAIKGBVPLC-NRFANRHFSA-N 2 0 423.601 4.059 20 0 HIADRP CSc1cccc([C@@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2ccc(F)c(F)c2)c1 ZINC000490119561 903776543 /nfs/dbraw/zinc/77/65/43/903776543.db2.gz PPJIESUNQXVQLE-HSZRJFAPSA-N 2 0 419.585 4.392 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H](c3ccccc3)c3ccc(Cl)cc3)ccn2)CC1 ZINC000490139357 903787564 /nfs/dbraw/zinc/78/75/64/903787564.db2.gz ZXZPJWQATPDNRF-DEOSSOPVSA-N 2 0 406.961 4.366 20 0 HIADRP C[NH+](C)CCOc1cccc(NC(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)c1 ZINC000490662080 904161238 /nfs/dbraw/zinc/16/12/38/904161238.db2.gz MXZJWBVXNJAZOG-UHFFFAOYSA-N 2 0 424.589 4.325 20 0 HIADRP COc1ccc([C@@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2ccccc2Cl)cc1 ZINC000493064351 905009207 /nfs/dbraw/zinc/00/92/07/905009207.db2.gz ZMUXGYOJXRRMSZ-HSZRJFAPSA-N 2 0 401.982 4.054 20 0 HIADRP c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+][C@H]3[C@H]4CCO[C@H]4C34CCC4)CC2)cc1 ZINC000493961924 905312441 /nfs/dbraw/zinc/31/24/41/905312441.db2.gz RNQNYZGKESRAQG-UODIDJSMSA-N 2 0 417.597 4.056 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cc(Br)cs2)CC1 ZINC000493966784 905317367 /nfs/dbraw/zinc/31/73/67/905317367.db2.gz CNDXAGCQVGSWDX-MRXNPFEDSA-N 2 0 422.436 4.499 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NCc1ccccc1C[NH+]1CCCCCC1)c1ccccc1 ZINC000494620258 905867186 /nfs/dbraw/zinc/86/71/86/905867186.db2.gz XBGMDWFORKLNHM-XMMPIXPASA-N 2 0 408.590 4.165 20 0 HIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]C1CC[NH+]([C@@H]3CCCC[C@H]3O)CC1)CC2 ZINC000494647885 905880869 /nfs/dbraw/zinc/88/08/69/905880869.db2.gz NIZTWHFVYDHEFM-VAMGGRTRSA-N 2 0 407.396 4.102 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)CC1 ZINC000494934571 906106004 /nfs/dbraw/zinc/10/60/04/906106004.db2.gz GJMDANICWYFERX-UHFFFAOYSA-N 2 0 424.511 4.418 20 0 HIADRP Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000495415538 906438220 /nfs/dbraw/zinc/43/82/20/906438220.db2.gz RBWVKKSOBYAQDP-GJZGRUSLSA-N 2 0 412.500 4.414 20 0 HIADRP COc1cccc([C@@H]2[C@@H]([NH2+][C@H](C)c3ccc(OCC[NH+](C)C)cc3)CCN2C2CC2)c1 ZINC000495419473 906439761 /nfs/dbraw/zinc/43/97/61/906439761.db2.gz BOSKTOMYAAADFQ-JSRBVGTNSA-N 2 0 423.601 4.264 20 0 HIADRP C[C@H](c1ccncc1)N1CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000512613307 921260789 /nfs/dbraw/zinc/26/07/89/921260789.db2.gz RNTCBOSOJSSRQO-JXHGYLODSA-N 2 0 418.629 4.497 20 0 HIADRP COc1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1NC(C)=O ZINC000512618015 921263697 /nfs/dbraw/zinc/26/36/97/921263697.db2.gz HKHMVVLBPINYGS-XPWALMASSA-N 2 0 407.558 4.044 20 0 HIADRP O=C(NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)Nc1cc(C(F)F)ccc1Cl ZINC000497309592 906828976 /nfs/dbraw/zinc/82/89/76/906828976.db2.gz GOICZLAMACPXBZ-UHFFFAOYSA-N 2 0 423.895 4.006 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N[C@H]2C[NH+](C)C[C@H]2c2ccccc2)c1 ZINC000497398373 906879336 /nfs/dbraw/zinc/87/93/36/906879336.db2.gz BVPYRONQJNDXPG-UIOOFZCWSA-N 2 0 413.565 4.146 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]CC4CCN(c5cc[nH+]cc5)CC4)[C@@H]3C2)cc1 ZINC000512654377 921275629 /nfs/dbraw/zinc/27/56/29/921275629.db2.gz LRNKLOJPHIJBPQ-DMDYGQEQSA-N 3 0 404.602 4.188 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@@H]4CCOC5(CCSCC5)C4)[C@@H]3C2)cc1 ZINC000512653969 921275652 /nfs/dbraw/zinc/27/56/52/921275652.db2.gz IHQZPTBLGMGLHP-AFXVXQJMSA-N 2 0 400.632 4.322 20 0 HIADRP CC[NH+](CC)CCN(Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512693734 921289413 /nfs/dbraw/zinc/28/94/13/921289413.db2.gz KKCHLTGTOCUOMT-GMAHTHKFSA-N 2 0 414.638 4.193 20 0 HIADRP C[C@@H](NC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512695301 921290357 /nfs/dbraw/zinc/29/03/57/921290357.db2.gz SUMPUBDXOSEWAV-IRLDBZIGSA-N 2 0 412.622 4.490 20 0 HIADRP CC[NH+](CC)CCN(Cc1cccs1)C(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512702307 921292461 /nfs/dbraw/zinc/29/24/61/921292461.db2.gz DMQXDUJYRJCXPP-VQTJNVASSA-N 2 0 420.667 4.255 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000497720209 907218441 /nfs/dbraw/zinc/21/84/41/907218441.db2.gz MQTFDDPEOLANCN-DEOSSOPVSA-N 2 0 412.622 4.223 20 0 HIADRP CCOC1CC2(C1)CC[NH+](Cc1cccc(C[N@H+]3CCC4(CC(OCC)C4)C3)c1)C2 ZINC000512822721 921326320 /nfs/dbraw/zinc/32/63/20/921326320.db2.gz HXCKOGWRUQZXSY-UHFFFAOYSA-N 2 0 412.618 4.469 20 0 HIADRP CCCN(CC[NH+]1CCCCC1)C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000498029763 907532940 /nfs/dbraw/zinc/53/29/40/907532940.db2.gz USZMBMDQWWXTIC-TZIWHRDSSA-N 2 0 406.640 4.039 20 0 HIADRP CCCN(CC[NH+]1CCCCC1)C(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000498029757 907533978 /nfs/dbraw/zinc/53/39/78/907533978.db2.gz USZMBMDQWWXTIC-CTNGQTDRSA-N 2 0 406.640 4.039 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]C2c3ccccc3-c3ccccc32)cc1 ZINC000498808844 908218313 /nfs/dbraw/zinc/21/83/13/908218313.db2.gz QHUGWFYQFKBQGT-UHFFFAOYSA-N 2 0 411.549 4.372 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1ccc(F)cn1 ZINC000498916517 908325749 /nfs/dbraw/zinc/32/57/49/908325749.db2.gz DJJTXIMULQLHKD-OAQYLSRUSA-N 2 0 424.486 4.478 20 0 HIADRP Cc1ccc([C@@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N2CCOCC2)cc1 ZINC000499139649 908497226 /nfs/dbraw/zinc/49/72/26/908497226.db2.gz QGZZIEYXKPEJBX-HVWQDESWSA-N 2 0 419.613 4.154 20 0 HIADRP O=c1ccccn1Cc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499150688 908509349 /nfs/dbraw/zinc/50/93/49/908509349.db2.gz JMRJPHJLYOYLRG-OOSCYNTBSA-N 2 0 413.565 4.182 20 0 HIADRP c1ccc(CC[N@@H+]2CC[C@@H](CN[C@@H]3C[C@H]4CC[C@@H](C3)[NH+]4Cc3ccccc3)C2)cc1 ZINC000499156756 908513645 /nfs/dbraw/zinc/51/36/45/908513645.db2.gz MKTHMPWFBCPJTC-YIPNQBBMSA-N 2 0 403.614 4.336 20 0 HIADRP COc1cccc(N2CC[C@@H](C[NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499161355 908516911 /nfs/dbraw/zinc/51/69/11/908516911.db2.gz LRLKZLRLWZRFBX-HFOXQMJASA-N 2 0 405.586 4.307 20 0 HIADRP O=C(CCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)N1Cc2ccccc2C1 ZINC000499220240 908577388 /nfs/dbraw/zinc/57/73/88/908577388.db2.gz VBEIRJJWUROGGY-QEIWAGNOSA-N 2 0 403.570 4.094 20 0 HIADRP Fc1ccc(-n2ccc(CC[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)n2)cc1 ZINC000499235815 908599462 /nfs/dbraw/zinc/59/94/62/908599462.db2.gz SGJJLSSFOBJNPI-NQDVKAMUSA-N 2 0 404.533 4.339 20 0 HIADRP CN(C(=O)c1ccc(C[NH+]2CCCCC2)cc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000499516332 908824612 /nfs/dbraw/zinc/82/46/12/908824612.db2.gz AGGZWKWDYATULY-UHFFFAOYSA-N 2 0 405.586 4.409 20 0 HIADRP OC[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1ccccc1OC(F)(F)F ZINC000513005583 921469858 /nfs/dbraw/zinc/46/98/58/921469858.db2.gz QCIQKGBCDIHOHX-KRWDZBQOSA-N 2 0 414.512 4.123 20 0 HIADRP COc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@@H](C)C[NH+]2CCCC2)cc1 ZINC000513077835 921529992 /nfs/dbraw/zinc/52/99/92/921529992.db2.gz XNKPTHMHEYMORV-HXUWFJFHSA-N 2 0 404.558 4.369 20 0 HIADRP C[C@@H]1C[C@@H](CCNC(=O)N2CCC(CCC[NH+](C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000500893894 910165115 /nfs/dbraw/zinc/16/51/15/910165115.db2.gz MUHLNAZAPQBIDJ-ZJSXRUAMSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H](NC(=O)[C@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1cc2ccccc2o1 ZINC000501024849 910242746 /nfs/dbraw/zinc/24/27/46/910242746.db2.gz OBXIDQJJSAGRHR-MOPGFXCFSA-N 2 0 420.557 4.242 20 0 HIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000501375322 910502395 /nfs/dbraw/zinc/50/23/95/910502395.db2.gz AAFIWILOTSREEV-GHRIWEEISA-N 2 0 404.480 4.045 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+]CC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)CC1 ZINC000501377205 910504689 /nfs/dbraw/zinc/50/46/89/910504689.db2.gz JPBFWYNTFIUXGJ-UHFFFAOYSA-N 2 0 413.556 4.245 20 0 HIADRP c1ccc(CN2CC[NH+](CCCC[NH2+][C@@H]3CCC[C@H](c4cccnc4)C3)CC2)cc1 ZINC000501384621 910514689 /nfs/dbraw/zinc/51/46/89/910514689.db2.gz AGCATDODERNOAG-AZGAKELHSA-N 2 0 406.618 4.295 20 0 HIADRP C[NH+](C)CCCC1CC[NH+](CC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)CC1 ZINC000501774959 910829728 /nfs/dbraw/zinc/82/97/28/910829728.db2.gz LXRKPVFXPWOYHK-SANMLTNESA-N 2 0 419.613 4.215 20 0 HIADRP COc1ccc(NC(=O)[C@H](c2ccccc2)[NH+]2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000501787900 910841260 /nfs/dbraw/zinc/84/12/60/910841260.db2.gz BTYLKASGTMKUMN-DEOSSOPVSA-N 2 0 409.574 4.429 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCC[C@H]2c2ccc(Br)c(F)c2)CC1 ZINC000501887277 910904846 /nfs/dbraw/zinc/90/48/46/910904846.db2.gz MFDVCELOVAHIDV-FQEVSTJZSA-N 2 0 412.391 4.141 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+](Cc2cccc(Br)c2)CC2CC2)CC1 ZINC000501943259 910929236 /nfs/dbraw/zinc/92/92/36/910929236.db2.gz AVEYWIJBFPORND-UHFFFAOYSA-N 2 0 408.428 4.077 20 0 HIADRP CC[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1cc(F)cc(Br)c1 ZINC000501946475 910931957 /nfs/dbraw/zinc/93/19/57/910931957.db2.gz LUMNBIRVPQYLBF-LJQANCHMSA-N 2 0 400.380 4.045 20 0 HIADRP Cc1cc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)nn1C ZINC000502696002 911732732 /nfs/dbraw/zinc/73/27/32/911732732.db2.gz IGFPYIRDPLESFA-GOSISDBHSA-N 2 0 423.527 4.000 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)N3CCC[C@H](C[N@@H+]4CCCC[C@@H]4C)C3)CC2)CC1 ZINC000502807635 911824952 /nfs/dbraw/zinc/82/49/52/911824952.db2.gz GNZIZAFYQZRSQZ-APCZXGEWSA-N 2 0 418.670 4.326 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)c1 ZINC000502846650 911856270 /nfs/dbraw/zinc/85/62/70/911856270.db2.gz OVQWCLBFBBBGOL-VWLOTQADSA-N 2 0 405.586 4.409 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000503086836 912056079 /nfs/dbraw/zinc/05/60/79/912056079.db2.gz JLJKXASWARVZML-XUZZJYLKSA-N 2 0 420.601 4.128 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)CCCC1)c1ccccc1 ZINC000503107385 912074148 /nfs/dbraw/zinc/07/41/48/912074148.db2.gz MEVBTLGMCXCREX-QUCCMNQESA-N 2 0 414.619 4.314 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CCc3c2c(F)ccc3F)c1)C1CCOCC1 ZINC000513400318 921769128 /nfs/dbraw/zinc/76/91/28/921769128.db2.gz XGJXHQWYKFZOLT-QHCPKHFHSA-N 2 0 416.512 4.232 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1)c1ccccc1 ZINC000506800745 915540376 /nfs/dbraw/zinc/54/03/76/915540376.db2.gz KKMKSJJJXIXWAA-BHIFYINESA-N 2 0 414.638 4.412 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)C1 ZINC000506862977 915651830 /nfs/dbraw/zinc/65/18/30/915651830.db2.gz JDULBFJZEGJCMB-AKFKNWHVSA-N 2 0 412.622 4.120 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC000506948602 915753827 /nfs/dbraw/zinc/75/38/27/915753827.db2.gz GUNKOSXDFWFSKB-QPPBQGQZSA-N 2 0 414.638 4.324 20 0 HIADRP O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000507138560 915884794 /nfs/dbraw/zinc/88/47/94/915884794.db2.gz LBUQGOKUCGRSHQ-UHFFFAOYSA-N 2 0 419.613 4.066 20 0 HIADRP Cc1cccc([C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C(=O)N2CCC[C@@H]([NH+](C)C)CC2)c1 ZINC000507391871 916154987 /nfs/dbraw/zinc/15/49/87/916154987.db2.gz XPWWPGSADBIAJI-CYXNTTPDSA-N 2 0 419.613 4.153 20 0 HIADRP Cc1ccc([C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000507438312 916207861 /nfs/dbraw/zinc/20/78/61/916207861.db2.gz CQPUOBMIRBQPRA-QHCPKHFHSA-N 2 0 414.615 4.118 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)[C@H]1CCCOC1 ZINC000507459673 916228231 /nfs/dbraw/zinc/22/82/31/916228231.db2.gz GKZOUDJKAQBXLL-MOPGFXCFSA-N 2 0 413.528 4.012 20 0 HIADRP CC(C)[NH+](CCN(C)C(=O)NCC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)C(C)C ZINC000508268746 917085648 /nfs/dbraw/zinc/08/56/48/917085648.db2.gz RVWIAFKJVPRQAR-FYYLOGMGSA-N 2 0 402.627 4.047 20 0 HIADRP Cc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(OC[C@H]2CCOC2)c1 ZINC000508691540 917454842 /nfs/dbraw/zinc/45/48/42/917454842.db2.gz NKODDSQVNLZTFF-NMVJMZGASA-N 2 0 408.586 4.411 20 0 HIADRP C[C@H]([NH2+]CC1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508712958 917473627 /nfs/dbraw/zinc/47/36/27/917473627.db2.gz DYBUWQCEGUWQOQ-SQJMNOBHSA-N 2 0 405.586 4.039 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)N[C@H](C)[C@H](c1ccccc1)[NH+](C)C ZINC000508852808 917605928 /nfs/dbraw/zinc/60/59/28/917605928.db2.gz NVBLJSHWEAQMCY-GZGNHOFSSA-N 2 0 422.617 4.231 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)N[C@@H](C)[C@@H](c1ccccc1)[NH+](C)C ZINC000508852810 917606543 /nfs/dbraw/zinc/60/65/43/917606543.db2.gz NVBLJSHWEAQMCY-PWWKTKHKSA-N 2 0 422.617 4.231 20 0 HIADRP Cc1ccccc1[C@H]([C@H](C)NC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[NH+](C)C ZINC000508861966 917614925 /nfs/dbraw/zinc/61/49/25/917614925.db2.gz IUVPYISPBTVKBZ-OFVILXPXSA-N 2 0 422.617 4.292 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N[C@H](C)[C@H](c1ccccc1C)[NH+](C)C)c1ccco1 ZINC000508877151 917630202 /nfs/dbraw/zinc/63/02/02/917630202.db2.gz DXLKUVZTCGUDNO-XHYAQGIWSA-N 2 0 400.567 4.008 20 0 HIADRP C[C@H](NC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1)[C@H](c1ccccc1)[NH+](C)C ZINC000508913342 917670094 /nfs/dbraw/zinc/67/00/94/917670094.db2.gz BZUPRKVNPLESNZ-GBXCKJPGSA-N 2 0 423.605 4.021 20 0 HIADRP Brc1ccccc1-c1ccc(C[NH2+]CCCC[NH+]2CCOCC2)cc1 ZINC000509545067 918194394 /nfs/dbraw/zinc/19/43/94/918194394.db2.gz XLDVNXXADBCNBQ-UHFFFAOYSA-N 2 0 403.364 4.318 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1)c1ccco1 ZINC000509612158 918258987 /nfs/dbraw/zinc/25/89/87/918258987.db2.gz WVHMCHXMWUOOFG-HOKHCIIBSA-N 2 0 424.589 4.016 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1)c1ccco1 ZINC000509612160 918259059 /nfs/dbraw/zinc/25/90/59/918259059.db2.gz WVHMCHXMWUOOFG-UWDQQESISA-N 2 0 424.589 4.016 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]C1CCC(NC(=O)COc2ccc(Cl)cc2)CC1 ZINC000509671122 918303045 /nfs/dbraw/zinc/30/30/45/918303045.db2.gz CIVXWRPMJILRQV-PELRDEGISA-N 2 0 422.013 4.000 20 0 HIADRP C[C@@H]1C[C@H](CCNC(=O)c2ccc(C[NH+]3CCCC3)cc2)C[N@@H+]1Cc1ccccc1 ZINC000510099401 918663265 /nfs/dbraw/zinc/66/32/65/918663265.db2.gz OLXQLVMEHUGYBH-QPPBQGQZSA-N 2 0 405.586 4.313 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(Br)cc21 ZINC000510943029 919471580 /nfs/dbraw/zinc/47/15/80/919471580.db2.gz HLUDRSNQIYJEQI-RBBKRZOGSA-N 2 0 415.375 4.183 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[NH+]4CCC(CC[NH+](C)C)CC4)cc3)nc12 ZINC000511460226 920070677 /nfs/dbraw/zinc/07/06/77/920070677.db2.gz LBLDDQWCUGFYFE-UHFFFAOYSA-N 2 0 406.574 4.385 20 0 HIADRP C[C@H](C[NH2+][C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)C[NH+]1CCCC1 ZINC000512099217 920859068 /nfs/dbraw/zinc/85/90/68/920859068.db2.gz KZAZFWUUQUMXLE-KGLIPLIRSA-N 2 0 405.892 4.397 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)N[C@H]2CC[NH+](Cc3ccccc3)CC2(C)C)C1 ZINC000512137933 920883507 /nfs/dbraw/zinc/88/35/07/920883507.db2.gz JPNYTCVVNFELKW-GMAHTHKFSA-N 2 0 414.638 4.098 20 0 HIADRP c1csc(-c2noc(CCC[N@@H+]3CC[C@]4(CC[NH+](Cc5ccccc5)C4)C3)n2)c1 ZINC000512236990 920992486 /nfs/dbraw/zinc/99/24/86/920992486.db2.gz LBKUENPWJWDURY-QHCPKHFHSA-N 2 0 408.571 4.329 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512332044 921080425 /nfs/dbraw/zinc/08/04/25/921080425.db2.gz MUYGMLYIAQDVCE-IXDOHACOSA-N 2 0 422.411 4.409 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(Br)cc1 ZINC000513456966 921822153 /nfs/dbraw/zinc/82/21/53/921822153.db2.gz GVMWPOPLJGIICW-RTWAWAEBSA-N 2 0 403.364 4.257 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+][C@@H](Cc2ccccn2)c2cccnc2)C[C@H](C)O1 ZINC000513498530 921848108 /nfs/dbraw/zinc/84/81/08/921848108.db2.gz AMTIQPGAEIPMCR-UZINWLIJSA-N 2 0 416.569 4.159 20 0 HIADRP Cc1nc(COc2ccc(C[NH2+]CC[C@@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)cc2)no1 ZINC000513546023 921883509 /nfs/dbraw/zinc/88/35/09/921883509.db2.gz VIYHXQVSSUEQCB-WMZHIEFXSA-N 2 0 420.557 4.347 20 0 HIADRP CCc1cc(N2CCC[C@@H]([NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)C2)ncn1 ZINC000513717984 922037990 /nfs/dbraw/zinc/03/79/90/922037990.db2.gz UWCBMELNAOZIKE-NSQNTRMNSA-N 2 0 407.606 4.041 20 0 HIADRP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000513750455 922071316 /nfs/dbraw/zinc/07/13/16/922071316.db2.gz IKOIALWMDZVGCD-UHFFFAOYSA-N 2 0 405.384 4.025 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)c1ccc(C[NH+]2CCSCC2)cc1)c1ccsc1 ZINC000513766263 922084100 /nfs/dbraw/zinc/08/41/00/922084100.db2.gz QJXNTVXXDQFLOR-OAQYLSRUSA-N 2 0 417.644 4.110 20 0 HIADRP FC(F)(F)c1cccc(OCCCC[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c1 ZINC000513819620 922143740 /nfs/dbraw/zinc/14/37/40/922143740.db2.gz ZZSHXFHJJNCBNH-UHFFFAOYSA-N 2 0 414.512 4.299 20 0 HIADRP CCC1(CNC(=O)NC[C@H]2CCC[N@@H+](C(C)C)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000514021688 922343507 /nfs/dbraw/zinc/34/35/07/922343507.db2.gz CMEXIWXJIMTBFT-HSZRJFAPSA-N 2 0 414.638 4.098 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1 ZINC000514229380 922566834 /nfs/dbraw/zinc/56/68/34/922566834.db2.gz DCDPYYBJUGQBSN-KRWDZBQOSA-N 2 0 409.496 4.329 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+]Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1 ZINC000514236963 922574540 /nfs/dbraw/zinc/57/45/40/922574540.db2.gz BFLXRQNHLNWRGM-UHFFFAOYSA-N 2 0 409.496 4.473 20 0 HIADRP CCOc1ccc(NC(=O)[C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000515521761 923152032 /nfs/dbraw/zinc/15/20/32/923152032.db2.gz UUBATNOLASUJMC-PMACEKPBSA-N 2 0 409.574 4.434 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000515759715 923332289 /nfs/dbraw/zinc/33/22/89/923332289.db2.gz WCHPCKJQFHWBOS-CEXWTWQISA-N 2 0 423.557 4.010 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)c1ccc(F)cc1 ZINC000515798144 923356524 /nfs/dbraw/zinc/35/65/24/923356524.db2.gz UEOPOZWCGCMHHZ-QHCPKHFHSA-N 2 0 412.553 4.279 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NCc2ccccc2C[NH+]2CCCCC2)CC1 ZINC000515875036 923406078 /nfs/dbraw/zinc/40/60/78/923406078.db2.gz MVNHYSNLJHOAPL-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP COC1CC[NH+](C2(CN[C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)CCCC2)CC1 ZINC000516708468 923857258 /nfs/dbraw/zinc/85/72/58/923857258.db2.gz GWTKPMWNAXNWMK-BKFWDETESA-N 2 0 411.634 4.195 20 0 HIADRP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000516765772 923881716 /nfs/dbraw/zinc/88/17/16/923881716.db2.gz QKBBTWADVRTMNX-FPOVZHCZSA-N 2 0 415.578 4.053 20 0 HIADRP c1nc(-c2ccccc2)sc1C[NH2+]CCCC[NH+]1CCN(Cc2ccccc2)CC1 ZINC000517543181 924254660 /nfs/dbraw/zinc/25/46/60/924254660.db2.gz WCTNBANRXJWTJR-UHFFFAOYSA-N 2 0 420.626 4.498 20 0 HIADRP Cc1ccc(-c2ccc(C[NH+]3CCC(C(=O)NCCC[NH+]4CCCC4)CC3)o2)cc1 ZINC000518440421 927272582 /nfs/dbraw/zinc/27/25/82/927272582.db2.gz SMPWMBOBLZJOGG-UHFFFAOYSA-N 2 0 409.574 4.069 20 0 HIADRP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000518591500 927367677 /nfs/dbraw/zinc/36/76/77/927367677.db2.gz KQQIEWWEKBIVPA-UAEBTNLVSA-N 2 0 419.613 4.061 20 0 HIADRP CN1CC[NH+](CCCC[NH2+]Cc2ccc(-c3cccc(Br)c3)s2)CC1 ZINC000518761432 927481441 /nfs/dbraw/zinc/48/14/41/927481441.db2.gz WHIJNDXXSBYYGW-UHFFFAOYSA-N 2 0 422.436 4.295 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000518888670 927600959 /nfs/dbraw/zinc/60/09/59/927600959.db2.gz LWKMPZMNJZHWHI-LOSJGSFVSA-N 2 0 402.586 4.432 20 0 HIADRP CC[N@@H+]1CCCC[C@@H]1CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000518967780 927663098 /nfs/dbraw/zinc/66/30/98/927663098.db2.gz ZOEIDRMCCOGPEO-HSZRJFAPSA-N 2 0 408.590 4.089 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCc2cccc(C[NH+]3CCCC3)c2)[NH+]2CCCC2)cc1 ZINC000519935833 928169334 /nfs/dbraw/zinc/16/93/34/928169334.db2.gz DFBWHMKTXLOKEO-RUZDIDTESA-N 2 0 420.601 4.227 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NCc1cccc(C[NH+]2CCCCCC2)c1)c1ccsc1 ZINC000520297784 928460351 /nfs/dbraw/zinc/46/03/51/928460351.db2.gz IFRKFGVDHYOSJO-JOCHJYFZSA-N 2 0 414.619 4.226 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)c1ccc(N2CC[NH+](C(C)C)CC2)cc1)c1ccccc1 ZINC000520464388 928581656 /nfs/dbraw/zinc/58/16/56/928581656.db2.gz VSVZJTMFTFUIGX-VWLOTQADSA-N 2 0 422.617 4.030 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H](O)COc1cccc2ccccc21 ZINC000520686650 928734268 /nfs/dbraw/zinc/73/42/68/928734268.db2.gz WSPQKEHSVGKNQB-PBXXJUDPSA-N 2 0 404.554 4.080 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)N3CCCC[C@@H]([NH+]4CCCC4)C3)c2)CC1 ZINC000520791381 928820608 /nfs/dbraw/zinc/82/06/08/928820608.db2.gz VTKVRXBVDULQGQ-XMMPIXPASA-N 2 0 412.622 4.078 20 0 HIADRP C[NH+](C)[C@@H]1CCCN(C(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000521522106 929273170 /nfs/dbraw/zinc/27/31/70/929273170.db2.gz UMPYJPTXHDMRQF-XMMPIXPASA-N 2 0 420.601 4.185 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000524878678 929869546 /nfs/dbraw/zinc/86/95/46/929869546.db2.gz OLSIOKDYDAMQOK-QFIPXVFZSA-N 2 0 423.601 4.144 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)[NH+]2CCCC2)o1 ZINC000524884773 929871824 /nfs/dbraw/zinc/87/18/24/929871824.db2.gz SUQFRUMTKNWEDH-REWPJTCUSA-N 2 0 424.589 4.031 20 0 HIADRP C[N@H+](C[C@@H](O)COc1ccc2ccccc2c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525269547 930121054 /nfs/dbraw/zinc/12/10/54/930121054.db2.gz AQZFKSREXUNAID-RCZVLFRGSA-N 2 0 404.554 4.033 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000525451152 930247946 /nfs/dbraw/zinc/24/79/46/930247946.db2.gz OQHGTSDZNXCNOH-QFIPXVFZSA-N 2 0 420.601 4.088 20 0 HIADRP C[C@@H]1C[NH+](CCOc2ccc(CC[NH2+][C@H](c3ncc[nH]3)c3ccccc3)cc2)C[C@H]1C ZINC000525869313 930473085 /nfs/dbraw/zinc/47/30/85/930473085.db2.gz WBQVMQUJOZZCAU-OTPAQWSUSA-N 2 0 418.585 4.298 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1 ZINC000526095682 930529698 /nfs/dbraw/zinc/52/96/98/930529698.db2.gz BWGWKSDBIHCPST-QFIPXVFZSA-N 2 0 414.981 4.403 20 0 HIADRP Cc1ccc(OCc2nc(C[NH2+]CCCC[NH+]3C[C@H](C)O[C@@H](C)C3)cs2)cc1 ZINC000531349950 931026652 /nfs/dbraw/zinc/02/66/52/931026652.db2.gz POZQWXOKJAIVQP-OALUTQOASA-N 2 0 403.592 4.010 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ccc(OC(F)(F)F)cc3)CC2)CC1 ZINC000531426425 931052188 /nfs/dbraw/zinc/05/21/88/931052188.db2.gz UYRCWDILCNERIU-UHFFFAOYSA-N 2 0 413.528 4.213 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@H]1CCCO[C@H]1c1ccccc1)C1CC[NH+](C)CC1 ZINC000531596850 931115623 /nfs/dbraw/zinc/11/56/23/931115623.db2.gz AOVFLSYXSNFEAN-BVAGGSTKSA-N 2 0 407.602 4.475 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1cccc(NC(=O)C2CCC2)c1)C1CC[NH+](C)CC1 ZINC000531597362 931116870 /nfs/dbraw/zinc/11/68/70/931116870.db2.gz JSMKELHTZGJNEP-UHFFFAOYSA-N 2 0 420.601 4.245 20 0 HIADRP C[NH+](C)CCC1CC[NH+](CC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000531643534 931136482 /nfs/dbraw/zinc/13/64/82/931136482.db2.gz USFHEZHWTIBEDC-FQEVSTJZSA-N 2 0 412.405 4.321 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531711403 931169892 /nfs/dbraw/zinc/16/98/92/931169892.db2.gz YGIGDAPWRUFLIC-INIZCTEOSA-N 2 0 405.945 4.068 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NC[C@@H]1CC[N@H+](CC(C)C)C1)c1cccc(C(F)(F)F)c1 ZINC000531800669 931203694 /nfs/dbraw/zinc/20/36/94/931203694.db2.gz VJAFJTOGWNAJGU-FXAWDEMLSA-N 2 0 413.528 4.182 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2ccc(Cl)c3cccnc23)cc1 ZINC000531866335 931227471 /nfs/dbraw/zinc/22/74/71/931227471.db2.gz NOKSKMKPMMLNLL-UHFFFAOYSA-N 2 0 422.960 4.004 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)CC1 ZINC000531928153 931248214 /nfs/dbraw/zinc/24/82/14/931248214.db2.gz ZDHQVYUGKHRIER-NRFANRHFSA-N 2 0 412.622 4.110 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000531937516 931253985 /nfs/dbraw/zinc/25/39/85/931253985.db2.gz JGDDWDJCWKFTQA-HSALFYBXSA-N 2 0 414.615 4.419 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1cccc(OCc2ccccc2)c1 ZINC000531941774 931255153 /nfs/dbraw/zinc/25/51/53/931255153.db2.gz UVXBGEVPSWZFOR-NRFANRHFSA-N 2 0 416.569 4.263 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]C2CCC3(CCOCC3)CC2)c1)C1CCOCC1 ZINC000531957589 931264745 /nfs/dbraw/zinc/26/47/45/931264745.db2.gz HIILFDFIEPMYDC-UHFFFAOYSA-N 2 0 416.606 4.005 20 0 HIADRP C[NH+]1CCN(C[C@H]([NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)c2ccccc2)CC1 ZINC000531965292 931268616 /nfs/dbraw/zinc/26/86/16/931268616.db2.gz PZIFBRVZTMQHRD-YADHBBJMSA-N 2 0 419.491 4.151 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCc4nc(-c5ccccc5)sc43)cn2)CC1 ZINC000531989925 931278592 /nfs/dbraw/zinc/27/85/92/931278592.db2.gz XPXJJPLVJKHFST-HXUWFJFHSA-N 2 0 419.598 4.124 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+]C2CCN(Cc3c(F)cccc3Cl)CC2)cc1 ZINC000532211117 931353883 /nfs/dbraw/zinc/35/38/83/931353883.db2.gz ACTFHBZXJIPNCE-UHFFFAOYSA-N 2 0 419.972 4.174 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(OC)c(Br)c2)[C@@H](C)C1 ZINC000532223228 931360226 /nfs/dbraw/zinc/36/02/26/931360226.db2.gz LSAMSZNWOGLLGC-FCEWJHQRSA-N 2 0 413.400 4.245 20 0 HIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000532451679 931440792 /nfs/dbraw/zinc/44/07/92/931440792.db2.gz JXURWYWZVZUWGO-JKSUJKDBSA-N 2 0 423.388 4.086 20 0 HIADRP COc1ccc(NC(=O)CC[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)cc1 ZINC000532986615 931726795 /nfs/dbraw/zinc/72/67/95/931726795.db2.gz JEFGEYRQXHBDDD-VWLOTQADSA-N 2 0 407.558 4.012 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1 ZINC000533090530 931768749 /nfs/dbraw/zinc/76/87/49/931768749.db2.gz SVTQEPZHFOVMTF-HKBOAZHASA-N 2 0 411.590 4.228 20 0 HIADRP CC1CC[NH+](CCCC[NH2+][C@H]2CCCC[C@@H](N3C(=O)c4ccccc4C3=O)C2)CC1 ZINC000533090490 931768975 /nfs/dbraw/zinc/76/89/75/931768975.db2.gz MHWJOCNDKPDXML-LEWJYISDSA-N 2 0 411.590 4.086 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]C[C@H](c2ccccc2)C(C)(C)CO)CC1 ZINC000533330659 931840307 /nfs/dbraw/zinc/84/03/07/931840307.db2.gz PQSHQZOFKNHTGK-XMMPIXPASA-N 2 0 409.618 4.111 20 0 HIADRP Cc1nc(NC2CC[NH+](C(C)(C)C)CC2)cc(NC2CC[NH+](C(C)(C)C)CC2)[nH+]1 ZINC000533555201 931899515 /nfs/dbraw/zinc/89/95/15/931899515.db2.gz MGLQFORXJZQPNX-UHFFFAOYSA-N 3 0 402.631 4.135 20 0 HIADRP CCC1(C[NH2+]Cc2cn(C)nc2-c2cccnc2)CC[NH+](Cc2ccccc2)CC1 ZINC000533583909 931907294 /nfs/dbraw/zinc/90/72/94/931907294.db2.gz MYSCHDQDEJMDML-UHFFFAOYSA-N 2 0 403.574 4.264 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1)c1ccccc1Cl ZINC000533763322 932018392 /nfs/dbraw/zinc/01/83/92/932018392.db2.gz BPHWGJCZZGVYDA-SIKLNZKXSA-N 2 0 421.029 4.096 20 0 HIADRP C[C@@H](c1ccc(F)cc1)N(C)C(=O)C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534228421 932347564 /nfs/dbraw/zinc/34/75/64/932347564.db2.gz OZAUSCHZGXGRDV-NRFANRHFSA-N 2 0 423.576 4.333 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)N2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000534242373 932360506 /nfs/dbraw/zinc/36/05/06/932360506.db2.gz XWNPAEGADHRILB-UHFFFAOYSA-N 2 0 406.574 4.268 20 0 HIADRP COc1ccc(NC(=O)[C@@H](C)[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000534965323 932864751 /nfs/dbraw/zinc/86/47/51/932864751.db2.gz RMPFELUIKLKQDJ-HXUWFJFHSA-N 2 0 407.558 4.010 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)Cc1ccccc1 ZINC000535256509 933039731 /nfs/dbraw/zinc/03/97/31/933039731.db2.gz ASONFRURFUXACL-DEOSSOPVSA-N 2 0 408.590 4.009 20 0 HIADRP CC(C)c1nn(-c2ccc(Br)cc2)cc1CNC[C@@H]1CCC[N@H+](C)C1 ZINC000535714300 933365807 /nfs/dbraw/zinc/36/58/07/933365807.db2.gz RCTUAIBORQRZHW-INIZCTEOSA-N 2 0 405.384 4.190 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)N2CC[C@H](C3CC[NH+](C)CC3)C2)CCCC1)c1ccccc1 ZINC000535939829 933506305 /nfs/dbraw/zinc/50/63/05/933506305.db2.gz YVKLFIZFFGFDHB-REWPJTCUSA-N 2 0 412.622 4.023 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cccc(F)c1F ZINC000537345038 933728054 /nfs/dbraw/zinc/72/80/54/933728054.db2.gz UYPWSVNYYKIQGS-QGZVFWFLSA-N 2 0 404.501 4.305 20 0 HIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc(OC)c1OC ZINC000563228270 945157522 /nfs/dbraw/zinc/15/75/22/945157522.db2.gz UDTKFCFGUJNPPZ-QGZVFWFLSA-N 2 0 414.546 4.036 20 0 HIADRP CC(C)N1CC[C@H](NC(=O)c2cccc(C[NH+](C)C)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000537521196 938315476 /nfs/dbraw/zinc/31/54/76/938315476.db2.gz MSKKWWKDDAWXJF-VXKWHMMOSA-N 2 0 417.956 4.495 20 0 HIADRP C[NH+](C)CCCC1CCN(C(=O)Nc2ccc(OCC[NH+]3CCCCC3)cc2)CC1 ZINC000537612638 938332853 /nfs/dbraw/zinc/33/28/53/938332853.db2.gz QNRILASQKYTMMO-UHFFFAOYSA-N 2 0 416.610 4.137 20 0 HIADRP COc1ccc(C[NH+]2CCC(CC[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)cc1OC(F)F ZINC000537660040 938348595 /nfs/dbraw/zinc/34/85/95/938348595.db2.gz UVXXFGJETFRWSB-IRXDYDNUSA-N 2 0 412.521 4.008 20 0 HIADRP Cc1nn(-c2ccc(F)cc2F)c(C)c1C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000537870298 938395514 /nfs/dbraw/zinc/39/55/14/938395514.db2.gz VAQDUSHNGIJWFA-UHFFFAOYSA-N 2 0 411.500 4.169 20 0 HIADRP Cc1cc(C[C@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)n(-c2ccccc2)n1 ZINC000537948513 938428888 /nfs/dbraw/zinc/42/88/88/938428888.db2.gz PWKOBVOIIOCPAN-FPOVZHCZSA-N 2 0 406.574 4.403 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000537955453 938432662 /nfs/dbraw/zinc/43/26/62/938432662.db2.gz WWQAUBXDMBJCMY-PISWEHOVSA-N 2 0 412.549 4.433 20 0 HIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cc1 ZINC000537959077 938434512 /nfs/dbraw/zinc/43/45/12/938434512.db2.gz UITOVYJQIUHLOG-BUUDZMLXSA-N 2 0 400.607 4.320 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H]2CCSc3ccc(Br)cc32)C[C@@H](C)O1 ZINC000537973554 938443190 /nfs/dbraw/zinc/44/31/90/938443190.db2.gz PGXRRXMCGGLINY-RKVPGOIHSA-N 2 0 413.425 4.465 20 0 HIADRP CC(C)Oc1cccc([C@@H](C)[NH2+][C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000538124874 938511592 /nfs/dbraw/zinc/51/15/92/938511592.db2.gz OHARTUFZJWPORP-RTWAWAEBSA-N 2 0 423.601 4.294 20 0 HIADRP Cc1cc(Br)cc2cc([C@H]([NH2+]C[C@@H](C)N3CC[NH+](C)CC3)C(C)C)oc21 ZINC000538445437 938623474 /nfs/dbraw/zinc/62/34/74/938623474.db2.gz LKBXJKGBVLDQIT-OXQOHEQNSA-N 2 0 422.411 4.426 20 0 HIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3ccccc3OCc3ccccn3)CC2)C[C@H](C)O1 ZINC000538763620 938704671 /nfs/dbraw/zinc/70/46/71/938704671.db2.gz NDOMHDMXHNGBDI-VXKWHMMOSA-N 2 0 423.601 4.372 20 0 HIADRP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000538888943 938731037 /nfs/dbraw/zinc/73/10/37/938731037.db2.gz YCDULGXHFMMQFG-XMMPIXPASA-N 2 0 420.601 4.059 20 0 HIADRP COc1ccccc1NC(=O)C[C@H](C)[NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000539045981 938781263 /nfs/dbraw/zinc/78/12/63/938781263.db2.gz DTXHHRTUGMPMBE-JAXLGGSGSA-N 2 0 409.574 4.303 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)C(C)(C)c1ccccc1 ZINC000539254158 938827180 /nfs/dbraw/zinc/82/71/80/938827180.db2.gz NEUAAEZWILLRCF-LEWJYISDSA-N 2 0 407.602 4.112 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@@H]1CCN(c3cccc(Cl)c3)C1)c1ccccc1O2 ZINC000539400505 938854930 /nfs/dbraw/zinc/85/49/30/938854930.db2.gz LXTZMALDTMEYLP-KNQAVFIVSA-N 2 0 411.977 4.497 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c2ccccc21 ZINC000539408037 938856270 /nfs/dbraw/zinc/85/62/70/938856270.db2.gz VEKPWVWMRAHOMZ-FCHUYYIVSA-N 2 0 405.542 4.062 20 0 HIADRP c1ccc(C[NH+]2CCC[C@@]3(CC[N@@H+](Cc4ccccc4N4CCOCC4)C3)C2)cc1 ZINC000539832422 938951971 /nfs/dbraw/zinc/95/19/71/938951971.db2.gz VGRYMKLIKXCZSG-AREMUKBSSA-N 2 0 405.586 4.011 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[NH+]4CC[C@@H]5[C@H](CCC[N@H+]5C)C4)cc3)nc12 ZINC000539897994 938972256 /nfs/dbraw/zinc/97/22/56/938972256.db2.gz GFGGMEJLRZYGDG-ZJSXRUAMSA-N 2 0 404.558 4.138 20 0 HIADRP CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540043910 939047251 /nfs/dbraw/zinc/04/72/51/939047251.db2.gz KRKQIQFHTCXAHZ-JOCHJYFZSA-N 2 0 422.617 4.446 20 0 HIADRP CCc1ccc([C@H](C)NC(=O)C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000540044834 939047993 /nfs/dbraw/zinc/04/79/93/939047993.db2.gz PBRZEDAGNQBPSB-FQEVSTJZSA-N 2 0 408.590 4.060 20 0 HIADRP CCc1ccc(-c2noc(C[N@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)n2)cc1 ZINC000540045268 939048031 /nfs/dbraw/zinc/04/80/31/939048031.db2.gz BUDIOOIXCJUDTQ-UHFFFAOYSA-N 2 0 405.546 4.433 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000540138000 939087243 /nfs/dbraw/zinc/08/72/43/939087243.db2.gz XYXIJJVVOANATG-INIZCTEOSA-N 2 0 420.479 4.324 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H]2CCSc3ccc(Br)cc32)ccn1 ZINC000540144306 939090268 /nfs/dbraw/zinc/09/02/68/939090268.db2.gz XLMJHZTWOPIXBQ-KRWDZBQOSA-N 2 0 422.392 4.111 20 0 HIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(N2CCOCC2)c1 ZINC000540145703 939090751 /nfs/dbraw/zinc/09/07/51/939090751.db2.gz LKOSUFXSAZKUOH-FIXSFTCYSA-N 2 0 407.602 4.475 20 0 HIADRP C[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c2cccc(Br)c21 ZINC000540159137 939095421 /nfs/dbraw/zinc/09/54/21/939095421.db2.gz XHWADELKWRWHRZ-YGBSJELFSA-N 2 0 407.396 4.355 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)cc1 ZINC000540172966 939102610 /nfs/dbraw/zinc/10/26/10/939102610.db2.gz GRMCBZQNGBUWNB-FQEVSTJZSA-N 2 0 406.357 4.062 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc2c(c1)OCCCO2 ZINC000540194428 939119695 /nfs/dbraw/zinc/11/96/95/939119695.db2.gz HYDGDLSLHWDEJS-OAQYLSRUSA-N 2 0 409.574 4.101 20 0 HIADRP CC[N@H+](CCC1CC[NH+]([C@H](C)C(=O)N[C@@H]2CCOc3ccccc32)CC1)CC(C)C ZINC000540197860 939122121 /nfs/dbraw/zinc/12/21/21/939122121.db2.gz SSWOMATZIGZZOH-NFBKMPQASA-N 2 0 415.622 4.095 20 0 HIADRP CC(C)[C@@H]([NH2+]CCCN1CC[N@H+](C)C[C@@H]1c1ccccc1)c1ccc2[nH]c(=O)oc2c1 ZINC000540260239 939176446 /nfs/dbraw/zinc/17/64/46/939176446.db2.gz BDDDIOWSDFOYHK-ISKFKSNPSA-N 2 0 422.573 4.199 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CCCc3cc(F)ccc32)c1)C1CCOCC1 ZINC000540416651 939240609 /nfs/dbraw/zinc/24/06/09/939240609.db2.gz VIISZWYOFUQNHU-RUZDIDTESA-N 2 0 412.549 4.483 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CC(C)(C)c1ccc3c(c1)OCCO3)c1ccccc1O2 ZINC000540475870 939267451 /nfs/dbraw/zinc/26/74/51/939267451.db2.gz SNXKJWJGTMJJJL-OAQYLSRUSA-N 2 0 422.569 4.313 20 0 HIADRP C[C@@H](CCN[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000540494678 939274548 /nfs/dbraw/zinc/27/45/48/939274548.db2.gz HDQRYNJFISTBKU-XUZZJYLKSA-N 2 0 407.602 4.475 20 0 HIADRP C[N@H+](CC(=O)NC1CC[NH+](C2CC2)CC1)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000540676708 939336533 /nfs/dbraw/zinc/33/65/33/939336533.db2.gz YIEIDDWMDKSFDB-RTWAWAEBSA-N 2 0 423.523 4.016 20 0 HIADRP CCOc1ccc([C@H](C)NC(=O)CCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000540984294 939424927 /nfs/dbraw/zinc/42/49/27/939424927.db2.gz IQUXREYFKBBOBV-FQEVSTJZSA-N 2 0 415.622 4.429 20 0 HIADRP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)CCCO2 ZINC000540989239 939426393 /nfs/dbraw/zinc/42/63/93/939426393.db2.gz OZLGOGKKDCIARW-KNQAVFIVSA-N 2 0 400.950 4.219 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3c(Br)cccc32)C1 ZINC000541246996 939487523 /nfs/dbraw/zinc/48/75/23/939487523.db2.gz OOQFBLPRDDFEIW-PGRDOPGGSA-N 2 0 415.375 4.183 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000541545499 939549893 /nfs/dbraw/zinc/54/98/93/939549893.db2.gz IHQOJGZRSBUMHZ-AQNXPRMDSA-N 2 0 410.558 4.046 20 0 HIADRP C[C@H](CCN[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)[NH2+][C@H](C)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000541602863 939566187 /nfs/dbraw/zinc/56/61/87/939566187.db2.gz BZHRZFIHKPMYKJ-RMRNXIRCSA-N 3 0 418.714 4.250 20 0 HIADRP C[C@H](CCN[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)[NH2+][C@H](C)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000541602860 939566341 /nfs/dbraw/zinc/56/63/41/939566341.db2.gz BZHRZFIHKPMYKJ-MRKXFKPJSA-N 3 0 418.714 4.250 20 0 HIADRP COc1cc(-c2ccccc2)ccc1C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000541923948 939655192 /nfs/dbraw/zinc/65/51/92/939655192.db2.gz NRHSCAVQTMTRSC-RUZDIDTESA-N 2 0 402.538 4.219 20 0 HIADRP O=C(c1ccccc1Cl)N1CCC([NH2+]C2CC[NH+](CC3CCCC3)CC2)CC1 ZINC000542144332 939728998 /nfs/dbraw/zinc/72/89/98/939728998.db2.gz IHSLJNYLAZLELY-UHFFFAOYSA-N 2 0 403.998 4.189 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@H](c3ccccc3)c3cncnc3)CC2)c1 ZINC000542670044 939853010 /nfs/dbraw/zinc/85/30/10/939853010.db2.gz BULADJLXWGDUML-AREMUKBSSA-N 2 0 415.585 4.066 20 0 HIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1F ZINC000542847762 939862936 /nfs/dbraw/zinc/86/29/36/939862936.db2.gz SZCYWQSHRSPQGT-AOHZBQACSA-N 2 0 412.549 4.217 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)cc1 ZINC000542852109 939863188 /nfs/dbraw/zinc/86/31/88/939863188.db2.gz QOPMHNBWZZXDDJ-IIBYNOLFSA-N 2 0 403.364 4.257 20 0 HIADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000543073082 939924302 /nfs/dbraw/zinc/92/43/02/939924302.db2.gz VSFMSDRFEXBFAD-UONOGXRCSA-N 2 0 405.892 4.397 20 0 HIADRP COc1ccc(Oc2ccc(C[N@@H+]3CC[C@@H](N4CC[NH+](C(C)C)CC4)C3)cc2)cc1 ZINC000543397358 940051156 /nfs/dbraw/zinc/05/11/56/940051156.db2.gz JEQLSHZXMJSZPU-JOCHJYFZSA-N 2 0 409.574 4.088 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1ccc(Oc2ccccc2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000543458809 940068945 /nfs/dbraw/zinc/06/89/45/940068945.db2.gz KSIKYFBGJFKNGV-QNWVGRARSA-N 2 0 424.585 4.461 20 0 HIADRP C[C@H]1[NH+](Cc2ccccc2C[N@@H+]2CCC3(CCOCC3)[C@H]2C)CCC12CCOCC2 ZINC000543575680 940115958 /nfs/dbraw/zinc/11/59/58/940115958.db2.gz ZMSMYYIDCIHFLX-FGZHOGPDSA-N 2 0 412.618 4.469 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3c(OC(F)F)ccc4ccccc43)CC2)CC1 ZINC000543618539 940134561 /nfs/dbraw/zinc/13/45/61/940134561.db2.gz HAJZYSJAKDSYAL-UHFFFAOYSA-N 2 0 417.544 4.291 20 0 HIADRP COc1ccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccccc2)cc1 ZINC000543772701 940181187 /nfs/dbraw/zinc/18/11/87/940181187.db2.gz BKTIIPZZOZNJHZ-AOYPEHQESA-N 2 0 402.538 4.141 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cnn1-c1cccc(Cl)c1 ZINC000543775825 940182679 /nfs/dbraw/zinc/18/26/79/940182679.db2.gz KXPHAGMTVUESGS-UZUQRXQVSA-N 2 0 424.976 4.252 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(F)c(Br)c1 ZINC000543778254 940184077 /nfs/dbraw/zinc/18/40/77/940184077.db2.gz ZQIBLXNVBUNSKH-KDOFPFPSSA-N 2 0 407.327 4.006 20 0 HIADRP COc1ccc(Oc2ccc(C[NH2+]C3CC[NH+]([C@@H]4CCCC[C@@H]4O)CC3)cc2)cc1 ZINC000544179817 940345428 /nfs/dbraw/zinc/34/54/28/940345428.db2.gz NFHHMQHAYKWJJJ-RPBOFIJWSA-N 2 0 410.558 4.345 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CN1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000544349392 940396694 /nfs/dbraw/zinc/39/66/94/940396694.db2.gz UOPFLMZDGMTCCQ-RDGATRHJSA-N 2 0 401.558 4.062 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ncc(Br)cc1Br ZINC000544407269 940415026 /nfs/dbraw/zinc/41/50/26/940415026.db2.gz XHEMFGMNZDYVRK-CYBMUJFWSA-N 2 0 419.205 4.351 20 0 HIADRP Cc1ccc(-c2noc(CCC[NH2+][C@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)n2)cc1F ZINC000544421239 940420459 /nfs/dbraw/zinc/42/04/59/940420459.db2.gz KDOREKWDHMLNQR-MJGOQNOKSA-N 2 0 400.542 4.359 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](CCSc3cc(Cl)ccc3Cl)CC2)CC1 ZINC000544494265 940456193 /nfs/dbraw/zinc/45/61/93/940456193.db2.gz TYXMWCHFIXZJMZ-UHFFFAOYSA-N 2 0 416.462 4.435 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]C/C=C\c2ccc(F)cc2F)c1)C1CCOCC1 ZINC000544607779 940489749 /nfs/dbraw/zinc/48/97/49/940489749.db2.gz DRJAISKAZIGCLO-HYXAFXHYSA-N 2 0 416.512 4.257 20 0 HIADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000544621673 940492564 /nfs/dbraw/zinc/49/25/64/940492564.db2.gz FTZBMZQFVORECR-HXUWFJFHSA-N 2 0 422.617 4.287 20 0 HIADRP C[NH+](C)CCOc1cccc(-c2noc([C@H]3CCC[N@H+](Cc4cccc(F)c4)C3)n2)c1 ZINC000544767645 940512406 /nfs/dbraw/zinc/51/24/06/940512406.db2.gz BPBPEIOPEFUXIX-FQEVSTJZSA-N 2 0 424.520 4.196 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)C[C@H](C)O1 ZINC000544828913 940517972 /nfs/dbraw/zinc/51/79/72/940517972.db2.gz COQCUMBTAUBXBK-YYDVJCTNSA-N 2 0 401.982 4.498 20 0 HIADRP C[NH+](C)Cc1cc(-c2noc([C@@H]3CCC[N@H+](Cc4cccc(F)c4)C3)n2)ccc1F ZINC000545024074 940534461 /nfs/dbraw/zinc/53/44/61/940534461.db2.gz NJKVXRMHGKSUTK-GOSISDBHSA-N 2 0 412.484 4.456 20 0 HIADRP c1ccc2c(c1)CO[C@@]21CC[NH+](CCCC[N@@H+]2CC[C@]3(C2)OCc2ccccc23)C1 ZINC000545329010 940562098 /nfs/dbraw/zinc/56/20/98/940562098.db2.gz QVQKYAJOMMIYIF-CLJLJLNGSA-N 2 0 404.554 4.029 20 0 HIADRP C[NH+](C)CCOc1ccccc1-c1noc([C@H]2CCC[N@H+](Cc3ccccc3)C2)n1 ZINC000547109752 941000370 /nfs/dbraw/zinc/00/03/70/941000370.db2.gz NVXLSBXXCQRLQV-FQEVSTJZSA-N 2 0 406.530 4.057 20 0 HIADRP C[C@@H]([NH2+]Cc1cc(Cl)ccc1N1CCOCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547393208 941060441 /nfs/dbraw/zinc/06/04/41/941060441.db2.gz FMFLBEJMIKSLLS-TZIWHRDSSA-N 2 0 413.993 4.177 20 0 HIADRP CC(C)[NH+]1CCC(C(=O)N[C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000549618031 941201539 /nfs/dbraw/zinc/20/15/39/941201539.db2.gz WOIQTLHBPYDQNX-XGBAPZKQSA-N 2 0 418.025 4.491 20 0 HIADRP CC[NH+](CC)CCN(C(=O)c1ccc2c[nH+]cn2c1)c1cccc(Br)c1 ZINC000550565352 941339895 /nfs/dbraw/zinc/33/98/95/941339895.db2.gz VPDVNVWSGYOXTM-UHFFFAOYSA-N 2 0 415.335 4.085 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCC(C)CC2)CC1 ZINC000550707387 941356799 /nfs/dbraw/zinc/35/67/99/941356799.db2.gz SBNVQBOIVHMPPO-DEOSSOPVSA-N 2 0 414.638 4.221 20 0 HIADRP COc1cc([C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)ccc1F ZINC000550883435 941378826 /nfs/dbraw/zinc/37/88/26/941378826.db2.gz ZNWSFCMCFZUQKN-UGKGYDQZSA-N 2 0 412.549 4.414 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCCn2cc(Br)cn2)CC1 ZINC000550901423 941380786 /nfs/dbraw/zinc/38/07/86/941380786.db2.gz HPPNNDNLWKXYMO-UHFFFAOYSA-N 2 0 419.411 4.459 20 0 HIADRP O=C(C[NH2+][C@H]1CCCCC[C@H]1c1ccc(Cl)cc1)NC1CC[NH+](C2CC2)CC1 ZINC000551425230 941476196 /nfs/dbraw/zinc/47/61/96/941476196.db2.gz WUIFCBVYAWTFNV-VXKWHMMOSA-N 2 0 403.998 4.089 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+][C@@H]3CCC[C@H]3c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000551787870 941545502 /nfs/dbraw/zinc/54/55/02/941545502.db2.gz NSIOVEGMQVEVDK-FCHUYYIVSA-N 2 0 409.540 4.490 20 0 HIADRP CC[C@@H](C(=O)N(C)C[C@H]1CC[NH+](Cc2ccc(C)s2)C1)[N@H+](C)Cc1ccccc1 ZINC000552133759 941591001 /nfs/dbraw/zinc/59/10/01/941591001.db2.gz ROVZJDOPVNHAJW-GGAORHGYSA-N 2 0 413.631 4.247 20 0 HIADRP Cc1cc(C[NH+](C)C)cc(NC(=O)[C@@H]2C[N@H+](Cc3ccccc3)CCC2(F)F)c1 ZINC000552133139 941591406 /nfs/dbraw/zinc/59/14/06/941591406.db2.gz YTJMYDAHPVCGMO-NRFANRHFSA-N 2 0 401.501 4.153 20 0 HIADRP O[C@H](C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)COc1ccc2ccccc2c1 ZINC000552190262 941598870 /nfs/dbraw/zinc/59/88/70/941598870.db2.gz FSALOEQQCPVYHY-RUZDIDTESA-N 2 0 404.554 4.355 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC000553738224 941956073 /nfs/dbraw/zinc/95/60/73/941956073.db2.gz MDWMPSFJHNEDAW-UHFFFAOYSA-N 2 0 422.573 4.205 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000554388750 942122453 /nfs/dbraw/zinc/12/24/53/942122453.db2.gz DIBAXEUHENVZGS-HYBUGGRVSA-N 2 0 408.590 4.289 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1cccc2ccccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554448658 942147546 /nfs/dbraw/zinc/14/75/46/942147546.db2.gz ZWUKMKDWEKYUFF-TUACAJSNSA-N 2 0 404.554 4.080 20 0 HIADRP COCCOCc1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)cc1 ZINC000554852864 942289389 /nfs/dbraw/zinc/28/93/89/942289389.db2.gz DYYXHGHPEDRERS-AREMUKBSSA-N 2 0 408.586 4.338 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000555010395 942354702 /nfs/dbraw/zinc/35/47/02/942354702.db2.gz ABYMGXZHJNHRLF-UHFFFAOYSA-N 2 0 417.597 4.411 20 0 HIADRP C[C@@H]1C[N@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000555341340 942485127 /nfs/dbraw/zinc/48/51/27/942485127.db2.gz AFSXGMOAOLWJHI-CLOONOSVSA-N 2 0 413.556 4.055 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3conc3Cc3ccccc3)CC2)cc1 ZINC000555532801 942630225 /nfs/dbraw/zinc/63/02/25/942630225.db2.gz CMIZIHLICWLIGF-UHFFFAOYSA-N 2 0 405.542 4.276 20 0 HIADRP COc1ccc(C[C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000556233803 942824116 /nfs/dbraw/zinc/82/41/16/942824116.db2.gz SVNGKMDRCHVFGJ-XUZZJYLKSA-N 2 0 408.586 4.145 20 0 HIADRP C[C@H](C[NH2+][C@H](c1sccc1Br)C1CCCCC1)N1CC[NH+](C)CC1 ZINC000556584295 942907281 /nfs/dbraw/zinc/90/72/81/942907281.db2.gz UCCUCUJVQDBUKU-QAPCUYQASA-N 2 0 414.457 4.358 20 0 HIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3cnc(-c4ccc(Cl)cc4)s3)C2)CC1 ZINC000556598112 942910275 /nfs/dbraw/zinc/91/02/75/942910275.db2.gz FQYWBRNOZFSFAZ-LJQANCHMSA-N 2 0 405.011 4.064 20 0 HIADRP c1ncn(-c2ccc(C[NH2+][C@H]3CCCC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)cc2)n1 ZINC000556869876 942944569 /nfs/dbraw/zinc/94/45/69/942944569.db2.gz ACAYGRYXCUVMLZ-HVCNVCAESA-N 2 0 401.558 4.048 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)cc1 ZINC000557640808 943245572 /nfs/dbraw/zinc/24/55/72/943245572.db2.gz MCLPFUYEULQDKW-SANMLTNESA-N 2 0 405.586 4.267 20 0 HIADRP c1ccc(C[C@H]2CCC[NH+]2CC2(C[N@H+]3CCC[C@@H]3Cc3ccccc3)COC2)cc1 ZINC000558604564 943615089 /nfs/dbraw/zinc/61/50/89/943615089.db2.gz SQOUEGOGERCJRT-CLJLJLNGSA-N 2 0 404.598 4.417 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000558781509 943661308 /nfs/dbraw/zinc/66/13/08/943661308.db2.gz UJEHADZZYLHGQG-XXBNENTESA-N 2 0 403.574 4.274 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000558970610 943776253 /nfs/dbraw/zinc/77/62/53/943776253.db2.gz KPXKZBRRSACILH-NJDAHSKKSA-N 2 0 407.396 4.184 20 0 HIADRP C[N@@H+]1CCCC[C@H]1CC[NH2+]C1(Cc2ccc(F)cc2Br)CCOCC1 ZINC000559266547 943887814 /nfs/dbraw/zinc/88/78/14/943887814.db2.gz GVDXNYFMALQYOQ-SFHVURJKSA-N 2 0 413.375 4.144 20 0 HIADRP CC[NH+](CC)CCC[NH2+]C1(Cc2ccc(F)cc2Br)CCOCC1 ZINC000559266647 943887911 /nfs/dbraw/zinc/88/79/11/943887911.db2.gz CFRRGPPADXPASI-UHFFFAOYSA-N 2 0 401.364 4.001 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+]Cc3ccccc3OCC3CC3)C3(C2)CCOCC3)cc1 ZINC000559327252 943897175 /nfs/dbraw/zinc/89/71/75/943897175.db2.gz YTZDPDLQEROJKL-VWLOTQADSA-N 2 0 420.597 4.494 20 0 HIADRP CSc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)s1 ZINC000559326339 943897304 /nfs/dbraw/zinc/89/73/04/943897304.db2.gz HDBGSAAVDBIWAM-IBGZPJMESA-N 2 0 402.629 4.488 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2C[NH+](C(C)(C)C)C[C@H]2C(F)(F)F)C1 ZINC000559825599 944061198 /nfs/dbraw/zinc/06/11/98/944061198.db2.gz YWJFYZDASKXZAB-INDMIFKZSA-N 2 0 417.560 4.008 20 0 HIADRP COc1cccc2c1CC[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)C2 ZINC000559891075 944076716 /nfs/dbraw/zinc/07/67/16/944076716.db2.gz NAZJQDMPOQBEMH-DNQXCXABSA-N 2 0 420.597 4.071 20 0 HIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CCC(=O)N2CCCCC2)c2ccc(F)cc2)CC1 ZINC000559921523 944085522 /nfs/dbraw/zinc/08/55/22/944085522.db2.gz LATRVUUZQWCASV-HSZRJFAPSA-N 2 0 403.586 4.371 20 0 HIADRP Ic1cccc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000560060443 944144746 /nfs/dbraw/zinc/14/47/46/944144746.db2.gz OVCCNVOHMWZCPC-UHFFFAOYSA-N 2 0 406.311 4.177 20 0 HIADRP CCS(=O)(=O)c1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000560266432 944212128 /nfs/dbraw/zinc/21/21/28/944212128.db2.gz XYXAFYHUSXQLCU-NNMXDRDESA-N 2 0 400.588 4.041 20 0 HIADRP CC(C)Cc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c1 ZINC000560530488 944245049 /nfs/dbraw/zinc/24/50/49/944245049.db2.gz PKRZKJQMCADKHY-CPJSRVTESA-N 2 0 407.602 4.433 20 0 HIADRP C[C@H](C(=O)NC12CC3CC(CC(C3)C1)C2)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000560823163 944346325 /nfs/dbraw/zinc/34/63/25/944346325.db2.gz MJNCNBNHLQUJDP-PXLFARDKSA-N 2 0 424.633 4.093 20 0 HIADRP CC[C@H]([NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)c1cccc(Cl)c1 ZINC000561081256 944435865 /nfs/dbraw/zinc/43/58/65/944435865.db2.gz GDBKVWDHRJLNNP-QHCPKHFHSA-N 2 0 413.993 4.470 20 0 HIADRP CSc1ccccc1NC(=O)CC[N@@H+]1C[C@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000562061169 944918003 /nfs/dbraw/zinc/91/80/03/944918003.db2.gz GCANIDHZRKMRTD-NHCUHLMSSA-N 2 0 409.599 4.191 20 0 HIADRP Cc1ccc([C@@H]([NH2+]CCCCC[NH+]2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000564311578 945510698 /nfs/dbraw/zinc/51/06/98/945510698.db2.gz FYGLZNIUSZRZHS-XMMPIXPASA-N 2 0 414.615 4.344 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H](c1ccc(Br)s1)C1CC1 ZINC000564366929 945532218 /nfs/dbraw/zinc/53/22/18/945532218.db2.gz CEKFKNWLNJMZOL-SFHVURJKSA-N 2 0 410.381 4.087 20 0 HIADRP CC(C)[NH+](Cc1ccc(NC(=O)N[C@@H](C)C[N@H+](C)C(C)C)cc1)C[C@@H]1CCCCO1 ZINC000564370821 945536388 /nfs/dbraw/zinc/53/63/88/945536388.db2.gz OCKCBJXVNFFJRN-REWPJTCUSA-N 2 0 418.626 4.316 20 0 HIADRP Cc1cccc(C)c1NC(=O)CCC[N@@H+]1C[C@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000564402565 945556076 /nfs/dbraw/zinc/55/60/76/945556076.db2.gz CPGFOBBHUAVUCR-RPWUZVMVSA-N 2 0 405.586 4.476 20 0 HIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000565379155 945819684 /nfs/dbraw/zinc/81/96/84/945819684.db2.gz WTEXCWAUGYJPQH-UFYCRDLUSA-N 2 0 400.485 4.394 20 0 HIADRP Cc1ccc(CN2CC[C@H]([NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)C2=O)cc1 ZINC000565672181 945863292 /nfs/dbraw/zinc/86/32/92/945863292.db2.gz YQOGAUHLCXLGRO-STEQJIOHSA-N 2 0 405.586 4.129 20 0 HIADRP CSc1ccc([C@H](CNC(=O)c2oc3ccccc3c2C[NH+](C)C)[NH+](C)C)cc1 ZINC000565914600 945919140 /nfs/dbraw/zinc/91/91/40/945919140.db2.gz MLQPNUXSWDHOCT-FQEVSTJZSA-N 2 0 411.571 4.249 20 0 HIADRP C[C@@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000566996641 946207433 /nfs/dbraw/zinc/20/74/33/946207433.db2.gz JNPCZUGJKNAMIY-HUUCEWRRSA-N 2 0 412.361 4.274 20 0 HIADRP CCOc1c(Br)cc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1OC ZINC000567280632 946288954 /nfs/dbraw/zinc/28/89/54/946288954.db2.gz MGVPKFJAWKFWPY-KRWDZBQOSA-N 2 0 411.384 4.020 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000568017955 946443968 /nfs/dbraw/zinc/44/39/68/946443968.db2.gz YHPZPIFDFPEYNH-IFMALSPDSA-N 2 0 408.590 4.289 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000568304698 946496013 /nfs/dbraw/zinc/49/60/13/946496013.db2.gz FPVDBYRWIAOEDZ-ZJSXRUAMSA-N 3 0 407.602 4.160 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NC[C@H](c2ccc(CC(C)C)cc2)[NH+](C)C)CC1 ZINC000569282622 946849205 /nfs/dbraw/zinc/84/92/05/946849205.db2.gz GCYSQYVCDTWMAE-RUZDIDTESA-N 2 0 422.617 4.224 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000569627779 946899438 /nfs/dbraw/zinc/89/94/38/946899438.db2.gz WKPIUFILUUIPNU-FIKGOQFSSA-N 2 0 419.491 4.135 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(F)cc2Br)[C@H](C)C1 ZINC000570480027 947261155 /nfs/dbraw/zinc/26/11/55/947261155.db2.gz NHBBMNXOTGMGPC-QINHECLXSA-N 2 0 415.391 4.246 20 0 HIADRP C[C@@H]1CN(c2ccccc2C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)CCO1 ZINC000570587588 947304880 /nfs/dbraw/zinc/30/48/80/947304880.db2.gz ZQUZNOSFKMWPHW-FCHUYYIVSA-N 2 0 407.602 4.433 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@H]2C)CC1 ZINC000570949335 947396208 /nfs/dbraw/zinc/39/62/08/947396208.db2.gz DSJMHDYSTDZAEL-OFNKIYASSA-N 2 0 423.576 4.093 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](NC[C@H]2CCCC[NH+](Cc3ccccc3)C2)[C@H](C)C1 ZINC000571573405 947708509 /nfs/dbraw/zinc/70/85/09/947708509.db2.gz QRZCYQVJRMADAI-GPXOXTDOSA-N 2 0 401.639 4.015 20 0 HIADRP C[NH+]1CCN(C[C@H]([NH2+][C@H]2CCc3ccc(Br)cc32)c2ccccc2)CC1 ZINC000571890343 947807068 /nfs/dbraw/zinc/80/70/68/947807068.db2.gz POHRAEZEEJQDGX-VXKWHMMOSA-N 2 0 414.391 4.015 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CCc2c1cc(Br)cc2F ZINC000572278735 947874981 /nfs/dbraw/zinc/87/49/81/947874981.db2.gz ABEAMFXYZAPFHK-LJQANCHMSA-N 2 0 422.342 4.091 20 0 HIADRP CC1CC[NH+](CCCC[NH2+]Cc2c(Br)cncc2Br)CC1 ZINC000572417019 947898269 /nfs/dbraw/zinc/89/82/69/947898269.db2.gz PYWIYNYXBOKYNN-UHFFFAOYSA-N 2 0 419.205 4.208 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1ccc(-n2cnc3ccccc32)cc1 ZINC000573161717 948095343 /nfs/dbraw/zinc/09/53/43/948095343.db2.gz FPXXGGYIMUBWQB-UHFFFAOYSA-N 2 0 415.541 4.041 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000573214973 948109188 /nfs/dbraw/zinc/10/91/88/948109188.db2.gz QONFDMYUFKMOKW-QFIPXVFZSA-N 2 0 410.949 4.144 20 0 HIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000573645604 948264278 /nfs/dbraw/zinc/26/42/78/948264278.db2.gz ISDXEFCMFYDLTE-UHFFFAOYSA-N 3 0 408.634 4.301 20 0 HIADRP C[C@@H](Cc1ccc(F)cc1Br)[NH2+]Cc1ccncc1OCCC[NH+](C)C ZINC000573671637 948272200 /nfs/dbraw/zinc/27/22/00/948272200.db2.gz SLIKYRVKWBHCLM-HNNXBMFYSA-N 2 0 424.358 4.035 20 0 HIADRP C[NH+](C)C1CCN(c2ccc(N[C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)nc2)CC1 ZINC000574715841 948510198 /nfs/dbraw/zinc/51/01/98/948510198.db2.gz QIJVRPZBFSARRU-VILGAWFOSA-N 2 0 419.617 4.220 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H](CO)Cc2ccc(F)c(F)c2)CC1 ZINC000575820154 948723363 /nfs/dbraw/zinc/72/33/63/948723363.db2.gz RITBOMANVXXICC-HWELCPFYSA-N 2 0 402.529 4.149 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3c[nH]nc3-c3cccs3)CC2)c1 ZINC000030633155 847748610 /nfs/dbraw/zinc/74/86/10/847748610.db2.gz YJZFLEQFJALUPT-UHFFFAOYSA-N 2 0 409.603 4.139 20 0 HIADRP Cc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000030907261 847795956 /nfs/dbraw/zinc/79/59/56/847795956.db2.gz BFKFXCRDMOCLTN-QFIPXVFZSA-N 2 0 400.570 4.481 20 0 HIADRP COc1ccccc1C[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000030913920 847797032 /nfs/dbraw/zinc/79/70/32/847797032.db2.gz UYMQUOCJSUSKKX-UHFFFAOYSA-N 2 0 401.554 4.307 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)NCc2ccccc2C[NH+]2CCCC2)c1 ZINC000045192092 848645125 /nfs/dbraw/zinc/64/51/25/848645125.db2.gz HLXNVTKOCOWHHZ-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C(=O)Nc1ccccc1OC(F)F ZINC000053140099 849670688 /nfs/dbraw/zinc/67/06/88/849670688.db2.gz WVCLBKFINKSSEI-QGZVFWFLSA-N 2 0 417.500 4.391 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C(=O)Nc1ccccc1OC(F)F ZINC000053140095 849671155 /nfs/dbraw/zinc/67/11/55/849671155.db2.gz WVCLBKFINKSSEI-KRWDZBQOSA-N 2 0 417.500 4.391 20 0 HIADRP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000058614802 850868331 /nfs/dbraw/zinc/86/83/31/850868331.db2.gz LTQYGPHIBNBXKR-ROUUACIJSA-N 2 0 418.632 4.083 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N2CCC(C[NH+]3CCCCCC3)CC2)cc1 ZINC000058879148 850949925 /nfs/dbraw/zinc/94/99/25/850949925.db2.gz DMOWTOCSMBTTOO-UHFFFAOYSA-N 2 0 415.622 4.135 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CCC[N@@H+](C(C)(C)C)CC2)cc1 ZINC000060536390 851137898 /nfs/dbraw/zinc/13/78/98/851137898.db2.gz KSSUWWZFJHPYPT-UHFFFAOYSA-N 2 0 422.617 4.431 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC000060566648 851149599 /nfs/dbraw/zinc/14/95/99/851149599.db2.gz QYPHOVOQIDHWET-UHFFFAOYSA-N 2 0 414.638 4.374 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NCc2cccc(C[NH+](C)C)c2)cc1 ZINC000061867817 851463037 /nfs/dbraw/zinc/46/30/37/851463037.db2.gz MAUYXLAJPTXEIT-HXUWFJFHSA-N 2 0 408.590 4.122 20 0 HIADRP Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000062252968 851516800 /nfs/dbraw/zinc/51/68/00/851516800.db2.gz QKOSJPXMJITHGH-IRXDYDNUSA-N 2 0 422.976 4.011 20 0 HIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2cc(Cl)ccc2OCc2cccnc2)C[C@H](C)O1 ZINC000062252859 851517010 /nfs/dbraw/zinc/51/70/10/851517010.db2.gz PYXPRRAZTSFRTN-OALUTQOASA-N 2 0 417.981 4.293 20 0 HIADRP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)NC1CC[NH+](CC2CCCCC2)CC1 ZINC000062529367 851571180 /nfs/dbraw/zinc/57/11/80/851571180.db2.gz NDJVVVPIFRVVTI-NRFANRHFSA-N 2 0 418.651 4.229 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cccc(Br)c3)CC2)cc1 ZINC000063319623 851658677 /nfs/dbraw/zinc/65/86/77/851658677.db2.gz OLMNECCBJVTIDK-UHFFFAOYSA-N 2 0 403.364 4.460 20 0 HIADRP Cc1cc[n+](C(C(=O)c2cc(C)c(C)c(C)c2C)C(=S)NC2CC[NH+](C)CC2)cc1 ZINC000063441722 851691055 /nfs/dbraw/zinc/69/10/55/851691055.db2.gz YVEQBBCXVSVSHR-UHFFFAOYSA-O 2 0 424.634 4.139 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)CC1 ZINC000064237832 851855153 /nfs/dbraw/zinc/85/51/53/851855153.db2.gz MVWKSMNKYMGEFT-UHFFFAOYSA-N 2 0 414.638 4.374 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000064754527 851977828 /nfs/dbraw/zinc/97/78/28/851977828.db2.gz PKVKSRRCYYFARU-QHAWAJNXSA-N 2 0 420.667 4.017 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)N[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000065442466 852135486 /nfs/dbraw/zinc/13/54/86/852135486.db2.gz SSLIWKWPUIGVLV-UNMCSNQZSA-N 2 0 424.589 4.364 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H](c2ccccc2OC)[NH+]2CCCC2)cc1)C(C)C ZINC000110172333 853069159 /nfs/dbraw/zinc/06/91/59/853069159.db2.gz JGECWMPHCFINKW-XMMPIXPASA-N 2 0 423.601 4.492 20 0 HIADRP C[C@@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000110429914 853098872 /nfs/dbraw/zinc/09/88/72/853098872.db2.gz LTINTSUNAQJXEK-BBWFWOEESA-N 2 0 400.485 4.467 20 0 HIADRP C[NH+](C)CCc1ccc(NC(=O)[C@@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000110867359 853159232 /nfs/dbraw/zinc/15/92/32/853159232.db2.gz PYRXYBJJYGOEJJ-JOCHJYFZSA-N 2 0 419.491 4.184 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NC[C@H](c1ccccc1OC)[NH+]1CCCC1)c1ccccc1 ZINC000111075256 853198000 /nfs/dbraw/zinc/19/80/00/853198000.db2.gz KKEHNWTXOMPPQS-ISKFKSNPSA-N 2 0 409.574 4.031 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)NCCC[NH+]1CCCCC1)C1CCCCC1 ZINC000195556987 853682537 /nfs/dbraw/zinc/68/25/37/853682537.db2.gz MZLGZXYJZQXAGX-UHFFFAOYSA-N 2 0 400.611 4.126 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2ccc(OC)c3ccccc23)CC1 ZINC000195600009 853706357 /nfs/dbraw/zinc/70/63/57/853706357.db2.gz UROOAHPIQFQLRI-UHFFFAOYSA-N 2 0 403.570 4.276 20 0 HIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000228926334 853890865 /nfs/dbraw/zinc/89/08/65/853890865.db2.gz LTINTSUNAQJXEK-IXDOHACOSA-N 2 0 400.485 4.467 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]C[C@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000236813977 853925411 /nfs/dbraw/zinc/92/54/11/853925411.db2.gz KYCYWTLEHUTGJH-AOYPEHQESA-N 2 0 407.602 4.476 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cn(-c3ccccc3)nc2C)CC1 ZINC000236851550 853928843 /nfs/dbraw/zinc/92/88/43/853928843.db2.gz QIHGJAGIIIEOOL-HXUWFJFHSA-N 2 0 421.564 4.313 20 0 HIADRP CCCOc1c(Cl)cc(C[NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)cc1OCC ZINC000236906177 853935239 /nfs/dbraw/zinc/93/52/39/853935239.db2.gz WBCZAHLSQDEEQF-UHFFFAOYSA-N 2 0 424.029 4.176 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1 ZINC000236972383 853944500 /nfs/dbraw/zinc/94/45/00/853944500.db2.gz OFMDGOVDOOXKPJ-SFHVURJKSA-N 2 0 418.029 4.074 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(OCC(F)F)cc2)CC1 ZINC000236982138 853946594 /nfs/dbraw/zinc/94/65/94/853946594.db2.gz SZYXTCLDJSWHFG-QGZVFWFLSA-N 2 0 421.507 4.462 20 0 HIADRP CCN(CC)c1ncc(C[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)s1 ZINC000236985928 853947277 /nfs/dbraw/zinc/94/72/77/853947277.db2.gz VVSAWGKOQHHIEE-KRWDZBQOSA-N 2 0 419.614 4.121 20 0 HIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccnc2)ccc1F ZINC000237077529 853960851 /nfs/dbraw/zinc/96/08/51/853960851.db2.gz PMRIACBJKGJQLA-UHFFFAOYSA-N 2 0 415.516 4.425 20 0 HIADRP CCc1oc2ccccc2c1C[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000237096109 853964150 /nfs/dbraw/zinc/96/41/50/853964150.db2.gz HVQITELMPYEABU-UHFFFAOYSA-N 2 0 405.542 4.111 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[NH2+]C4C[C@H]5CCC[C@@H](C4)[N@H+]5C)cc3)nc12 ZINC000237099959 853964447 /nfs/dbraw/zinc/96/44/47/853964447.db2.gz VMIJDDOFYYVFBX-BRTIRZTQSA-N 2 0 404.558 4.327 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000237173146 853975438 /nfs/dbraw/zinc/97/54/38/853975438.db2.gz IMTYLFQUTBYHKL-UHFFFAOYSA-N 2 0 401.982 4.036 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+]Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000237192220 853978902 /nfs/dbraw/zinc/97/89/02/853978902.db2.gz NOLBUVBVHYPQBF-UHFFFAOYSA-N 2 0 418.463 4.121 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2ccc(Cl)s2)CC1 ZINC000237233279 853987475 /nfs/dbraw/zinc/98/74/75/853987475.db2.gz XJAPVVANXPKYQI-UHFFFAOYSA-N 2 0 403.901 4.462 20 0 HIADRP COc1cc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)ccc1OCc1c(C)noc1C ZINC000237256377 853992129 /nfs/dbraw/zinc/99/21/29/853992129.db2.gz DVSICWDBGWFAJP-KRWDZBQOSA-N 2 0 401.551 4.091 20 0 HIADRP Cc1nn(C)c2ncc(C[NH2+]CCCC[NH+]3CCC(Cc4ccccc4)CC3)cc12 ZINC000237887836 854115764 /nfs/dbraw/zinc/11/57/64/854115764.db2.gz LMHGTRUBTMJFOP-UHFFFAOYSA-N 2 0 405.590 4.101 20 0 HIADRP C[C@H](C(=O)NCc1ccccc1Cl)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000303210371 854818573 /nfs/dbraw/zinc/81/85/73/854818573.db2.gz RCQPHEDRKYSCRT-LJQANCHMSA-N 2 0 413.993 4.189 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000303212989 854819194 /nfs/dbraw/zinc/81/91/94/854819194.db2.gz PJMGECHNDSBDEE-JOCHJYFZSA-N 2 0 414.638 4.182 20 0 HIADRP C[C@H](C(=O)NC(c1ccccc1)c1ccccc1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000303215694 854820501 /nfs/dbraw/zinc/82/05/01/854820501.db2.gz SZIYMXACFSQNGK-OAQYLSRUSA-N 2 0 405.586 4.089 20 0 HIADRP C[C@@H]([NH2+]C1CCC(NC(=O)OC(C)(C)C)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309722478 855364569 /nfs/dbraw/zinc/36/45/69/855364569.db2.gz OGLDSAHXOGJMBA-UREXAPBRSA-N 2 0 401.595 4.323 20 0 HIADRP C[C@@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309805434 855365116 /nfs/dbraw/zinc/36/51/16/855365116.db2.gz UFGNIXHSRZCZCL-WKDRNLAYSA-N 2 0 401.595 4.132 20 0 HIADRP CC(C)(C)OC(=O)N1CCC(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000390733179 855456394 /nfs/dbraw/zinc/45/63/94/855456394.db2.gz ZCFMVROUBWVMSE-JOCHJYFZSA-N 2 0 401.595 4.135 20 0 HIADRP C[C@H]([NH2+]CC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000393945851 855468817 /nfs/dbraw/zinc/46/88/17/855468817.db2.gz QOOZLZHDBGGVTL-SIKLNZKXSA-N 2 0 401.595 4.134 20 0 HIADRP CC(C)(C)OC(=O)N1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000397493414 855471590 /nfs/dbraw/zinc/47/15/90/855471590.db2.gz BQIBQEPRFKZCSA-JOCHJYFZSA-N 2 0 401.595 4.278 20 0 HIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1cccc(Br)c1 ZINC000397504508 855472777 /nfs/dbraw/zinc/47/27/77/855472777.db2.gz BUKPTRDMSJKHAF-QGZVFWFLSA-N 2 0 403.364 4.127 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCN(C(=O)OC(C)(C)C)CC1 ZINC000398047821 855474980 /nfs/dbraw/zinc/47/49/80/855474980.db2.gz WLNSKVCSXKPDTR-UGKGYDQZSA-N 2 0 401.595 4.134 20 0 HIADRP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CN1C(=O)OC(C)(C)C ZINC000399026199 855477603 /nfs/dbraw/zinc/47/76/03/855477603.db2.gz JIPKRDBNTGUUMI-FCEUIQTBSA-N 2 0 401.595 4.276 20 0 HIADRP C[C@@H]1CC[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CN1C(=O)OC(C)(C)C ZINC000399221212 855478601 /nfs/dbraw/zinc/47/86/01/855478601.db2.gz BYXNPBRLQYBLES-KNQAVFIVSA-N 2 0 401.595 4.276 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)CC1 ZINC000410337321 855936163 /nfs/dbraw/zinc/93/61/63/855936163.db2.gz NIDFESBLAPNIBA-QFIPXVFZSA-N 2 0 414.638 4.372 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)cc1 ZINC000410336896 855936567 /nfs/dbraw/zinc/93/65/67/855936567.db2.gz KFQLKXVIEZTAME-PGRDOPGGSA-N 2 0 414.619 4.225 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N(CC[NH+](C)C)Cc2ccccc2)cc1 ZINC000410345514 855940287 /nfs/dbraw/zinc/94/02/87/855940287.db2.gz QDDPXYBWBITPPK-JOCHJYFZSA-N 2 0 422.617 4.334 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NCCC[NH2+]C2CCCCC2)cc1 ZINC000410345401 855940777 /nfs/dbraw/zinc/94/07/77/855940777.db2.gz QUKNOQKZSPCWPJ-FQEVSTJZSA-N 2 0 400.611 4.173 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)Nc2cccc(OCC[NH+](C)C)c2)cc1 ZINC000410347506 855941625 /nfs/dbraw/zinc/94/16/25/855941625.db2.gz OMKRZTLWDKYQMG-HXUWFJFHSA-N 2 0 424.589 4.323 20 0 HIADRP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)NCCCC[N@H+]2CCC[C@H](C)C2)C1 ZINC000410362891 855951468 /nfs/dbraw/zinc/95/14/68/855951468.db2.gz ZFJAHKNTPVDQDW-FCHUYYIVSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H]1CCC[NH+](Cc2ccccc2CNC(=O)NCCCC[N@H+]2CCC[C@H](C)C2)C1 ZINC000410362896 855951512 /nfs/dbraw/zinc/95/15/12/855951512.db2.gz ZFJAHKNTPVDQDW-VXKWHMMOSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000410366019 855954078 /nfs/dbraw/zinc/95/40/78/855954078.db2.gz FXWIKQNSLOCJJW-REWPJTCUSA-N 2 0 424.589 4.148 20 0 HIADRP COc1ccc(CC[C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1O ZINC000426357818 856258635 /nfs/dbraw/zinc/25/86/35/856258635.db2.gz FICZIQZTNRDWHC-XUVXKRRUSA-N 2 0 412.574 4.121 20 0 HIADRP Cc1ccc(-c2nnc([C@H](C)[NH+]3CCC(CC[NH+]4C[C@H](C)O[C@@H](C)C4)CC3)o2)cc1 ZINC000426788217 856478230 /nfs/dbraw/zinc/47/82/30/856478230.db2.gz LFAJYWHQJDTVFY-UFYCRDLUSA-N 2 0 412.578 4.317 20 0 HIADRP Cc1ccc([C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)C2CCC2)cc1 ZINC000427694479 856911590 /nfs/dbraw/zinc/91/15/90/856911590.db2.gz JJDKJRUKEZNLPM-LOSJGSFVSA-N 2 0 405.586 4.323 20 0 HIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c1)CCS2 ZINC000427693758 856911635 /nfs/dbraw/zinc/91/16/35/856911635.db2.gz GTOHOGAYHCNSFD-GMAHTHKFSA-N 2 0 423.626 4.327 20 0 HIADRP COc1ccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1NC(C)=O ZINC000428246834 857125455 /nfs/dbraw/zinc/12/54/55/857125455.db2.gz ZCRGYUSESJKCKL-WXFUMESZSA-N 2 0 421.585 4.434 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000428260416 857131295 /nfs/dbraw/zinc/13/12/95/857131295.db2.gz LJFCUEQWBUXPDY-OFVILXPXSA-N 2 0 422.617 4.381 20 0 HIADRP c1ccc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)c(C[NH+]2CCOC[C@@H](C3CCC3)C2)c1 ZINC000429262584 857580679 /nfs/dbraw/zinc/58/06/79/857580679.db2.gz URJLHBYZVHTLLC-UIOOFZCWSA-N 2 0 412.618 4.184 20 0 HIADRP Cc1oc(-c2cccs2)nc1C[N@@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430928318 858372964 /nfs/dbraw/zinc/37/29/64/858372964.db2.gz SVZMXCIDVSAXLF-UHFFFAOYSA-N 2 0 416.635 4.340 20 0 HIADRP CN(CCC1CC[NH+](C2CCN(C)CC2)CC1)C(=O)Nc1ncc(C(C)(C)C)s1 ZINC000431177755 858488573 /nfs/dbraw/zinc/48/85/73/858488573.db2.gz ZBLZLMLTKSUBAZ-UHFFFAOYSA-N 2 0 421.655 4.101 20 0 HIADRP COc1ccc([C@@H](CNC(=O)C[C@@H](c2ccccc2)[NH+](C)C)[NH+]2CCCCC2)cc1 ZINC000431570948 858672928 /nfs/dbraw/zinc/67/29/28/858672928.db2.gz OZJISBPVJHUQPT-BJKOFHAPSA-N 2 0 409.574 4.031 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000431696607 858745379 /nfs/dbraw/zinc/74/53/79/858745379.db2.gz MAQAITJTIZKGSM-PXDATVDWSA-N 2 0 420.601 4.135 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)Nc1cccc(OCC[NH+](C)C)c1 ZINC000437735208 863063547 /nfs/dbraw/zinc/06/35/47/863063547.db2.gz RXHFLPSHHWUKNV-QFIPXVFZSA-N 2 0 424.589 4.003 20 0 HIADRP CC(C)c1nccn1Cc1cccc(NC(=O)N2CC[N@@H+](C3CCC3)C[C@@H](C)C2)c1 ZINC000432676784 859286363 /nfs/dbraw/zinc/28/63/63/859286363.db2.gz IBKPEANGJOBMIN-LJQANCHMSA-N 2 0 409.578 4.393 20 0 HIADRP C[C@@H](C(=O)N(C)Cc1cccc(F)c1)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433121051 859528951 /nfs/dbraw/zinc/52/89/51/859528951.db2.gz MDMLIZXJOKDYDZ-NRFANRHFSA-N 2 0 423.576 4.161 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(C(F)(F)F)cc1Cl ZINC000438060429 863431424 /nfs/dbraw/zinc/43/14/24/863431424.db2.gz WSAKJOLCIPZXLZ-HNNXBMFYSA-N 2 0 420.907 4.239 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC2CCCC2)c(F)c1 ZINC000438649083 864088615 /nfs/dbraw/zinc/08/86/15/864088615.db2.gz SIXSEFATHFCMBH-LJQANCHMSA-N 2 0 420.573 4.027 20 0 HIADRP C[C@@H]1CN(Cc2cccc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)c2)CCO1 ZINC000438834871 864328779 /nfs/dbraw/zinc/32/87/79/864328779.db2.gz VHEAEOYKVRFLGT-CFSFKAJLSA-N 2 0 421.629 4.440 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](c2ccc(Br)s2)C2CC2)C1 ZINC000439137635 864570606 /nfs/dbraw/zinc/57/06/06/864570606.db2.gz BAHAHZLAFTWPNW-YLJYHZDGSA-N 2 0 421.404 4.318 20 0 HIADRP COc1ccccc1NC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000439595504 864917809 /nfs/dbraw/zinc/91/78/09/864917809.db2.gz KCUUMASURTZPIA-GOSISDBHSA-N 2 0 407.514 4.037 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)cc1 ZINC000439734742 865067325 /nfs/dbraw/zinc/06/73/25/865067325.db2.gz QNOSGLVQBIHSMU-FQEVSTJZSA-N 2 0 408.590 4.269 20 0 HIADRP CC(C)C[C@@H](CNC(=O)N1CCC([NH+]2CCCCC2)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000468030716 881863411 /nfs/dbraw/zinc/86/34/11/881863411.db2.gz RBSYQYVFKQLLSZ-GGAORHGYSA-N 2 0 414.638 4.412 20 0 HIADRP CC(C)N(CC[NH+](C)C)C(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000440222140 865455908 /nfs/dbraw/zinc/45/59/08/865455908.db2.gz VXILPZQVUXKAIQ-UHFFFAOYSA-N 2 0 422.617 4.431 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000440535711 865808019 /nfs/dbraw/zinc/80/80/19/865808019.db2.gz SLLCICLYNBJYJZ-CLJLJLNGSA-N 2 0 419.613 4.269 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@H]3Cc4[nH]c5ccccc5c4C3)CC2)c1 ZINC000442722709 867648809 /nfs/dbraw/zinc/64/88/09/867648809.db2.gz WALYOJKEFBLAAR-OAQYLSRUSA-N 2 0 402.586 4.136 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+][C@H]3CC[C@@H](c4ccc(C(F)(F)F)cc4)C3)CC2)CC1 ZINC000442784108 867674226 /nfs/dbraw/zinc/67/42/26/867674226.db2.gz SJPCUJFMEPOYOY-NQIIRXRSSA-N 2 0 409.540 4.490 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+][C@H](c2ccc(Br)cc2Cl)C2CC2)CC1(C)C ZINC000442875284 867709227 /nfs/dbraw/zinc/70/92/27/867709227.db2.gz NSLRFUQHFLDATB-SFHVURJKSA-N 2 0 414.819 4.169 20 0 HIADRP O=C(NCc1ccco1)c1cccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000443586753 868142500 /nfs/dbraw/zinc/14/25/00/868142500.db2.gz AYZHCKTZFFTHKH-UHFFFAOYSA-N 2 0 409.574 4.298 20 0 HIADRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)C1 ZINC000443614346 868181361 /nfs/dbraw/zinc/18/13/61/868181361.db2.gz GKXRKGZHUYHYNQ-OAQYLSRUSA-N 2 0 402.970 4.038 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)Nc2ccccc2CC[NH+](C)C)CC1 ZINC000446562456 870474261 /nfs/dbraw/zinc/47/42/61/870474261.db2.gz BXEUWWDIJIGRHL-HXUWFJFHSA-N 2 0 400.611 4.299 20 0 HIADRP CC[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Br)cc1Cl ZINC000446819962 870734770 /nfs/dbraw/zinc/73/47/70/870734770.db2.gz WXCWZKJYUHUEEX-SFHVURJKSA-N 2 0 402.808 4.171 20 0 HIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)[NH2+]CCOCC[NH+](C)C ZINC000447592751 871497165 /nfs/dbraw/zinc/49/71/65/871497165.db2.gz NNIRWJHMQWSFDK-ZDUSSCGKSA-N 2 0 412.397 4.110 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000448208918 872107630 /nfs/dbraw/zinc/10/76/30/872107630.db2.gz MDRQRTONBNXOMH-UKILVPOCSA-N 2 0 424.633 4.221 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)[C@H](C)C1 ZINC000448524017 872516905 /nfs/dbraw/zinc/51/69/05/872516905.db2.gz CYFBAVYLVKSKMZ-URVUXULASA-N 2 0 400.611 4.022 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCCC2)cc1)N1C[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC000461432445 874476698 /nfs/dbraw/zinc/47/66/98/874476698.db2.gz UPKLJKXGOHNTHQ-UIOOFZCWSA-N 2 0 417.597 4.267 20 0 HIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(OCc3cn4cccc(C)c4n3)cc2)CC1 ZINC000462769459 875829125 /nfs/dbraw/zinc/82/91/25/875829125.db2.gz YYBGJTHANZNTKU-UHFFFAOYSA-N 2 0 406.574 4.433 20 0 HIADRP COc1ccccc1[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[NH+]1CCCC1 ZINC000463136379 876185479 /nfs/dbraw/zinc/18/54/79/876185479.db2.gz DJMDGDSBGUFQEW-PFATUAPWSA-N 2 0 407.602 4.475 20 0 HIADRP O=C(c1ccccc1)N1CCC(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000463242696 876298736 /nfs/dbraw/zinc/29/87/36/876298736.db2.gz NVXPWZUQRTUGEK-NXMIGULDSA-N 2 0 417.597 4.324 20 0 HIADRP COc1cccc([C@H]2[C@@H](NC3CC[NH+](CCc4ccccc4)CC3)CC[N@@H+]2C2CC2)c1 ZINC000463280359 876337652 /nfs/dbraw/zinc/33/76/52/876337652.db2.gz LNIYIHUFYOPNFH-SVBPBHIXSA-N 2 0 419.613 4.270 20 0 HIADRP COc1cccc([C@@H]2[C@@H](NC3CC[NH+](CCc4ccccc4)CC3)CC[N@@H+]2C2CC2)c1 ZINC000463280358 876338588 /nfs/dbraw/zinc/33/85/88/876338588.db2.gz LNIYIHUFYOPNFH-RRPNLBNLSA-N 2 0 419.613 4.270 20 0 HIADRP Cc1ccc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)c(-n2cc(Cl)cn2)n1 ZINC000468961592 883028060 /nfs/dbraw/zinc/02/80/60/883028060.db2.gz MVTXEBLLICPDSY-KRWDZBQOSA-N 2 0 413.953 4.020 20 0 HIADRP Cc1ccc([C@H](Cc2ccccc2Br)[NH2+]CC2(O)CC[NH+](C)CC2)cc1 ZINC000464057418 877200951 /nfs/dbraw/zinc/20/09/51/877200951.db2.gz GATPJRIDBUUMBR-NRFANRHFSA-N 2 0 417.391 4.088 20 0 HIADRP CC(C)C[N@@H+]1CC[C@H](CNC(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000464827305 878080714 /nfs/dbraw/zinc/08/07/14/878080714.db2.gz HCTFLRSLIKXPCQ-JOCHJYFZSA-N 2 0 422.617 4.192 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1Cl ZINC000465421549 878850563 /nfs/dbraw/zinc/85/05/63/878850563.db2.gz LEYISKZEYDSPOZ-RHXYGLJOSA-N 2 0 407.002 4.037 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NC[C@H](c2ccccc2Cl)[NH+](CC)CC)C1 ZINC000465421378 878851256 /nfs/dbraw/zinc/85/12/56/878851256.db2.gz KRKPBSUOYYEBLX-GHTZIAJQSA-N 2 0 409.018 4.096 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)N(C)CC[C@H]3CCCC[N@@H+]3C)cc2)C1 ZINC000465518995 878967073 /nfs/dbraw/zinc/96/70/73/878967073.db2.gz FORTZINZSBOOBD-PQNGQFLHSA-N 2 0 414.638 4.180 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@H](C1CCCCC1)[NH+](C)C ZINC000465533095 878990663 /nfs/dbraw/zinc/99/06/63/878990663.db2.gz IULGMQBBDVOEPO-ISKFKSNPSA-N 2 0 414.638 4.051 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000465639444 879154609 /nfs/dbraw/zinc/15/46/09/879154609.db2.gz UXZSIZCJCWOOFL-VWLOTQADSA-N 2 0 422.617 4.192 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000503433786 912436640 /nfs/dbraw/zinc/43/66/40/912436640.db2.gz KKBAPBVWOAZKAY-QFIPXVFZSA-N 2 0 414.638 4.324 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1 ZINC000465759967 879353787 /nfs/dbraw/zinc/35/37/87/879353787.db2.gz QDTADUXXGDYWPT-GGAORHGYSA-N 2 0 414.638 4.051 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCC(C)(C)[NH+]1CCC[C@H](C)C1 ZINC000465759969 879354464 /nfs/dbraw/zinc/35/44/64/879354464.db2.gz QDTADUXXGDYWPT-JTHBVZDNSA-N 2 0 414.638 4.051 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccco1 ZINC000465804651 879417105 /nfs/dbraw/zinc/41/71/05/879417105.db2.gz DXXLDEJYCGHXJW-DBXWQHBBSA-N 2 0 418.607 4.106 20 0 HIADRP CC[NH+]1CCC(CCNC(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)CC1 ZINC000465924469 879588115 /nfs/dbraw/zinc/58/81/15/879588115.db2.gz NRABSXOZZYGOIL-FQEVSTJZSA-N 2 0 400.611 4.071 20 0 HIADRP CCCN(C(=O)NCCC1CC[NH+](CC)CC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000466089912 879809372 /nfs/dbraw/zinc/80/93/72/879809372.db2.gz ABCSWELDIQIVOG-XMMPIXPASA-N 2 0 414.638 4.195 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000466507555 880282318 /nfs/dbraw/zinc/28/23/18/880282318.db2.gz XDZGUJNIEOTSQM-TYBLODHISA-N 2 0 420.601 4.174 20 0 HIADRP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000503505361 912553924 /nfs/dbraw/zinc/55/39/24/912553924.db2.gz TWXYLQJTACGLEE-SFTDATJTSA-N 2 0 418.651 4.183 20 0 HIADRP CC1CC[NH+](C[C@H]2CCCN(C(=O)NC[C@H](c3cccs3)[NH+]3CCCC3)C2)CC1 ZINC000503505337 912554183 /nfs/dbraw/zinc/55/41/83/912554183.db2.gz SYZUEZLHJTVSAE-NHCUHLMSSA-N 2 0 418.651 4.039 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](CC(=O)N(C2CCCCC2)C2CCCCC2)CC1 ZINC000466731592 880516787 /nfs/dbraw/zinc/51/67/87/880516787.db2.gz PTDLHIOTTORSBT-UHFFFAOYSA-N 2 0 421.670 4.303 20 0 HIADRP C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NC[C@@H]1CCC[NH+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000469538987 883806620 /nfs/dbraw/zinc/80/66/20/883806620.db2.gz AVLKCVZNCINSRY-HPNQWNLUSA-N 2 0 411.512 4.077 20 0 HIADRP CC(C)S(=O)(=O)c1ccc(C[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000469755423 883920341 /nfs/dbraw/zinc/92/03/41/883920341.db2.gz AHPVGCCGFGJRFB-GZOXUSKESA-N 2 0 414.615 4.115 20 0 HIADRP COc1ccc(C[C@H](C)C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)cc1F ZINC000469950882 884151617 /nfs/dbraw/zinc/15/16/17/884151617.db2.gz RWSUPWIPAPCQQB-FQEVSTJZSA-N 2 0 419.629 4.141 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC([NH+]2CCCC2)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000503691648 912797525 /nfs/dbraw/zinc/79/75/25/912797525.db2.gz YEXDTWPTELDWPU-HXUWFJFHSA-N 2 0 400.611 4.166 20 0 HIADRP CCC[NH+]1CCC(N(C)C(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)CC1 ZINC000503706031 912804387 /nfs/dbraw/zinc/80/43/87/912804387.db2.gz UIQIRGYEXHSGKW-FQEVSTJZSA-N 2 0 400.611 4.166 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)CC1 ZINC000503740815 912813764 /nfs/dbraw/zinc/81/37/64/912813764.db2.gz QQYQHVKIBVJNSN-OAQYLSRUSA-N 2 0 414.638 4.413 20 0 HIADRP CC[NH+](CC)Cc1ccc(NC(=O)c2ccc(N3CC[NH+](C(C)C)CC3)cc2)cc1 ZINC000470111711 884371040 /nfs/dbraw/zinc/37/10/40/884371040.db2.gz MMOUOKVITOVVDD-UHFFFAOYSA-N 2 0 408.590 4.311 20 0 HIADRP CC[NH+](CC)CCN(Cc1cccs1)C(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000470642159 885065526 /nfs/dbraw/zinc/06/55/26/885065526.db2.gz PZIFLBCXXHXZEH-UHFFFAOYSA-N 2 0 413.631 4.331 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)N(C)[C@H]2CCC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)o1 ZINC000470733650 885187851 /nfs/dbraw/zinc/18/78/51/885187851.db2.gz SWAQKANPRSKXBJ-XZOQPEGZSA-N 2 0 424.589 4.031 20 0 HIADRP O=C(CC[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1)Nc1c(Cl)cccc1Cl ZINC000471014367 885514292 /nfs/dbraw/zinc/51/42/92/885514292.db2.gz JTNJGFGYEVYOAD-HDICACEKSA-N 2 0 418.368 4.386 20 0 HIADRP CCN(C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000471375602 886018336 /nfs/dbraw/zinc/01/83/36/886018336.db2.gz ZGEFWEADBBNUKB-ACIOBRDBSA-N 2 0 424.589 4.284 20 0 HIADRP C[C@H](CCCCN1C(=O)c2ccccc2C1=O)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000471593798 886307003 /nfs/dbraw/zinc/30/70/03/886307003.db2.gz NBBWKYVCINOINK-LJQANCHMSA-N 2 0 411.590 4.086 20 0 HIADRP CCN(CCC[NH+]1CCCC1)C(=O)NCc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000472097883 886891535 /nfs/dbraw/zinc/89/15/35/886891535.db2.gz ZWSVPFZBPRGYFC-NRFANRHFSA-N 2 0 400.611 4.078 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000472145473 886942850 /nfs/dbraw/zinc/94/28/50/886942850.db2.gz HWHBBLFTWDUAPU-AWEZNQCLSA-N 2 0 413.418 4.233 20 0 HIADRP C[NH+](C)CCOc1ccccc1-c1nc(-c2cccc(C[NH+]3CCCCC3)c2)no1 ZINC000504253052 913117816 /nfs/dbraw/zinc/11/78/16/913117816.db2.gz LGRYXQQSOBJPAK-UHFFFAOYSA-N 2 0 406.530 4.330 20 0 HIADRP COc1ccccc1C[N@H+](CCCN1CC[NH+](C(C)C)CC1)Cc1cccs1 ZINC000472745543 887590875 /nfs/dbraw/zinc/59/08/75/887590875.db2.gz FBZAKERUFCGWFR-UHFFFAOYSA-N 2 0 401.620 4.175 20 0 HIADRP C[C@H](CCNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1 ZINC000473019686 887845410 /nfs/dbraw/zinc/84/54/10/887845410.db2.gz HJXWLOIICVZWLZ-RCZVLFRGSA-N 2 0 422.617 4.061 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N(C)CC[NH+](C)C2CC2)cc1)C[C@H]1CCCCO1 ZINC000473771218 888569994 /nfs/dbraw/zinc/56/99/94/888569994.db2.gz BWPOHFKITSPPPO-HSZRJFAPSA-N 2 0 416.610 4.024 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NC2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000475119459 889974883 /nfs/dbraw/zinc/97/48/83/889974883.db2.gz NFJPFXIVLPRFRX-HXUWFJFHSA-N 2 0 412.622 4.308 20 0 HIADRP CCN(C(=O)NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475160116 890024902 /nfs/dbraw/zinc/02/49/02/890024902.db2.gz AHEGCQLRFKYKTN-XMMPIXPASA-N 2 0 412.622 4.090 20 0 HIADRP CC[C@@H](C)[NH2+][C@@H](CNC(=O)NCc1ccccc1C[NH+]1CCCCC1)c1ccco1 ZINC000476948858 891886271 /nfs/dbraw/zinc/88/62/71/891886271.db2.gz CZZHPYBDAPVTAZ-KNQAVFIVSA-N 2 0 412.578 4.194 20 0 HIADRP c1cc(C[N@@H+]2CCC[C@@]3(CCCOC3)C2)ccc1C[NH+]1CCC[C@@]2(CCCOC2)C1 ZINC000477044470 891970378 /nfs/dbraw/zinc/97/03/78/891970378.db2.gz CANZSIPLWHWIIR-CLJLJLNGSA-N 2 0 412.618 4.472 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@H](c2cccs2)[NH+](C)C)CC1 ZINC000477603823 892684606 /nfs/dbraw/zinc/68/46/06/892684606.db2.gz COKPKSZIUSPCNO-UYAOXDASSA-N 2 0 406.640 4.037 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000477615787 892713511 /nfs/dbraw/zinc/71/35/11/892713511.db2.gz ZYSWIPLLOYRGSZ-IRLDBZIGSA-N 2 0 416.610 4.103 20 0 HIADRP CC[C@@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479055450 894313790 /nfs/dbraw/zinc/31/37/90/894313790.db2.gz FUEFMAYTOAVOFV-CXAGYDPISA-N 2 0 422.333 4.145 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H]2CC(C)(C)c3ccc(Br)cc32)CC1 ZINC000479072172 894336594 /nfs/dbraw/zinc/33/65/94/894336594.db2.gz UTYLRGDSXVYVPH-OXQOHEQNSA-N 2 0 408.428 4.035 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(Br)cc1C(F)(F)F ZINC000479273609 894549192 /nfs/dbraw/zinc/54/91/92/894549192.db2.gz FJTQNXPMCUBPND-ZIAGYGMSSA-N 2 0 422.333 4.145 20 0 HIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)cc1C(F)(F)F ZINC000479297300 894579909 /nfs/dbraw/zinc/57/99/09/894579909.db2.gz RFGOESIUDHTZFQ-UKRRQHHQSA-N 2 0 423.317 4.355 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3cc(Br)ccc32)C1 ZINC000479434583 894749212 /nfs/dbraw/zinc/74/92/12/894749212.db2.gz DYWRKTMMZUFOST-IRLDBZIGSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@@H]([NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000479503158 894819191 /nfs/dbraw/zinc/81/91/91/894819191.db2.gz NOAYFSMOVZURTC-PBPGXSGUSA-N 3 0 413.528 4.083 20 0 HIADRP COc1ccccc1[C@H](CN[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)[NH+]1CCCC1 ZINC000479877814 895220328 /nfs/dbraw/zinc/22/03/28/895220328.db2.gz YTKKRCFLCMKOHE-TUSQITKMSA-N 2 0 407.602 4.332 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(-n2ccnc2)cc1 ZINC000480232584 895638755 /nfs/dbraw/zinc/63/87/55/895638755.db2.gz OQDZSCFBWJKNTQ-NJDAHSKKSA-N 2 0 404.558 4.332 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccccc1OCC(=O)N(C)C ZINC000480447539 895836479 /nfs/dbraw/zinc/83/64/79/895836479.db2.gz SPXRXOQHTFYUCP-DEOSSOPVSA-N 2 0 423.601 4.380 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@H](C)C1 ZINC000480473051 895854107 /nfs/dbraw/zinc/85/41/07/895854107.db2.gz RDRIMDXQJBFSHJ-VQIMIIECSA-N 2 0 407.649 4.449 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21)N1CC[NH+](C)CC1 ZINC000480523439 895887252 /nfs/dbraw/zinc/88/72/52/895887252.db2.gz HHKJPEOCWMLXQK-CTNGQTDRSA-N 2 0 416.610 4.188 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480539265 895902755 /nfs/dbraw/zinc/90/27/55/895902755.db2.gz KEYFIOOCXABSPY-UZLBHIALSA-N 2 0 404.599 4.180 20 0 HIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480548079 895909080 /nfs/dbraw/zinc/90/90/80/895909080.db2.gz CLINVAPDRDLOLN-UZLBHIALSA-N 2 0 404.599 4.180 20 0 HIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480548078 895909323 /nfs/dbraw/zinc/90/93/23/895909323.db2.gz CLINVAPDRDLOLN-OXQOHEQNSA-N 2 0 404.599 4.180 20 0 HIADRP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000480623047 895991148 /nfs/dbraw/zinc/99/11/48/895991148.db2.gz HMHURLIZDAEPTL-PMACEKPBSA-N 2 0 409.640 4.022 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480641866 896010334 /nfs/dbraw/zinc/01/03/34/896010334.db2.gz MAPAIWUMGUXGCB-ROUUACIJSA-N 2 0 418.578 4.454 20 0 HIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1 ZINC000480705203 896067603 /nfs/dbraw/zinc/06/76/03/896067603.db2.gz MOLRLSLYFSPRHG-HXUWFJFHSA-N 2 0 416.569 4.360 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3oc4ccc(OC)cc4c3C)cn2)CC1 ZINC000480714975 896075862 /nfs/dbraw/zinc/07/58/62/896075862.db2.gz RKQJFTDCZCYXPT-SFHVURJKSA-N 2 0 408.546 4.138 20 0 HIADRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000480722209 896083080 /nfs/dbraw/zinc/08/30/80/896083080.db2.gz JZDHUUJTSGZXQT-XMMPIXPASA-N 2 0 411.565 4.131 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C[NH2+]C3CCN(Cc4cccnc4)CC3)cc2)C1 ZINC000480727201 896086654 /nfs/dbraw/zinc/08/66/54/896086654.db2.gz NGYRRGZURMSEMX-VXKWHMMOSA-N 2 0 406.618 4.314 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3sc(C(C)(C)C)nc3C)cn2)CC1 ZINC000480731309 896091159 /nfs/dbraw/zinc/09/11/59/896091159.db2.gz XCYJFUSROWROJC-INIZCTEOSA-N 2 0 401.624 4.137 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000480739890 896100712 /nfs/dbraw/zinc/10/07/12/896100712.db2.gz OEAOXKODHWHBBH-KRWDZBQOSA-N 2 0 407.587 4.116 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1ccc(OC)c(OC)c1 ZINC000480743561 896105037 /nfs/dbraw/zinc/10/50/37/896105037.db2.gz VKMJZNLQXUNYFP-QHCPKHFHSA-N 2 0 411.590 4.082 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(F)c(Br)c1 ZINC000480901693 896256885 /nfs/dbraw/zinc/25/68/85/896256885.db2.gz SKSGYDSQGWROGY-INIZCTEOSA-N 2 0 420.370 4.186 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CCSc4ccc(Cl)cc43)cc2)CC1 ZINC000480914207 896272863 /nfs/dbraw/zinc/27/28/63/896272863.db2.gz UTGFBFZWHKHDLC-NRFANRHFSA-N 2 0 402.007 4.414 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H](O)Cc1ccccc1C(F)(F)F ZINC000481180673 896520394 /nfs/dbraw/zinc/52/03/94/896520394.db2.gz XKAYSSGUNACEPY-PIPMEXSNSA-N 2 0 406.492 4.109 20 0 HIADRP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000481243192 896593513 /nfs/dbraw/zinc/59/35/13/896593513.db2.gz SNTSOUXXTMVQJK-FQEVSTJZSA-N 2 0 402.542 4.477 20 0 HIADRP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(SCC(F)F)cc1 ZINC000481245230 896597051 /nfs/dbraw/zinc/59/70/51/896597051.db2.gz FUPINOLJIQXALM-INIZCTEOSA-N 2 0 406.546 4.041 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1Br ZINC000481305723 896652911 /nfs/dbraw/zinc/65/29/11/896652911.db2.gz LEADWIHWINVLPU-HNNXBMFYSA-N 2 0 407.352 4.249 20 0 HIADRP CCc1nc(C)c([C@H](C)[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)s1 ZINC000481308573 896654264 /nfs/dbraw/zinc/65/42/64/896654264.db2.gz NLLFRCULQGXPHK-IBGZPJMESA-N 2 0 400.636 4.263 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(I)cc1 ZINC000481329922 896687971 /nfs/dbraw/zinc/68/79/71/896687971.db2.gz AGPGQYDJRVHPHG-OAHLLOKOSA-N 2 0 424.326 4.082 20 0 HIADRP COc1ccc(C2(C[NH2+][C@@H](C)c3ccc(OCC[NH+](C)C)cc3)CCOCC2)cc1 ZINC000481549568 896915602 /nfs/dbraw/zinc/91/56/02/896915602.db2.gz SIGXDCCLFVSRSP-FQEVSTJZSA-N 2 0 412.574 4.035 20 0 HIADRP COc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc(OC)c1OC ZINC000481722405 897115938 /nfs/dbraw/zinc/11/59/38/897115938.db2.gz ZCEFXICNCMPMMV-MRXNPFEDSA-N 2 0 404.576 4.337 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000481731779 897125000 /nfs/dbraw/zinc/12/50/00/897125000.db2.gz DNDZBKDJBBYZAY-ATIYNZHBSA-N 2 0 406.618 4.458 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H]1CCC(C)(C)c2ccc(Br)cc21 ZINC000482000116 897397470 /nfs/dbraw/zinc/39/74/70/897397470.db2.gz RGHRCIDXNJNGIK-OXQOHEQNSA-N 2 0 408.428 4.177 20 0 HIADRP C[C@@H]([NH2+]C[C@@H]1CCCN(Cc2cccs2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482117131 897569011 /nfs/dbraw/zinc/56/90/11/897569011.db2.gz BLVZTBVZOHWGKV-UXHICEINSA-N 2 0 401.620 4.251 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+][C@@H](CCc3ccccc3)Cc3ccccc3)CC2)CC1 ZINC000482121841 897576659 /nfs/dbraw/zinc/57/66/59/897576659.db2.gz DGDHGQRRONKNHS-SANMLTNESA-N 2 0 405.630 4.379 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482130845 897587837 /nfs/dbraw/zinc/58/78/37/897587837.db2.gz FMUORFSTTWWWPT-IBGZPJMESA-N 2 0 418.541 4.125 20 0 HIADRP COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000482232705 897713216 /nfs/dbraw/zinc/71/32/16/897713216.db2.gz UMXBMMOEPKALML-FQEVSTJZSA-N 2 0 412.574 4.344 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CCCc3c4ccccc4sc32)c1 ZINC000482245715 897727970 /nfs/dbraw/zinc/72/79/70/897727970.db2.gz PDWYYEIMQWVISW-OAQYLSRUSA-N 2 0 407.583 4.360 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@H]2CCSc3c(F)cccc32)c1 ZINC000482247889 897730060 /nfs/dbraw/zinc/73/00/60/897730060.db2.gz VYMJLPLVGWSNAK-NRFANRHFSA-N 2 0 404.551 4.109 20 0 HIADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 ZINC000482347683 897858547 /nfs/dbraw/zinc/85/85/47/897858547.db2.gz YAOMACLQNIQMKY-LJQANCHMSA-N 2 0 421.651 4.070 20 0 HIADRP CC(C)Oc1ccc([C@@H](CNC(=O)Nc2ccccc2CC[NH+](C)C)[NH+](C)C)cc1 ZINC000482449579 898013998 /nfs/dbraw/zinc/01/39/98/898013998.db2.gz RZXACLHPUQLMGG-HSZRJFAPSA-N 2 0 412.578 4.002 20 0 HIADRP COc1cc(OC)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1Cl ZINC000482531660 898119359 /nfs/dbraw/zinc/11/93/59/898119359.db2.gz GADUHMAIJJULKW-MRXNPFEDSA-N 2 0 418.965 4.165 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(-n2ccnc2)cc1 ZINC000482539412 898126926 /nfs/dbraw/zinc/12/69/26/898126926.db2.gz ACOTTYNADAQZPF-RTBURBONSA-N 2 0 407.537 4.175 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cnn(Cc2ccccc2)c1 ZINC000482550218 898140318 /nfs/dbraw/zinc/14/03/18/898140318.db2.gz PNRHHNODOBAWEH-WOJBJXKFSA-N 2 0 421.564 4.234 20 0 HIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)ccc1OC(F)F ZINC000482563723 898155791 /nfs/dbraw/zinc/15/57/91/898155791.db2.gz UHRKHXCFCIJKMJ-MRXNPFEDSA-N 2 0 420.500 4.104 20 0 HIADRP CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)OCCO2 ZINC000482565128 898157785 /nfs/dbraw/zinc/15/77/85/898157785.db2.gz MPMXLKGMYSRVLJ-DYESRHJHSA-N 2 0 413.537 4.151 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2ccc([S@](C)=O)cc2)CC1 ZINC000482568987 898163466 /nfs/dbraw/zinc/16/34/66/898163466.db2.gz KVXLVQNDVKRYSN-BPFYBUMWSA-N 2 0 417.594 4.117 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)[C@H](C)C1 ZINC000482632056 898235441 /nfs/dbraw/zinc/23/54/41/898235441.db2.gz PJPRWLZJIUYGNY-YKSBVNFPSA-N 3 0 422.057 4.279 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)[C@@H](C)C1 ZINC000482632055 898235815 /nfs/dbraw/zinc/23/58/15/898235815.db2.gz PJPRWLZJIUYGNY-RDPSFJRHSA-N 3 0 422.057 4.279 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@H](CCSc1ccc(F)cc1)c1ccc(F)cc1 ZINC000482644945 898248393 /nfs/dbraw/zinc/24/83/93/898248393.db2.gz UUGGAEYASFAHCS-FDDCHVKYSA-N 2 0 419.585 4.414 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482892594 898510984 /nfs/dbraw/zinc/51/09/84/898510984.db2.gz BQGRUYYGVASMSP-GOSISDBHSA-N 2 0 407.558 4.242 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(I)cc1 ZINC000483142496 898821586 /nfs/dbraw/zinc/82/15/86/898821586.db2.gz JGFQJLQLZAJFOC-ZDUSSCGKSA-N 2 0 412.290 4.343 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000483219671 898865343 /nfs/dbraw/zinc/86/53/43/898865343.db2.gz UNQQEXPIGUJOSM-JYJNAYRXSA-N 2 0 401.378 4.240 20 0 HIADRP c1ccc(C[NH+]2CCC[C@H]3C[N@H+](CCc4nc(-c5ccccc5)no4)CC[C@@H]32)cc1 ZINC000483467075 899108333 /nfs/dbraw/zinc/10/83/33/899108333.db2.gz KIMMZPNVKSNZNH-GOTSBHOMSA-N 2 0 402.542 4.266 20 0 HIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(Br)s1 ZINC000483544789 899204468 /nfs/dbraw/zinc/20/44/68/899204468.db2.gz PEUDZVNMHMXPTJ-HNNXBMFYSA-N 2 0 400.430 4.112 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)C[C@H]1C ZINC000483697255 899353581 /nfs/dbraw/zinc/35/35/81/899353581.db2.gz DZZCQXHWOBLYQO-MZKRTTBSSA-N 2 0 400.611 4.075 20 0 HIADRP Cc1nc(C)c([C@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)s1 ZINC000483732332 899393671 /nfs/dbraw/zinc/39/36/71/899393671.db2.gz MHNDHNSQSSEYKV-ZDUSSCGKSA-N 2 0 412.525 4.381 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)C[C@H]1C ZINC000483765952 899427613 /nfs/dbraw/zinc/42/76/13/899427613.db2.gz ZUVPOCWXVVEFJO-NFBKMPQASA-N 2 0 400.611 4.077 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H](CO)Cc1c(F)cccc1Cl ZINC000483803693 899478674 /nfs/dbraw/zinc/47/86/74/899478674.db2.gz FYVRIEWBOHPBBK-LYHRCORUSA-N 2 0 404.957 4.130 20 0 HIADRP O=C(NC1CC[NH+](C2CCCC2)CC1)N1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000483991224 899632260 /nfs/dbraw/zinc/63/22/60/899632260.db2.gz ZDJUCSOGKLCSJW-AREMUKBSSA-N 2 0 424.633 4.091 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000484031254 899663220 /nfs/dbraw/zinc/66/32/20/899663220.db2.gz IBVXAVNOTXSLAY-BWKNWUBXSA-N 2 0 422.617 4.238 20 0 HIADRP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000484287094 899853287 /nfs/dbraw/zinc/85/32/87/899853287.db2.gz BMJSOYSYVPMMMU-MRXNPFEDSA-N 2 0 410.002 4.016 20 0 HIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccc([S@](C)=O)cc1 ZINC000484475686 899968953 /nfs/dbraw/zinc/96/89/53/899968953.db2.gz MPIGWNKQGVQEFH-OLILMLBXSA-N 2 0 414.615 4.146 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000484482166 899974552 /nfs/dbraw/zinc/97/45/52/899974552.db2.gz IBAWHZNMKDUVIO-IBGZPJMESA-N 2 0 419.038 4.457 20 0 HIADRP CCC[NH+]1CCC([N@H+](C)C[C@@H](O)CO[C@H](c2ccccc2)c2ccccc2C)CC1 ZINC000484911342 900288447 /nfs/dbraw/zinc/28/84/47/900288447.db2.gz QPUOCUHEVWAIOE-AOYPEHQESA-N 2 0 410.602 4.268 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@@H]4CCO[C@]5(CCSC5)C4)[C@@H]3C2)cc1 ZINC000485258680 900544050 /nfs/dbraw/zinc/54/40/50/900544050.db2.gz HEVVBLAKLTWKMZ-UDIRQSBCSA-N 2 0 400.632 4.322 20 0 HIADRP C[C@H](NC(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000485398663 900696394 /nfs/dbraw/zinc/69/63/94/900696394.db2.gz BYRVPEPVJIBVJM-GVXSCFBNSA-N 2 0 420.601 4.033 20 0 HIADRP Cc1cccc(C)c1NC(=O)CCC[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000485410307 900707444 /nfs/dbraw/zinc/70/74/44/900707444.db2.gz UPVFLRJYSMVTTA-SZPZYZBQSA-N 2 0 415.622 4.233 20 0 HIADRP CCOc1cc(Cl)ccc1C(=O)N(C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000485479325 900772175 /nfs/dbraw/zinc/77/21/75/900772175.db2.gz JEMMFVIGWNICQG-UHFFFAOYSA-N 2 0 422.013 4.007 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1)[NH2+][C@H](C)c1ccccc1 ZINC000485781532 901035999 /nfs/dbraw/zinc/03/59/99/901035999.db2.gz YORFPRVLDQZCPP-BAGYTPMASA-N 2 0 400.611 4.022 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000486188317 901373502 /nfs/dbraw/zinc/37/35/02/901373502.db2.gz GKXKOERLLWUVHW-OFVILXPXSA-N 2 0 405.586 4.313 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@H](C)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000486240740 901423910 /nfs/dbraw/zinc/42/39/10/901423910.db2.gz BCUAHZGWSMLSFE-QPPBQGQZSA-N 2 0 422.617 4.237 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000486273775 901456500 /nfs/dbraw/zinc/45/65/00/901456500.db2.gz YKDGYPGOANVKQY-PXDATVDWSA-N 2 0 422.617 4.238 20 0 HIADRP C[C@@H]([NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)c1cccc(Cl)c1 ZINC000487942706 902472041 /nfs/dbraw/zinc/47/20/41/902472041.db2.gz FVJFQXSMOIAQJR-MRXNPFEDSA-N 2 0 403.979 4.178 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CC[NH+](C2CCC2)C[C@H](C)C1 ZINC000488139335 902636016 /nfs/dbraw/zinc/63/60/16/902636016.db2.gz YKXUQGALLDBWIR-SFTDATJTSA-N 2 0 412.622 4.077 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000488539466 902875042 /nfs/dbraw/zinc/87/50/42/902875042.db2.gz KCKYVWPZJOZKBX-IAGOWNOFSA-N 2 0 401.576 4.387 20 0 HIADRP C[C@H](NC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488607840 902898076 /nfs/dbraw/zinc/89/80/76/902898076.db2.gz GNLVNYWXDSTSQB-GPUOULLFSA-N 2 0 420.601 4.033 20 0 HIADRP CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506032018 914715143 /nfs/dbraw/zinc/71/51/43/914715143.db2.gz OISBKLWLUQOZCC-RTWAWAEBSA-N 2 0 415.622 4.352 20 0 HIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]CCCC[NH+]1CCN(c3ncccn3)CC1)CCCO2 ZINC000489496718 903423943 /nfs/dbraw/zinc/42/39/43/903423943.db2.gz ZFXFPDHBWXXRKY-QHCPKHFHSA-N 2 0 423.605 4.006 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000489681900 903541938 /nfs/dbraw/zinc/54/19/38/903541938.db2.gz UEVRACMITSFPCB-OAHLLOKOSA-N 2 0 420.907 4.239 20 0 HIADRP CCc1ccc([C@@H](CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)[NH+](C)C)cc1 ZINC000489872189 903644243 /nfs/dbraw/zinc/64/42/43/903644243.db2.gz LNMFEYYOUFPUGH-RUZDIDTESA-N 2 0 422.617 4.158 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1)N1CC[NH+](C)CC1 ZINC000490162614 903802643 /nfs/dbraw/zinc/80/26/43/903802643.db2.gz ALTRMHQTSIRSEH-DHIUTWEWSA-N 2 0 403.973 4.430 20 0 HIADRP COc1ccccc1-c1ncc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cn1 ZINC000490785571 904232628 /nfs/dbraw/zinc/23/26/28/904232628.db2.gz RZPXLEZSKMUTRO-UHFFFAOYSA-N 2 0 408.571 4.216 20 0 HIADRP C[C@H](NC(=O)c1oc2ccccc2c1C[NH+](C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000490802104 904249090 /nfs/dbraw/zinc/24/90/90/904249090.db2.gz XWOCOJDBTOAFJL-AZUAARDMSA-N 2 0 405.542 4.135 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1 ZINC000491018462 904371009 /nfs/dbraw/zinc/37/10/09/904371009.db2.gz IBECWOYMYDNSQW-HRAATJIYSA-N 2 0 423.935 4.256 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000491020928 904374111 /nfs/dbraw/zinc/37/41/11/904374111.db2.gz NRERTWWCSADTFP-AUSIDOKSSA-N 2 0 417.544 4.241 20 0 HIADRP CCOc1ccc([C@H]([NH2+]C[C@H](C)N2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000491026863 904376855 /nfs/dbraw/zinc/37/68/55/904376855.db2.gz ZGIUYTLSCAZSDZ-MBSDFSHPSA-N 2 0 401.982 4.054 20 0 HIADRP CC(=O)N1CC[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c2ccccc2C1 ZINC000493209779 905052040 /nfs/dbraw/zinc/05/20/40/905052040.db2.gz ZPZKLYNSHKZHKQ-AREMUKBSSA-N 2 0 417.553 4.495 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)CC3 ZINC000493307839 905081211 /nfs/dbraw/zinc/08/12/11/905081211.db2.gz WYHYPSLDWMCGFU-OAQYLSRUSA-N 2 0 403.570 4.080 20 0 HIADRP COc1cc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1OCC(F)(F)F ZINC000512390326 921126398 /nfs/dbraw/zinc/12/63/98/921126398.db2.gz CHYAJZHAFOOKLN-WBVHZDCISA-N 2 0 400.485 4.379 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cc(Br)cs1 ZINC000493882141 905240544 /nfs/dbraw/zinc/24/05/44/905240544.db2.gz HLYKUIHMBGOYDE-AWEZNQCLSA-N 2 0 409.393 4.318 20 0 HIADRP C[C@@H](CCSc1ccccc1)[NH+]1CCN([C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000512438539 921161374 /nfs/dbraw/zinc/16/13/74/921161374.db2.gz GQAMERHVTDIWAN-UPVQGACJSA-N 2 0 409.643 4.449 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H](C[C@@H]1CCOC1)c1ccc(F)cc1 ZINC000495000777 906163121 /nfs/dbraw/zinc/16/31/21/906163121.db2.gz VMORDFNRQQMHHV-PNTFMKQHSA-N 2 0 412.549 4.040 20 0 HIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccc(C(=O)N(C)C)cc1 ZINC000495074758 906222548 /nfs/dbraw/zinc/22/25/48/906222548.db2.gz NMMAVUQFLYPMNN-NRFANRHFSA-N 2 0 423.601 4.110 20 0 HIADRP C[C@@H]([NH2+]C1CCN(CCc2ccc(F)cc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495416396 906437953 /nfs/dbraw/zinc/43/79/53/906437953.db2.gz ZMYQNNAQNZJLLK-QPPBQGQZSA-N 2 0 409.593 4.333 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccco1 ZINC000496649841 906728540 /nfs/dbraw/zinc/72/85/40/906728540.db2.gz JSVQGVQNEHZRRP-XKYYZAJSSA-N 2 0 424.589 4.204 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)NCCc1ccc(F)cc1 ZINC000497276408 906827822 /nfs/dbraw/zinc/82/78/22/906827822.db2.gz OHTKZXXUBQMNFU-FQEVSTJZSA-N 2 0 411.565 4.039 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)Nc1ccc(F)c(F)c1 ZINC000497276772 906827853 /nfs/dbraw/zinc/82/78/53/906827853.db2.gz PEWZNNJTLAPVCF-KRWDZBQOSA-N 2 0 401.501 4.458 20 0 HIADRP O=C1CCCN1Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000512642217 921270819 /nfs/dbraw/zinc/27/08/19/921270819.db2.gz NGXHIGRSEOHBJQ-JIMJEQGWSA-N 2 0 417.597 4.199 20 0 HIADRP O=C(C1CCC1)N(CCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)C1CC1 ZINC000512641950 921270882 /nfs/dbraw/zinc/27/08/82/921270882.db2.gz LJNZZGLHIDGWHQ-ICDZXHCJSA-N 2 0 409.618 4.058 20 0 HIADRP C[C@H](C[NH2+][C@@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1)N1CC[NH+](C)CC1 ZINC000512668580 921281447 /nfs/dbraw/zinc/28/14/47/921281447.db2.gz VUMIKXOAXNWHID-IIBYNOLFSA-N 2 0 409.471 4.159 20 0 HIADRP C[C@H](NC(=O)N1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000512694369 921289421 /nfs/dbraw/zinc/28/94/21/921289421.db2.gz OEJGABUWBBERLP-GIWBLDEGSA-N 2 0 418.670 4.326 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@H](C)[C@H]2CCC[NH+](C3CCC3)C2)CC1)CC1CC1 ZINC000512711710 921293995 /nfs/dbraw/zinc/29/39/95/921293995.db2.gz KVTNDEQAIXHVMQ-OFNKIYASSA-N 2 0 418.670 4.183 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@H](C)[C@@H]2CCC[NH+](C3CCC3)C2)CC1)CC1CC1 ZINC000512711708 921294194 /nfs/dbraw/zinc/29/41/94/921294194.db2.gz KVTNDEQAIXHVMQ-NFBKMPQASA-N 2 0 418.670 4.183 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@@H](c2ccco2)c2ccc(Br)cc2)CC1 ZINC000497816687 907301877 /nfs/dbraw/zinc/30/18/77/907301877.db2.gz IOZBHVDDJAKXEN-OAQYLSRUSA-N 2 0 420.395 4.139 20 0 HIADRP CCCN(CC[NH+]1CCCCC1)C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000498029761 907533039 /nfs/dbraw/zinc/53/30/39/907533039.db2.gz USZMBMDQWWXTIC-PZJWPPBQSA-N 2 0 406.640 4.039 20 0 HIADRP C[C@H](NC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000498124355 907638051 /nfs/dbraw/zinc/63/80/51/907638051.db2.gz HNBUMFPDMCCJMT-ACIOBRDBSA-N 2 0 424.589 4.016 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC1 ZINC000498506525 907978163 /nfs/dbraw/zinc/97/81/63/907978163.db2.gz AWFVUKIAOJOQAC-JOCHJYFZSA-N 2 0 403.586 4.008 20 0 HIADRP C[C@H](NC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[C@@H](c1ccccc1)[NH+](C)C ZINC000498899545 908305364 /nfs/dbraw/zinc/30/53/64/908305364.db2.gz SQVMTETWEHQRHO-JVODISISSA-N 2 0 408.590 4.030 20 0 HIADRP Cc1ccc([C@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N2CCOCC2)cc1 ZINC000499139652 908498108 /nfs/dbraw/zinc/49/81/08/908498108.db2.gz QGZZIEYXKPEJBX-XUJYPJAKSA-N 2 0 419.613 4.154 20 0 HIADRP C[C@@H]1CN(Cc2cccc(C[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2)CCO1 ZINC000499144132 908501762 /nfs/dbraw/zinc/50/17/62/908501762.db2.gz VHMHWWXCJUXDFL-YFVWJHKLSA-N 2 0 419.613 4.193 20 0 HIADRP Cc1cccc([C@@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N2CCOCC2)c1 ZINC000499148390 908507133 /nfs/dbraw/zinc/50/71/33/908507133.db2.gz SULNXTWLNBLLMD-JVYGEBFASA-N 2 0 419.613 4.154 20 0 HIADRP COc1ccc([C@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N(C)C)cc1OC ZINC000499153213 908511200 /nfs/dbraw/zinc/51/12/00/908511200.db2.gz RHRNQUKPOQUSSP-KIHHCIJBSA-N 2 0 423.601 4.092 20 0 HIADRP O=C1CCCN1Cc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499158173 908514751 /nfs/dbraw/zinc/51/47/51/908514751.db2.gz SCGZUULKYNTRDL-QEIWAGNOSA-N 2 0 403.570 4.094 20 0 HIADRP O=C1CCCN1Cc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499158172 908515441 /nfs/dbraw/zinc/51/54/41/908515441.db2.gz SCGZUULKYNTRDL-MPIKPJSNSA-N 2 0 403.570 4.094 20 0 HIADRP COc1cccc(N2CC[C@H](C[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499161356 908516617 /nfs/dbraw/zinc/51/66/17/908516617.db2.gz LRLKZLRLWZRFBX-MFYODDQASA-N 2 0 405.586 4.307 20 0 HIADRP FC(F)(F)c1cccc(OCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000499186438 908539519 /nfs/dbraw/zinc/53/95/19/908539519.db2.gz KMRCUIMZGGUYNC-LDLYASANSA-N 2 0 405.464 4.264 20 0 HIADRP CC(C)C[C@H](CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[NH2+][C@@H](C)c1ccccc1 ZINC000499196434 908550577 /nfs/dbraw/zinc/55/05/77/908550577.db2.gz VUZRQPTWCMDPEK-LVEKEYPTSA-N 2 0 400.611 4.019 20 0 HIADRP O[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2cccc(OCc3ccc(F)cc3)c2)CC1 ZINC000499686720 908877388 /nfs/dbraw/zinc/87/73/88/908877388.db2.gz VAAJVFNOOSKOBI-RPBOFIJWSA-N 2 0 412.549 4.262 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+](CCSC2CCCCC2)CC1)Cc1ccccc1 ZINC000500073840 909543413 /nfs/dbraw/zinc/54/34/13/909543413.db2.gz ITYMBCUQQWATNA-UHFFFAOYSA-N 2 0 417.663 4.013 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)CC1 ZINC000500077047 909547524 /nfs/dbraw/zinc/54/75/24/909547524.db2.gz WANBHJOLNLQPQH-IBGZPJMESA-N 2 0 414.421 4.253 20 0 HIADRP O[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)COc1cccc(Cl)c1Cl ZINC000513053993 921510489 /nfs/dbraw/zinc/51/04/89/921510489.db2.gz ZEBFDQHCPUECIW-KRWDZBQOSA-N 2 0 401.378 4.120 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NCC1([NH2+][C@@H](C)c2ccccc2)CCOCC1)c1ccccc1 ZINC000500495164 909890276 /nfs/dbraw/zinc/89/02/76/909890276.db2.gz UORZLLRQAUWDEY-URXFXBBRSA-N 2 0 423.601 4.086 20 0 HIADRP Fc1cccc(N2CCCC2)c1C[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000513105244 921552973 /nfs/dbraw/zinc/55/29/73/921552973.db2.gz UBNNAVGNYFJIHC-UHFFFAOYSA-N 2 0 410.581 4.118 20 0 HIADRP C[C@@H]1C[C@H](CCNC(=O)N2CCC(CCC[NH+](C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000500893887 910165190 /nfs/dbraw/zinc/16/51/90/910165190.db2.gz MUHLNAZAPQBIDJ-QPPBQGQZSA-N 2 0 414.638 4.051 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2=O)CC1 ZINC000501004165 910226751 /nfs/dbraw/zinc/22/67/51/910226751.db2.gz OYYKGMDJRGFPLB-HXUWFJFHSA-N 2 0 411.512 4.255 20 0 HIADRP CC[C@@H](NC(=O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000501017284 910235348 /nfs/dbraw/zinc/23/53/48/910235348.db2.gz ASFCLBUBSJJPBY-JOCHJYFZSA-N 2 0 414.981 4.151 20 0 HIADRP C[N@H+](CCC(=O)Nc1cccc(C(F)(F)F)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501024414 910243028 /nfs/dbraw/zinc/24/30/28/910243028.db2.gz NPVAGWPPARFWBG-UHFFFAOYSA-N 2 0 420.479 4.277 20 0 HIADRP C[N@@H+](CC(=O)Nc1c(Cl)cccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501055118 910267470 /nfs/dbraw/zinc/26/74/70/910267470.db2.gz SEMWLFKCPFAZQT-UHFFFAOYSA-N 2 0 407.345 4.175 20 0 HIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000501404992 910535605 /nfs/dbraw/zinc/53/56/05/910535605.db2.gz HQQPBPOLRMDBEV-LGMDPLHJSA-N 2 0 404.480 4.045 20 0 HIADRP Cc1ccc([C@H](NC(=O)C[NH+]2CCC(CCC[NH+](C)C)CC2)c2cccs2)cc1 ZINC000501779433 910834379 /nfs/dbraw/zinc/83/43/79/910834379.db2.gz WUMROISJODJPPC-DEOSSOPVSA-N 2 0 413.631 4.316 20 0 HIADRP C[NH+](C)CCCC1CC[NH+](CCC(=O)NC(c2ccccc2)c2ccccc2)CC1 ZINC000501786056 910839166 /nfs/dbraw/zinc/83/91/66/910839166.db2.gz OUHIQUZLBOIDDD-UHFFFAOYSA-N 2 0 407.602 4.336 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)C1 ZINC000502509581 911513817 /nfs/dbraw/zinc/51/38/17/911513817.db2.gz LJZBHAGFKAALAK-USGHRTRXSA-N 2 0 412.622 4.164 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCC2)cc1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000502673334 911715532 /nfs/dbraw/zinc/71/55/32/911715532.db2.gz XQHYDSCHCNAVKA-UHFFFAOYSA-N 2 0 412.622 4.080 20 0 HIADRP CCC(CC)(CNC(=O)NC[C@@H]1CCC[N@@H+](C(C)C)C1)[NH2+][C@H](C)c1ccccc1 ZINC000502762669 911786486 /nfs/dbraw/zinc/78/64/86/911786486.db2.gz JRXKRABQCZXUNE-RTWAWAEBSA-N 2 0 402.627 4.316 20 0 HIADRP CCC(CC)(CNC(=O)NC[C@H]1CCC[N@@H+](C(C)C)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000502762667 911786738 /nfs/dbraw/zinc/78/67/38/911786738.db2.gz JRXKRABQCZXUNE-LEWJYISDSA-N 2 0 402.627 4.316 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)[NH+]2CCCC2)o1 ZINC000502779964 911803825 /nfs/dbraw/zinc/80/38/25/911803825.db2.gz ALRWPCNTRZWJJQ-QHCPKHFHSA-N 2 0 424.589 4.031 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)NC[C@H](c2cccs2)[NH+](C)C)CCCC1)c1ccccc1 ZINC000503107387 912073700 /nfs/dbraw/zinc/07/37/00/912073700.db2.gz MEVBTLGMCXCREX-UYAOXDASSA-N 2 0 414.619 4.314 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000506469342 915066450 /nfs/dbraw/zinc/06/64/50/915066450.db2.gz HTWUCALDEPLBKC-MSOLQXFVSA-N 2 0 422.411 4.364 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)[NH+]2CCCC2)o1 ZINC000506632035 915300734 /nfs/dbraw/zinc/30/07/34/915300734.db2.gz GDEWELALUXMHPS-HJNYFJLDSA-N 2 0 416.610 4.021 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)C1 ZINC000506919379 915718934 /nfs/dbraw/zinc/71/89/34/915718934.db2.gz SSGHZGQCHLEZOT-AOHZBQACSA-N 2 0 412.622 4.120 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)C1 ZINC000506919381 915720843 /nfs/dbraw/zinc/72/08/43/915720843.db2.gz SSGHZGQCHLEZOT-GPXNEJASSA-N 2 0 412.622 4.120 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC000506940394 915745341 /nfs/dbraw/zinc/74/53/41/915745341.db2.gz OCVAOTNCYVJPAA-PIATZUFCSA-N 2 0 412.622 4.118 20 0 HIADRP C[NH+](C/C=C/C[N@@H+](C)C[C@H]1OCCc2ccccc21)C[C@@H]1OCCc2ccccc21 ZINC000507263148 916024945 /nfs/dbraw/zinc/02/49/45/916024945.db2.gz YSECPBDTHDZMHN-GGYVIMMISA-N 2 0 406.570 4.034 20 0 HIADRP CC(C)(C)OC(=O)C1CCC([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)CC1 ZINC000507890940 916742643 /nfs/dbraw/zinc/74/26/43/916742643.db2.gz RLOTYQVEQCPFLR-UHFFFAOYSA-N 2 0 415.622 4.079 20 0 HIADRP COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000508698613 917460030 /nfs/dbraw/zinc/46/00/30/917460030.db2.gz PIEPAXZTLRIPRF-MZYLBHOOSA-N 2 0 423.601 4.030 20 0 HIADRP FC(F)(F)CN1CCC([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)CC1 ZINC000509465587 918114517 /nfs/dbraw/zinc/11/45/17/918114517.db2.gz RVCSHXCZIKHYLU-UHFFFAOYSA-N 2 0 411.556 4.338 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N(CC)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000509578373 918228880 /nfs/dbraw/zinc/22/88/80/918228880.db2.gz QGYFWRYXCRVJOM-BVSLBCMMSA-N 2 0 412.578 4.015 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccco1 ZINC000509595723 918245922 /nfs/dbraw/zinc/24/59/22/918245922.db2.gz JGDUGESAVKIKEZ-PWRODBHTSA-N 2 0 404.599 4.006 20 0 HIADRP C[C@@H]1C[C@@H](CCNC(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000509793849 918401004 /nfs/dbraw/zinc/40/10/04/918401004.db2.gz YCXKABLFZDFVKF-CQOQZXRMSA-N 2 0 414.638 4.098 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccccc3-c3ccnn3C)CC2)cc1 ZINC000510350220 918846972 /nfs/dbraw/zinc/84/69/72/918846972.db2.gz GZZAGQVEWGGFHF-UHFFFAOYSA-N 2 0 404.558 4.098 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000510523581 918969880 /nfs/dbraw/zinc/96/98/80/918969880.db2.gz MFXLELBRYFVYOD-UNWVZKJWSA-N 2 0 400.611 4.022 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)c1cccc(C[N@H+](C)Cc2ccccc2)c1)c1ccsc1 ZINC000510736338 919182025 /nfs/dbraw/zinc/18/20/25/919182025.db2.gz PRVQWAXEZBECCV-HSZRJFAPSA-N 2 0 407.583 4.413 20 0 HIADRP O=C(Cc1ccccc1)N1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000511003898 919562003 /nfs/dbraw/zinc/56/20/03/919562003.db2.gz XFHLEPWFLDDBCL-POTDNYQPSA-N 2 0 417.597 4.005 20 0 HIADRP O=C(Nc1ccccc1)N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000511025788 919599757 /nfs/dbraw/zinc/59/97/57/919599757.db2.gz FXDHREUFJXMSMA-RVFVQDDPSA-N 2 0 418.585 4.183 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC[NH+](CCc3ccccc3)CC2)cc1)C(C)C ZINC000511276100 919873270 /nfs/dbraw/zinc/87/32/70/919873270.db2.gz GLVUQFLSKAVWFW-UHFFFAOYSA-N 2 0 407.602 4.354 20 0 HIADRP C[C@@H](NC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511286648 919881650 /nfs/dbraw/zinc/88/16/50/919881650.db2.gz MIESOLLTOAXFBJ-UYAOXDASSA-N 2 0 421.029 4.066 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511294370 919889414 /nfs/dbraw/zinc/88/94/14/919889414.db2.gz QUYXOVQDSMEQOF-VQTJNVASSA-N 2 0 416.610 4.182 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)CC1 ZINC000511416709 920029105 /nfs/dbraw/zinc/02/91/05/920029105.db2.gz FVKMNJYIXNIMHF-TUNNFDKTSA-N 2 0 412.622 4.164 20 0 HIADRP C[C@H](NC(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000511449130 920057974 /nfs/dbraw/zinc/05/79/74/920057974.db2.gz MZAWBMKKXXFKTF-VWNVYAMZSA-N 2 0 418.651 4.083 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2cc(-c3ccccc3)cs2)CC1 ZINC000511671499 920336471 /nfs/dbraw/zinc/33/64/71/920336471.db2.gz OELKFZZBSFTVCU-UHFFFAOYSA-N 2 0 413.631 4.331 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000511809047 920504798 /nfs/dbraw/zinc/50/47/98/920504798.db2.gz ROPKDFMBNARVBB-RUZDIDTESA-N 2 0 419.613 4.316 20 0 HIADRP C[C@@H](C[NH2+][C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)C[NH+]1CCCC1 ZINC000512099216 920859391 /nfs/dbraw/zinc/85/93/91/920859391.db2.gz KZAZFWUUQUMXLE-KBPBESRZSA-N 2 0 405.892 4.397 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000512109481 920866131 /nfs/dbraw/zinc/86/61/31/920866131.db2.gz ZNXZRRQPESSAPW-HSZRJFAPSA-N 2 0 414.638 4.098 20 0 HIADRP Cc1cc(C[NH+]2CCSCC2)ccc1NC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000512298408 921053203 /nfs/dbraw/zinc/05/32/03/921053203.db2.gz JFKJUROCZTZVCO-UHFFFAOYSA-N 2 0 423.626 4.395 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512337859 921084649 /nfs/dbraw/zinc/08/46/49/921084649.db2.gz UZRCHEVCKTXFCG-ITTUMRLJSA-N 2 0 423.601 4.227 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc(OCC[NH+](C)C)c(Cl)c2)cc1 ZINC000513476174 921834210 /nfs/dbraw/zinc/83/42/10/921834210.db2.gz PMMGXYCHAFFWDM-UHFFFAOYSA-N 2 0 403.954 4.375 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@@H](Cc3ccccn3)c3cccnc3)cc2)C[C@H](C)O1 ZINC000513500352 921849912 /nfs/dbraw/zinc/84/99/12/921849912.db2.gz MCNMPNBCFVRFCV-UZINWLIJSA-N 2 0 416.569 4.159 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N[C@@H]2CC[N@H+](C3CC3)[C@H]2c2cccc(OC)c2)cc1 ZINC000513652895 921974624 /nfs/dbraw/zinc/97/46/24/921974624.db2.gz BVYYLMRKJYKWQM-RPBOFIJWSA-N 2 0 421.585 4.245 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCC(=O)N2Cc3ccccc3C2)CC1 ZINC000513702464 922022121 /nfs/dbraw/zinc/02/21/21/922022121.db2.gz JJSRTDPRFQOMCI-UHFFFAOYSA-N 2 0 405.586 4.342 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCC(=O)N2CCc3ccccc32)CC1 ZINC000513707540 922027086 /nfs/dbraw/zinc/02/70/86/922027086.db2.gz FFAKFMQZRJBNEY-UHFFFAOYSA-N 2 0 405.586 4.389 20 0 HIADRP CCC1(CNC(=O)NC2CC[NH+](CC(C)C)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000513982561 922303785 /nfs/dbraw/zinc/30/37/85/922303785.db2.gz FLZCKJYQNBWPMN-UHFFFAOYSA-N 2 0 414.638 4.098 20 0 HIADRP Cc1ccc([C@H](OC[C@H](O)C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c2ccccc2)cc1 ZINC000514005690 922330045 /nfs/dbraw/zinc/33/00/45/922330045.db2.gz PIIKEQMCSQSTLR-CLJLJLNGSA-N 2 0 410.602 4.267 20 0 HIADRP Cc1ccc(COc2ccc(C[NH2+]Cc3ccccc3C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000514238263 922575832 /nfs/dbraw/zinc/57/58/32/922575832.db2.gz RAKSEWPTBYDTMQ-AREMUKBSSA-N 2 0 416.565 4.430 20 0 HIADRP CCc1ccc([C@H]2CCCCCN2C(=O)NC2CC[NH+](C3CCN(C)CC3)CC2)o1 ZINC000514441486 922628648 /nfs/dbraw/zinc/62/86/48/922628648.db2.gz AMVIOIKLZGHGFS-JOCHJYFZSA-N 2 0 416.610 4.027 20 0 HIADRP CSC1(C[NH2+][C@@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)CC[NH+](C)CC1 ZINC000514821216 922815289 /nfs/dbraw/zinc/81/52/89/922815289.db2.gz UMWOBTMDHPIUDO-PKOBYXMFSA-N 2 0 410.599 4.252 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c2cccs2)CC1 ZINC000515290951 923036493 /nfs/dbraw/zinc/03/64/93/923036493.db2.gz NISVRPVYAJGEQP-GOSISDBHSA-N 2 0 406.640 4.130 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1 ZINC000515294322 923038721 /nfs/dbraw/zinc/03/87/21/923038721.db2.gz RDZPKOIVHNSPNW-DEOSSOPVSA-N 2 0 408.590 4.165 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(=O)NC[C@@H](C)c1ccccc1 ZINC000515521742 923150804 /nfs/dbraw/zinc/15/08/04/923150804.db2.gz UBSUNOOZJZCZSX-YPAWHYETSA-N 2 0 407.602 4.317 20 0 HIADRP C[C@H](CNC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC000515521741 923151103 /nfs/dbraw/zinc/15/11/03/923151103.db2.gz UBSUNOOZJZCZSX-VSKRKVRLSA-N 2 0 407.602 4.317 20 0 HIADRP CC(C)(C)[NH+]1CCC(NC(=O)NC[C@H](c2ccccc2Cl)[NH+]2CCCC2)CC1 ZINC000515818621 923371561 /nfs/dbraw/zinc/37/15/61/923371561.db2.gz PURUKMPJSLJELB-HXUWFJFHSA-N 2 0 407.002 4.039 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000517472758 924213400 /nfs/dbraw/zinc/21/34/00/924213400.db2.gz BWKHMMBXHDNBCV-JOCHJYFZSA-N 2 0 420.601 4.090 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)N1CCC([N@@H+]2CCc3ccccc3C2)CC1)c1ccccc1 ZINC000517507341 924236729 /nfs/dbraw/zinc/23/67/29/924236729.db2.gz QZNQBOXOKPTXOS-RUZDIDTESA-N 2 0 405.586 4.119 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000518632080 927391392 /nfs/dbraw/zinc/39/13/92/927391392.db2.gz YCCMBWCNZQURMG-URXFXBBRSA-N 2 0 412.622 4.221 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cnn(Cc3ccccc3)c2)CC1 ZINC000518774645 927486121 /nfs/dbraw/zinc/48/61/21/927486121.db2.gz YHOVFCFFCSXKTC-HXUWFJFHSA-N 2 0 421.564 4.063 20 0 HIADRP O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1ccc2c[nH+]cn2c1 ZINC000518801633 927499991 /nfs/dbraw/zinc/49/99/91/927499991.db2.gz WHBMYAJSRCKOSZ-UHFFFAOYSA-N 2 0 407.477 4.176 20 0 HIADRP CCOc1cc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)ccc1OCC(F)(F)F ZINC000519673176 928046290 /nfs/dbraw/zinc/04/62/90/928046290.db2.gz SVHXQXGOYAAUES-SFHVURJKSA-N 2 0 400.485 4.190 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCC[C@@H]2C[NH+]2CCCCC2)cc1 ZINC000520613263 928673705 /nfs/dbraw/zinc/67/37/05/928673705.db2.gz YMBOHFVKQZDQRT-XUZZJYLKSA-N 2 0 412.622 4.221 20 0 HIADRP O[C@]1(CNCc2ccc(-c3nc4ccccc4s3)o2)CC[N@H+](Cc2ccccc2)C1 ZINC000524637772 929747390 /nfs/dbraw/zinc/74/73/90/929747390.db2.gz TUGWWJYDASAIIG-DEOSSOPVSA-N 2 0 419.550 4.283 20 0 HIADRP C[NH+]1CCN(CCC[NH2+]Cc2c(Cl)cccc2OCc2ccccc2Cl)CC1 ZINC000525181583 930078572 /nfs/dbraw/zinc/07/85/72/930078572.db2.gz PWRLQXAOEPYFEB-UHFFFAOYSA-N 2 0 422.400 4.300 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000525398896 930219013 /nfs/dbraw/zinc/21/90/13/930219013.db2.gz RSKMRMMDYGQZMQ-JOCHJYFZSA-N 2 0 422.617 4.334 20 0 HIADRP Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000526134688 930541958 /nfs/dbraw/zinc/54/19/58/930541958.db2.gz HKUMBGVRCIZOIE-UHFFFAOYSA-N 2 0 402.970 4.273 20 0 HIADRP CC[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(Br)cc1Cl ZINC000527348632 930643333 /nfs/dbraw/zinc/64/33/33/930643333.db2.gz JULMIBBFFJWOCJ-GOSISDBHSA-N 2 0 402.808 4.171 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+](Cc2cccc3ccccc32)CC1)Cc1ccccc1 ZINC000530688188 930798533 /nfs/dbraw/zinc/79/85/33/930798533.db2.gz CPHOEDHEXUBLMT-UHFFFAOYSA-N 2 0 415.581 4.300 20 0 HIADRP c1sc(-c2ccccn2)nc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000530904130 930855066 /nfs/dbraw/zinc/85/50/66/930855066.db2.gz KQJDMSQWMYGDTI-UHFFFAOYSA-N 2 0 422.598 4.366 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)Nc2ccc(C[NH+]3CCC(C)CC3)cc2)CC1 ZINC000531443277 931058702 /nfs/dbraw/zinc/05/87/02/931058702.db2.gz DWUOVHHDRCXFOB-UHFFFAOYSA-N 2 0 406.574 4.477 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]CCc2nc(-c3ccncc3)cs2)CC1 ZINC000531582260 931109391 /nfs/dbraw/zinc/10/93/91/931109391.db2.gz PZGSMAZOFYPFBY-UHFFFAOYSA-N 2 0 421.614 4.069 20 0 HIADRP CN(c1ccccc1C[NH2+]CCCc1nc2c(s1)CCCC2)C1CC[NH+](C)CC1 ZINC000531594561 931113300 /nfs/dbraw/zinc/11/33/00/931113300.db2.gz MBNDFHNRHOHDGR-UHFFFAOYSA-N 2 0 412.647 4.275 20 0 HIADRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1 ZINC000531609840 931123053 /nfs/dbraw/zinc/12/30/53/931123053.db2.gz BXMWIPSSFUUSMR-UHFFFAOYSA-N 2 0 419.013 4.283 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000531691544 931156016 /nfs/dbraw/zinc/15/60/16/931156016.db2.gz DXFMSYZQJSLMIB-SJORKVTESA-N 2 0 410.400 4.268 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccc(Br)c(F)c1)C1CC[NH+](C)CC1 ZINC000531848949 931218583 /nfs/dbraw/zinc/21/85/83/931218583.db2.gz HRXZWRHHLOISTR-UHFFFAOYSA-N 2 0 420.370 4.408 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531945156 931257410 /nfs/dbraw/zinc/25/74/10/931257410.db2.gz CAXSSXCGORGYPT-CEXWTWQISA-N 2 0 407.558 4.031 20 0 HIADRP C[NH+]1CCN(C[C@H]([NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)c2ccccc2)CC1 ZINC000531965291 931268729 /nfs/dbraw/zinc/26/87/29/931268729.db2.gz PZIFBRVZTMQHRD-VXKWHMMOSA-N 2 0 419.491 4.151 20 0 HIADRP CN(C)[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000532105707 931314545 /nfs/dbraw/zinc/31/45/45/931314545.db2.gz QOXAOYATSSTPMU-XMMPIXPASA-N 2 0 415.025 4.263 20 0 HIADRP CCCCNC(=O)c1ccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1 ZINC000532107453 931315208 /nfs/dbraw/zinc/31/52/08/931315208.db2.gz PYARRKIHBRJQQU-UHFFFAOYSA-N 2 0 422.617 4.037 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccccc1OCC(=O)N(C)C ZINC000532201832 931346865 /nfs/dbraw/zinc/34/68/65/931346865.db2.gz AOBHDWJAHCACLV-XMMPIXPASA-N 2 0 423.601 4.380 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccccc1C(F)(F)F ZINC000532230553 931364482 /nfs/dbraw/zinc/36/44/82/931364482.db2.gz ADXOVAVHGHPMCL-QFBILLFUSA-N 2 0 419.491 4.254 20 0 HIADRP COc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)c(-c2ccccc2)cc1OC ZINC000532270307 931379086 /nfs/dbraw/zinc/37/90/86/931379086.db2.gz ZGIMVMBUKSGAEY-DNQXCXABSA-N 2 0 424.585 4.228 20 0 HIADRP CN(C)[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccccc1Cl ZINC000532361349 931409508 /nfs/dbraw/zinc/40/95/08/931409508.db2.gz OCIUALGJXVPYNL-DEOSSOPVSA-N 2 0 415.025 4.263 20 0 HIADRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 ZINC000532373881 931413987 /nfs/dbraw/zinc/41/39/87/931413987.db2.gz CFQHCMPZKXQTCO-UHFFFAOYSA-N 2 0 413.509 4.154 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]CCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000532459319 931444516 /nfs/dbraw/zinc/44/45/16/931444516.db2.gz OVMDDAYSPSLPIJ-BZSNNMDCSA-N 2 0 410.002 4.413 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(NC(=O)c2ccco2)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000532472125 931451611 /nfs/dbraw/zinc/45/16/11/931451611.db2.gz CRKKTRRBSYIPQP-SFHVURJKSA-N 2 0 407.514 4.323 20 0 HIADRP C[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(Br)cc1 ZINC000532497855 931463148 /nfs/dbraw/zinc/46/31/48/931463148.db2.gz ZIGUUIXPKHFTRF-DYESRHJHSA-N 2 0 402.380 4.088 20 0 HIADRP Cc1ccc(COc2ccc(C[NH2+]C3CC[NH+]([C@@H]4CCCC[C@H]4O)CC3)cc2)cc1 ZINC000532628276 931559718 /nfs/dbraw/zinc/55/97/18/931559718.db2.gz FJMJODCVSYMLRQ-CLJLJLNGSA-N 2 0 408.586 4.432 20 0 HIADRP CN(c1ccccc1CNc1cccc(OCCC[NH+](C)C)c1)C1CC[NH+](C)CC1 ZINC000532736733 931617979 /nfs/dbraw/zinc/61/79/79/931617979.db2.gz YOWWXVFBKITIDR-UHFFFAOYSA-N 2 0 410.606 4.160 20 0 HIADRP C[NH+](C)CC1CCC([NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)CC1 ZINC000533392291 931856080 /nfs/dbraw/zinc/85/60/80/931856080.db2.gz LUBIGXLVMBCMLY-UHFFFAOYSA-N 2 0 403.574 4.203 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cnc(CC(C)C)s2)CC1 ZINC000533446548 931871878 /nfs/dbraw/zinc/87/18/78/931871878.db2.gz OLJANMJPIIKWCO-KRWDZBQOSA-N 2 0 404.599 4.473 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000534971478 932868952 /nfs/dbraw/zinc/86/89/52/932868952.db2.gz OJGSXAZKBAXKNE-OXQOHEQNSA-N 2 0 424.992 4.034 20 0 HIADRP C[N@@H+]1CC[C@@H](CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000534971476 932869040 /nfs/dbraw/zinc/86/90/40/932869040.db2.gz OJGSXAZKBAXKNE-OXJNMPFZSA-N 2 0 424.992 4.034 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CC[NH+](C)[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000535434078 933133270 /nfs/dbraw/zinc/13/32/70/933133270.db2.gz CJKDZTLKENCSDL-KMRPREKFSA-N 2 0 420.601 4.126 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CC[NH+](C)[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000535434079 933133748 /nfs/dbraw/zinc/13/37/48/933133748.db2.gz CJKDZTLKENCSDL-ZBCONREDSA-N 2 0 420.601 4.126 20 0 HIADRP Clc1cc2c(c(Br)c1)CC[C@@H]2NC1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000535509195 933203356 /nfs/dbraw/zinc/20/33/56/933203356.db2.gz VRSAXCFMVZZLHK-YJYMSZOUSA-N 2 0 413.787 4.180 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ncc(Br)s3)CC2)cc1 ZINC000535989030 933549931 /nfs/dbraw/zinc/54/99/31/933549931.db2.gz PZQJOTIRGXETPJ-AWEZNQCLSA-N 2 0 424.408 4.477 20 0 HIADRP CC(C)C[NH+]1CCC(NC(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)CC1 ZINC000537669297 938350405 /nfs/dbraw/zinc/35/04/05/938350405.db2.gz GBHPOCRLVUFFGA-UHFFFAOYSA-N 2 0 400.611 4.203 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)NCc3cccc(C[NH+](C)C)c3)c2)CC1 ZINC000537672454 938350851 /nfs/dbraw/zinc/35/08/51/938350851.db2.gz XKBSEZISFQXRRT-UHFFFAOYSA-N 2 0 408.590 4.344 20 0 HIADRP CC[C@H]([NH2+]Cc1c(Cl)cccc1N1CC[NH+](C)CC1)c1ccc2c(c1)OCCO2 ZINC000537749518 938368919 /nfs/dbraw/zinc/36/89/19/938368919.db2.gz QSUWCSOKWQCCII-FQEVSTJZSA-N 2 0 415.965 4.104 20 0 HIADRP C[C@H](NC(=O)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1Cl ZINC000537844400 938388291 /nfs/dbraw/zinc/38/82/91/938388291.db2.gz DYWCUKRYUBQZFI-SFHVURJKSA-N 2 0 414.981 4.151 20 0 HIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000537939520 938424280 /nfs/dbraw/zinc/42/42/80/938424280.db2.gz SRGXKDMWPOOVOW-DYXWJJEUSA-N 2 0 415.603 4.009 20 0 HIADRP Cc1cc(C[C@@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)n(-c2ccccc2)n1 ZINC000537948515 938428608 /nfs/dbraw/zinc/42/86/08/938428608.db2.gz PWKOBVOIIOCPAN-TZIWHRDSSA-N 2 0 406.574 4.403 20 0 HIADRP CC(C)Oc1cccc([C@@H](C)[NH2+][C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000538124871 938511880 /nfs/dbraw/zinc/51/18/80/938511880.db2.gz OHARTUFZJWPORP-NHCUHLMSSA-N 2 0 423.601 4.294 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@H]1CCCN(c3cccc(F)c3)C1)c1ccccc1O2 ZINC000538293664 938585034 /nfs/dbraw/zinc/58/50/34/938585034.db2.gz LUQANYUTIXJULD-REWPJTCUSA-N 2 0 409.549 4.372 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@@H]1CCOC3(CCSCC3)C1)c1ccccc1O2 ZINC000538294624 938585648 /nfs/dbraw/zinc/58/56/48/938585648.db2.gz VSYPKCFRLLWLSI-QUCCMNQESA-N 2 0 402.604 4.009 20 0 HIADRP COCCCOc1cccc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c1 ZINC000538307533 938588949 /nfs/dbraw/zinc/58/89/49/938588949.db2.gz BIFACAWMGKYFMO-QHCPKHFHSA-N 2 0 410.558 4.180 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cc3cccc(OC)c3o2)CC1 ZINC000538398433 938611136 /nfs/dbraw/zinc/61/11/36/938611136.db2.gz MCPLWIDSDOYHST-LJQANCHMSA-N 2 0 407.558 4.430 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(Br)c(OC(F)F)c(OC)c2)[C@@H](C)C1 ZINC000538718319 938689494 /nfs/dbraw/zinc/68/94/94/938689494.db2.gz JXHGSZUAYFAGRF-SWLSCSKDSA-N 2 0 421.326 4.221 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)Nc1ccccc1C(F)(F)F ZINC000538945909 938743877 /nfs/dbraw/zinc/74/38/77/938743877.db2.gz VUXKIZRNLSPRRD-UHFFFAOYSA-N 2 0 420.479 4.277 20 0 HIADRP Cc1c([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)nnn1-c1ccc(Cl)cc1 ZINC000539038788 938777266 /nfs/dbraw/zinc/77/72/66/938777266.db2.gz NSKRIRCOOXGKMY-INIZCTEOSA-N 2 0 410.953 4.191 20 0 HIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C2CC[NH+]([C@@H]4CCC[C@H]4O)CC2)CCC3)cc1 ZINC000539059611 938787240 /nfs/dbraw/zinc/78/72/40/938787240.db2.gz KIKSCJHJJSDHLO-CEMLEFRQSA-N 2 0 411.615 4.463 20 0 HIADRP C/C=C\COc1ccc(CC[C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1 ZINC000539060671 938787980 /nfs/dbraw/zinc/78/79/80/938787980.db2.gz ITUGWTNNMXOOGB-KVMLMBNISA-N 2 0 400.607 4.320 20 0 HIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1 ZINC000539063475 938789083 /nfs/dbraw/zinc/78/90/83/938789083.db2.gz GWOWBBUPBVHVHM-WTVLQJKYSA-N 2 0 401.378 4.117 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)cc1 ZINC000539074079 938794971 /nfs/dbraw/zinc/79/49/71/938794971.db2.gz UDVPRZFVYVKSEU-HSZRJFAPSA-N 2 0 421.585 4.294 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCc3c2cccc3Br)CC1 ZINC000539217187 938820066 /nfs/dbraw/zinc/82/00/66/938820066.db2.gz KYJUUAAZOWRKBM-JOCHJYFZSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1nc2ccccc2n1C ZINC000539218377 938820572 /nfs/dbraw/zinc/82/05/72/938820572.db2.gz RRYLULHKRBVGPB-HXUWFJFHSA-N 2 0 406.574 4.295 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@H](c1ccccc1)N1CCCC1)c1ccccc1O2 ZINC000539369080 938850105 /nfs/dbraw/zinc/85/01/05/938850105.db2.gz BEWYYJBAPYFRAD-BJKOFHAPSA-N 2 0 405.586 4.401 20 0 HIADRP CCCCNC(=O)c1ccc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000539394460 938853943 /nfs/dbraw/zinc/85/39/43/938853943.db2.gz SOYBRUROTXBQLQ-HSZRJFAPSA-N 2 0 421.585 4.294 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCOCc1ccc(Cl)cc1)c1ccccc1O2 ZINC000539406974 938856178 /nfs/dbraw/zinc/85/61/78/938856178.db2.gz LIUINQSJQLOTMU-OAQYLSRUSA-N 2 0 400.950 4.434 20 0 HIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc1F ZINC000563567027 945217430 /nfs/dbraw/zinc/21/74/30/945217430.db2.gz XUKOOAMKKARFIX-RBBKRZOGSA-N 2 0 415.553 4.376 20 0 HIADRP COCCOc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1OC ZINC000539825317 938947317 /nfs/dbraw/zinc/94/73/17/938947317.db2.gz PPXVTYGHOXMETL-UHFFFAOYSA-N 2 0 424.585 4.209 20 0 HIADRP CN(c1ccccc1CNc1cccc(CC[NH+]2CCCC2)c1)C1CC[NH+](C)CC1 ZINC000539872638 938962974 /nfs/dbraw/zinc/96/29/74/938962974.db2.gz PNHXWMHQQDBKJN-UHFFFAOYSA-N 2 0 406.618 4.467 20 0 HIADRP COc1cc(C)c([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc1OC ZINC000540119217 939079830 /nfs/dbraw/zinc/07/98/30/939079830.db2.gz LOCYJAAQBBSOHR-OAQYLSRUSA-N 2 0 411.590 4.265 20 0 HIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000540140956 939088651 /nfs/dbraw/zinc/08/86/51/939088651.db2.gz BPMZZKOUUJUFLP-DYXWJJEUSA-N 2 0 400.588 4.041 20 0 HIADRP CC[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccccc1OCC(=O)N(C)C ZINC000540144322 939089821 /nfs/dbraw/zinc/08/98/21/939089821.db2.gz NCJVBDYKANBCHT-YDPRHXJPSA-N 2 0 415.622 4.237 20 0 HIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(N2CCOCC2)c1 ZINC000540145710 939090740 /nfs/dbraw/zinc/09/07/40/939090740.db2.gz LKOSUFXSAZKUOH-WPFOTENUSA-N 2 0 407.602 4.475 20 0 HIADRP C[C@H](CCc1ccc(Cl)s1)[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000540169714 939102052 /nfs/dbraw/zinc/10/20/52/939102052.db2.gz IBSJSCVSGSCBBB-QGZVFWFLSA-N 2 0 420.022 4.338 20 0 HIADRP CC(C)[C@@H]([NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1)c1ccc2[nH]c(=O)oc2c1 ZINC000540260240 939176296 /nfs/dbraw/zinc/17/62/96/939176296.db2.gz BDDDIOWSDFOYHK-LADGPHEKSA-N 2 0 422.573 4.199 20 0 HIADRP COc1ccccc1[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)C1CCCC1 ZINC000540315255 939191101 /nfs/dbraw/zinc/19/11/01/939191101.db2.gz DXRAQLYTLLCHFQ-XMMPIXPASA-N 2 0 409.574 4.008 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCOc1ccc(C(F)(F)F)cn1)c1ccccc1O2 ZINC000540495430 939275709 /nfs/dbraw/zinc/27/57/09/939275709.db2.gz ZYFHRIHCYVZGKT-GOSISDBHSA-N 2 0 421.463 4.057 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3cc4cccc(OC)c4o3)cc2)CC1 ZINC000540598424 939315604 /nfs/dbraw/zinc/31/56/04/939315604.db2.gz JGMZFYAIOQYECO-LJQANCHMSA-N 2 0 407.558 4.430 20 0 HIADRP CC(C)[NH+]1CCN(c2cccc(N[C@H](C)c3cccc(OCC[NH+](C)C)c3)c2)CC1 ZINC000540748324 939357829 /nfs/dbraw/zinc/35/78/29/939357829.db2.gz XIYBCZYDZAGWQA-OAQYLSRUSA-N 2 0 410.606 4.331 20 0 HIADRP C[C@H](Nc1cccc(C[NH+]2CCSCC2)c1)[C@@H](c1ccccc1)N1CCOCC1 ZINC000540787123 939371805 /nfs/dbraw/zinc/37/18/05/939371805.db2.gz CCZIQYUOYYDSPI-RDPSFJRHSA-N 2 0 411.615 4.109 20 0 HIADRP COC(=O)c1cc2c(o1)c(OC)ccc2C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000540811159 939380190 /nfs/dbraw/zinc/38/01/90/939380190.db2.gz REHHECQALCOLDR-UHFFFAOYSA-N 2 0 408.498 4.114 20 0 HIADRP Cc1ccc([C@@H](C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)N2CCCC2)o1 ZINC000540810421 939380221 /nfs/dbraw/zinc/38/02/21/939380221.db2.gz WZXCMNUZBZBDIG-XMMPIXPASA-N 2 0 410.606 4.045 20 0 HIADRP COc1cccc(C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccccc2)c1 ZINC000540990390 939426357 /nfs/dbraw/zinc/42/63/57/939426357.db2.gz JWQFXNYTDIMRRE-XNMGPUDCSA-N 2 0 416.565 4.335 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)NC2CC[NH+](C3CCCC3)CC2)c1 ZINC000541422575 939511844 /nfs/dbraw/zinc/51/18/44/939511844.db2.gz KKONKWLWRPKYHD-UHFFFAOYSA-N 2 0 405.586 4.455 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000541548819 939551692 /nfs/dbraw/zinc/55/16/92/939551692.db2.gz IEQPLUMKDCEZQT-VQTJNVASSA-N 2 0 410.558 4.464 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000541744982 939619374 /nfs/dbraw/zinc/61/93/74/939619374.db2.gz BJBNOVJQAQMBRS-DHIUTWEWSA-N 2 0 406.636 4.182 20 0 HIADRP OC[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000541882575 939648935 /nfs/dbraw/zinc/64/89/35/939648935.db2.gz ULGFQUCHISLPAL-PDGJWGCVSA-N 2 0 404.476 4.239 20 0 HIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@H](c2cccnc2)c2ccc(F)cc2F)cc1 ZINC000542472894 939828982 /nfs/dbraw/zinc/82/89/82/939828982.db2.gz PPVFIALSBNQBDQ-XMMPIXPASA-N 2 0 411.496 4.222 20 0 HIADRP CC[C@@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Cl)s1 ZINC000542556110 939843103 /nfs/dbraw/zinc/84/31/03/939843103.db2.gz MAWIPBSWWDEPJG-GOSISDBHSA-N 2 0 405.995 4.354 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N(C)[C@@H](C)C2CC[NH+](C)CC2)c1 ZINC000542743404 939858597 /nfs/dbraw/zinc/85/85/97/939858597.db2.gz VVFDJPBSPZPNCK-FQEVSTJZSA-N 2 0 402.627 4.180 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)CCN(C)c2cc[nH+]cc2)cc1)C[C@H]1CCCCO1 ZINC000542784348 939860544 /nfs/dbraw/zinc/86/05/44/939860544.db2.gz PXJFSFLGSYVVSI-XMMPIXPASA-N 2 0 424.589 4.326 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000543403966 940053706 /nfs/dbraw/zinc/05/37/06/940053706.db2.gz IINZOJLTGYBBGS-WOJBJXKFSA-N 2 0 410.558 4.321 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000543417039 940058487 /nfs/dbraw/zinc/05/84/87/940058487.db2.gz KUDMECNKYHFCIQ-UHFFFAOYSA-N 2 0 407.602 4.447 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2c[nH]c3ccc(Br)cc23)[C@H](C)C1 ZINC000543416748 940058502 /nfs/dbraw/zinc/05/85/02/940058502.db2.gz ZZQQNAOFEDFQIN-OXQOHEQNSA-N 2 0 422.411 4.200 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000543420680 940059356 /nfs/dbraw/zinc/05/93/56/940059356.db2.gz BXIUUANKQURJJW-DHLKQENFSA-N 2 0 419.613 4.458 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(-c2ccccc2)s1 ZINC000543594023 940124069 /nfs/dbraw/zinc/12/40/69/940124069.db2.gz FUIDKMLLFNMTOC-HXUWFJFHSA-N 2 0 421.614 4.458 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)s1 ZINC000543777909 940184101 /nfs/dbraw/zinc/18/41/01/940184101.db2.gz XNUVOVBWJYBBAZ-RHSMWYFYSA-N 2 0 409.393 4.318 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N(C)CC[NH+]2CCCC2)cc1)C[C@@H]1CCCCO1 ZINC000543818550 940197203 /nfs/dbraw/zinc/19/72/03/940197203.db2.gz GKWIJQQOZHRIFJ-QHCPKHFHSA-N 2 0 416.610 4.026 20 0 HIADRP CC(C)Cn1cc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)cn1 ZINC000543849252 940207796 /nfs/dbraw/zinc/20/77/96/940207796.db2.gz SMMWFQBPLWQHIG-UHFFFAOYSA-N 2 0 417.601 4.151 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000543910770 940239085 /nfs/dbraw/zinc/23/90/85/940239085.db2.gz WESGPHLFDJECHW-UHFFFAOYSA-N 2 0 414.638 4.195 20 0 HIADRP COc1ccc(Oc2ccc(C[NH2+]C3CC[NH+]([C@@H]4CCCC[C@H]4O)CC3)cc2)cc1 ZINC000544179815 940345325 /nfs/dbraw/zinc/34/53/25/940345325.db2.gz NFHHMQHAYKWJJJ-JWQCQUIFSA-N 2 0 410.558 4.345 20 0 HIADRP Fc1ccc(-c2noc(CCC[NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)n2)cc1 ZINC000544367021 940403192 /nfs/dbraw/zinc/40/31/92/940403192.db2.gz IALXEZAWGUUHGN-MDNUFGMLSA-N 2 0 420.532 4.309 20 0 HIADRP C[C@H]([NH2+]CC[S@@](=O)c1cc(Cl)ccc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544419265 940418816 /nfs/dbraw/zinc/41/88/16/940418816.db2.gz AIKASDUHQGLBDA-SKHRDNQBSA-N 2 0 403.419 4.344 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000546869826 940898512 /nfs/dbraw/zinc/89/85/12/940898512.db2.gz NCBPSIORRAWBQP-HSZRJFAPSA-N 2 0 400.998 4.026 20 0 HIADRP CC[C@H]([NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000548155921 941089842 /nfs/dbraw/zinc/08/98/42/941089842.db2.gz JSKXBVONUVAUKY-NDEVUPSOSA-N 2 0 417.601 4.455 20 0 HIADRP Cc1nc(-c2ccc([C@@H](C)[NH2+]CC(=O)NC[C@@H](c3ccccc3)[NH+](C)C)cc2)cs1 ZINC000548442491 941104359 /nfs/dbraw/zinc/10/43/59/941104359.db2.gz DZERXWBDOTURAT-HXOBKFHXSA-N 2 0 422.598 4.188 20 0 HIADRP Cc1nc(-c2ccc([C@H](C)[NH2+]CC(=O)NC[C@H](c3ccccc3)[NH+](C)C)cc2)cs1 ZINC000548442490 941104480 /nfs/dbraw/zinc/10/44/80/941104480.db2.gz DZERXWBDOTURAT-GAJHUEQPSA-N 2 0 422.598 4.188 20 0 HIADRP C[C@H]1C[C@@H](N(C)C(=O)c2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000549381711 941184443 /nfs/dbraw/zinc/18/44/43/941184443.db2.gz UDWVSOSWFCOMFC-OFVILXPXSA-N 2 0 405.586 4.408 20 0 HIADRP C[C@@H](c1ccc(F)cc1)N1CC[C@@H](N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)C1=O ZINC000549446486 941190884 /nfs/dbraw/zinc/19/08/84/941190884.db2.gz SUUJZZNNECMEFL-QTDGGUCWSA-N 2 0 401.570 4.074 20 0 HIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000549877312 941224143 /nfs/dbraw/zinc/22/41/43/941224143.db2.gz ITLURZBKUVXJIT-QHCPKHFHSA-N 2 0 424.633 4.273 20 0 HIADRP Fc1ccc2cc(C[NH2+]C[C@@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)[nH]c2c1 ZINC000549879882 941225435 /nfs/dbraw/zinc/22/54/35/941225435.db2.gz OEGUFBSAKDREFK-OAQYLSRUSA-N 2 0 407.533 4.325 20 0 HIADRP CC(C)[C@]1(CO)CCC[NH+](Cc2cccc(C[N@H+]3CCC[C@@](CO)(C(C)C)C3)c2)C1 ZINC000550433506 941326855 /nfs/dbraw/zinc/32/68/55/941326855.db2.gz LWXSNONHHQZXGQ-CLJLJLNGSA-N 2 0 416.650 4.148 20 0 HIADRP COc1ccccc1C[C@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550885982 941379285 /nfs/dbraw/zinc/37/92/85/941379285.db2.gz LSSPVCCWZRKLKO-URXFXBBRSA-N 2 0 408.586 4.145 20 0 HIADRP Cc1c([C@@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cnn1C(C)C ZINC000551264720 941438698 /nfs/dbraw/zinc/43/86/98/941438698.db2.gz MNHSTDGNNYGSSY-NFBKMPQASA-N 2 0 410.606 4.352 20 0 HIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000551263860 941438758 /nfs/dbraw/zinc/43/87/58/941438758.db2.gz VDEJSEYYTAQTHG-RDPSFJRHSA-N 2 0 421.585 4.224 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+]Cc2ccc3c(c2)C(=O)NCC3)c2ccc(F)cc2)CC1 ZINC000551286290 941444151 /nfs/dbraw/zinc/44/41/51/941444151.db2.gz KQZMIIIDXDWTFW-VWLOTQADSA-N 2 0 423.576 4.455 20 0 HIADRP C[NH+]1CCCC[C@@H]1CCSc1nnc(SCC[C@H]2CCCC[N@H+]2C)s1 ZINC000551363148 941461654 /nfs/dbraw/zinc/46/16/54/941461654.db2.gz QKGVVGMHDVPIMN-HZPDHXFCSA-N 2 0 400.683 4.471 20 0 HIADRP O=C(C[NH2+][C@H]1CCCCC[C@@H]1c1ccc(Cl)cc1)NC1CC[NH+](C2CC2)CC1 ZINC000551425232 941476456 /nfs/dbraw/zinc/47/64/56/941476456.db2.gz WUIFCBVYAWTFNV-YADHBBJMSA-N 2 0 403.998 4.089 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+][C@@H]3CCC[C@@H]3c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000551787871 941545601 /nfs/dbraw/zinc/54/56/01/941545601.db2.gz NSIOVEGMQVEVDK-FGZHOGPDSA-N 2 0 409.540 4.490 20 0 HIADRP CCn1nccc1[C@@H]1OCC[C@H]1C[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000552054083 941574820 /nfs/dbraw/zinc/57/48/20/941574820.db2.gz JQVXLCRSXRQLMC-IIDPJMFPSA-N 2 0 422.617 4.261 20 0 HIADRP CCO[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C12CCOCC2 ZINC000552065704 941577700 /nfs/dbraw/zinc/57/77/00/941577700.db2.gz KMTIJZPSWXYEIL-MBWGTIHESA-N 2 0 412.618 4.241 20 0 HIADRP C[NH+](C)C1CCC([NH2+][C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000552252627 941614582 /nfs/dbraw/zinc/61/45/82/941614582.db2.gz RWWAXCCSVNSHBL-AOMIVXANSA-N 2 0 421.006 4.295 20 0 HIADRP COc1cc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)c(-c2ccccc2)cc1OC ZINC000552497685 941688776 /nfs/dbraw/zinc/68/87/76/941688776.db2.gz UHQHZOFAYJOBEK-MDNUFGMLSA-N 2 0 410.558 4.054 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H](C)C(C)(C)c2ccccc2)CC1 ZINC000552946984 941806534 /nfs/dbraw/zinc/80/65/34/941806534.db2.gz FDPCCNXKOJOIMR-NRFANRHFSA-N 2 0 407.602 4.032 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC2CC[NH+](CCc3ccc(F)cc3)CC2)CC1 ZINC000554635901 942181993 /nfs/dbraw/zinc/18/19/93/942181993.db2.gz DHOQEQRWSXGMBV-UHFFFAOYSA-N 2 0 409.593 4.395 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2cc(-c3ccccc3)cs2)CC1 ZINC000554875692 942303979 /nfs/dbraw/zinc/30/39/79/942303979.db2.gz NIRKAWZEEINVIS-UHFFFAOYSA-N 2 0 413.631 4.475 20 0 HIADRP CSC1(C[NH2+][C@@H](c2ccc(Br)cc2F)C2CC2)CC[NH+](C)CC1 ZINC000554998940 942349841 /nfs/dbraw/zinc/34/98/41/942349841.db2.gz XVNJPMFSOKNQSZ-QGZVFWFLSA-N 2 0 401.389 4.456 20 0 HIADRP c1coc(-c2ncc(C[NH2+]C[C@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)s2)c1 ZINC000555612568 942669349 /nfs/dbraw/zinc/66/93/49/942669349.db2.gz TYUSTILHTQSGLU-FQEVSTJZSA-N 2 0 423.582 4.422 20 0 HIADRP CCCOc1cccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000555612693 942669825 /nfs/dbraw/zinc/66/98/25/942669825.db2.gz ZYOVLRCIVNHYFJ-DEOSSOPVSA-N 2 0 408.586 4.494 20 0 HIADRP COc1cc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc(Cl)c1OC ZINC000556405096 942858201 /nfs/dbraw/zinc/85/82/01/942858201.db2.gz TXRPVHCAXZZURF-UHFFFAOYSA-N 2 0 404.938 4.120 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC[C@@H]3c3cccc(C(F)(F)F)c3)cn2)CC1 ZINC000556589238 942908151 /nfs/dbraw/zinc/90/81/51/942908151.db2.gz QFLJVHAMZHLFCZ-RTWAWAEBSA-N 2 0 418.507 4.278 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]CCCc4nnc5n4CCCCC5)[C@H]3C2)cc1 ZINC000556870677 942945626 /nfs/dbraw/zinc/94/56/26/942945626.db2.gz GUBSJRZUJFJUOI-KMDXXIMOSA-N 2 0 421.633 4.218 20 0 HIADRP O=C([C@@H]1CC[N@@H+](C2CCCCC2)C1)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000558304200 943494810 /nfs/dbraw/zinc/49/48/10/943494810.db2.gz SLZNLQPQGYUYNY-HSZRJFAPSA-N 2 0 409.618 4.156 20 0 HIADRP CSC1(C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2OC(F)F)CC[NH+](C)CC1 ZINC000558507031 943579476 /nfs/dbraw/zinc/57/94/76/943579476.db2.gz CHZASLGQNGDGNB-LBPRGKRZSA-N 2 0 410.477 4.367 20 0 HIADRP CC[C@H](C)[N@H+](C)CCNC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000558770425 943653953 /nfs/dbraw/zinc/65/39/53/943653953.db2.gz AVJNVFPNNUTWER-PHASAHSISA-N 2 0 421.029 4.283 20 0 HIADRP C[NH+](C)CCN(Cc1ccccc1)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000558956758 943771214 /nfs/dbraw/zinc/77/12/14/943771214.db2.gz KOTCIXGQDHFPMD-DEOSSOPVSA-N 2 0 422.617 4.061 20 0 HIADRP Brc1ccc2c(c1)CCCC[C@H]2[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000558972617 943778030 /nfs/dbraw/zinc/77/80/30/943778030.db2.gz WYIYEMGLSZZHHR-HRAATJIYSA-N 2 0 407.396 4.307 20 0 HIADRP Cc1ccc(C[NH+]2CCC(CC[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c(-c2ccnn2C)c1 ZINC000559068595 943823442 /nfs/dbraw/zinc/82/34/42/943823442.db2.gz YFDOIQPZJYHARS-SFTDATJTSA-N 2 0 410.606 4.107 20 0 HIADRP Clc1cccc(N2CCOCC2)c1C[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000559258461 943886761 /nfs/dbraw/zinc/88/67/61/943886761.db2.gz UMMULWCPPTTYCR-UHFFFAOYSA-N 2 0 420.022 4.240 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+]Cc3ccccc3OCC3CC3)C3(C2)CCOCC3)cc1 ZINC000559327251 943896980 /nfs/dbraw/zinc/89/69/80/943896980.db2.gz YTZDPDLQEROJKL-RUZDIDTESA-N 2 0 420.597 4.494 20 0 HIADRP COCCC1(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)CCCCC1 ZINC000559330063 943897146 /nfs/dbraw/zinc/89/71/46/943897146.db2.gz JBISYLMYJWDQNP-DEOSSOPVSA-N 2 0 414.634 4.492 20 0 HIADRP COc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c(C)c1OC ZINC000559326937 943897450 /nfs/dbraw/zinc/89/74/50/943897450.db2.gz SSGODIPYBWUONE-QHCPKHFHSA-N 2 0 424.585 4.031 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)c2ccc3c[nH+]cn3c2)cc1)C[C@H]1CCCCO1 ZINC000559618554 944017954 /nfs/dbraw/zinc/01/79/54/944017954.db2.gz GYHCMJPTNNUXHL-HSZRJFAPSA-N 2 0 406.530 4.366 20 0 HIADRP COc1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000559892322 944077238 /nfs/dbraw/zinc/07/72/38/944077238.db2.gz ICGREYYMYZHYPB-QPPBQGQZSA-N 2 0 406.570 4.201 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccccc3OCc3ccccn3)cc2)CC1 ZINC000560070760 944148554 /nfs/dbraw/zinc/14/85/54/944148554.db2.gz BYJJTEAIZPEYBG-UHFFFAOYSA-N 2 0 417.553 4.423 20 0 HIADRP COc1cc(OC)c(OC)cc1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000560572736 944259344 /nfs/dbraw/zinc/25/93/44/944259344.db2.gz BCXGNBFCIOJZBW-UHFFFAOYSA-N 2 0 410.558 4.201 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000561279749 944537231 /nfs/dbraw/zinc/53/72/31/944537231.db2.gz RMYSJLZCAXFNEY-AREMUKBSSA-N 2 0 403.570 4.021 20 0 HIADRP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000564387355 945548024 /nfs/dbraw/zinc/54/80/24/945548024.db2.gz JMQAPCBWAOICMF-NJYVYQBISA-N 2 0 414.638 4.036 20 0 HIADRP COCCC[C@@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccc(Br)cc1 ZINC000564433985 945583739 /nfs/dbraw/zinc/58/37/39/945583739.db2.gz KUEKHENYCFZICI-GOSISDBHSA-N 2 0 415.441 4.334 20 0 HIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000565379157 945819342 /nfs/dbraw/zinc/81/93/42/945819342.db2.gz WTEXCWAUGYJPQH-ZCNNSNEGSA-N 2 0 400.485 4.394 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccccc1-n1ccnn1 ZINC000565413041 945827205 /nfs/dbraw/zinc/82/72/05/945827205.db2.gz LLGRZNMGIZBCCE-IBGZPJMESA-N 2 0 401.514 4.343 20 0 HIADRP c1[nH]c2ncccc2c1C1CC[NH+](C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1 ZINC000565495952 945838222 /nfs/dbraw/zinc/83/82/22/945838222.db2.gz DEFBSCQNCQYURD-JOCHJYFZSA-N 2 0 404.558 4.033 20 0 HIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]Cc1ccncc1OCC[NH+](C)C ZINC000566996642 946207696 /nfs/dbraw/zinc/20/76/96/946207696.db2.gz JNPCZUGJKNAMIY-LSDHHAIUSA-N 2 0 412.361 4.274 20 0 HIADRP COCC(=O)Nc1cccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000567495542 946350755 /nfs/dbraw/zinc/35/07/55/946350755.db2.gz LHIQKXZWBBLHMC-PZUNEJSGSA-N 2 0 421.585 4.052 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CCCc2cc(Br)ccc21 ZINC000568321008 946505622 /nfs/dbraw/zinc/50/56/22/946505622.db2.gz WMUZABKYRRJMRV-HXUWFJFHSA-N 2 0 418.379 4.342 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)[NH+](C)C)CC1 ZINC000569282623 946849105 /nfs/dbraw/zinc/84/91/05/946849105.db2.gz GCYSQYVCDTWMAE-VWLOTQADSA-N 2 0 422.617 4.224 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CCCN(c2ccccc2F)CC1)C1CC[NH+](C)CC1 ZINC000569768378 947000334 /nfs/dbraw/zinc/00/03/34/947000334.db2.gz DZLJWRJNHJDJDC-UHFFFAOYSA-N 2 0 410.581 4.068 20 0 HIADRP C[C@@H]1C[N@H+](CC(Cc2ccccc2)Cc2ccccc2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000570559606 947299135 /nfs/dbraw/zinc/29/91/35/947299135.db2.gz IZCYHWLTJZPRIA-YIXXDRMTSA-N 2 0 405.630 4.046 20 0 HIADRP COc1ncc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1Cl ZINC000570913670 947392163 /nfs/dbraw/zinc/39/21/63/947392163.db2.gz OATQVNLAJMQYKV-BBWFWOEESA-N 2 0 403.954 4.204 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)NC[C@H](C2CCCCC2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000571007171 947429722 /nfs/dbraw/zinc/42/97/22/947429722.db2.gz AIBRIACIAWCREW-FGCOXFRFSA-N 2 0 414.638 4.191 20 0 HIADRP Cc1ccc(C[N@@H+]2C[C@H]3CC[NH+](Cc4ccccc4)C[C@H]3C2)c(-c2cnn(C)c2)c1 ZINC000571098251 947495737 /nfs/dbraw/zinc/49/57/37/947495737.db2.gz LDFKYZOCMWPTQW-RDGATRHJSA-N 2 0 400.570 4.349 20 0 HIADRP Clc1ccc([C@@H](C2CCOCC2)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000571268624 947576134 /nfs/dbraw/zinc/57/61/34/947576134.db2.gz FYSSIPQOWGTAGM-QHCPKHFHSA-N 2 0 406.998 4.385 20 0 HIADRP Cc1ccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c(-c2ccnn2C)c1 ZINC000571771850 947776250 /nfs/dbraw/zinc/77/62/50/947776250.db2.gz TUDWSZYFPDVDIL-UHFFFAOYSA-N 2 0 423.649 4.024 20 0 HIADRP CSC1(C[NH2+]Cc2ccc(Br)cc2C(F)(F)F)CC[NH+](C)CC1 ZINC000572171070 947855991 /nfs/dbraw/zinc/85/59/91/947855991.db2.gz WYUTYFVVUHGCMP-UHFFFAOYSA-N 2 0 411.331 4.385 20 0 HIADRP COc1ncc([C@H](C)[NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)cc1Cl ZINC000572742323 947997848 /nfs/dbraw/zinc/99/78/48/947997848.db2.gz KDUUKPBRCSFDTN-KRWDZBQOSA-N 2 0 403.954 4.112 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000573268636 948130363 /nfs/dbraw/zinc/13/03/63/948130363.db2.gz GEFKTJGGBCVIJA-AWEZNQCLSA-N 2 0 422.333 4.146 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H](CO)Cc2ccc(F)c(F)c2)CC1 ZINC000575820155 948723660 /nfs/dbraw/zinc/72/36/60/948723660.db2.gz RITBOMANVXXICC-ITAUSPCMSA-N 2 0 402.529 4.149 20 0 HIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@H]2CC[NH+]3Cc2cccnc2)nc1 ZINC001164732088 720472667 /nfs/dbraw/zinc/47/26/67/720472667.db2.gz YNTUFGGWCCMPAP-TZRRMPRUSA-N 2 0 405.590 4.267 20 0 HIADRP CC[N@@H+]1CCCC[C@H]1c1ccc(N([C@H]2COC3(C2)CC[NH2+]CC3)C(C)(C)C)nc1 ZINC001164736043 720547179 /nfs/dbraw/zinc/54/71/79/720547179.db2.gz URNXJFRCMHJGKM-RTWAWAEBSA-N 2 0 400.611 4.145 20 0 HIADRP c1ccc(C[N@@H+]2CCc3nc(N4CCCC[C@@H]4CC[NH+]4CCCC4)ccc3C2)cc1 ZINC001165049013 721968449 /nfs/dbraw/zinc/96/84/49/721968449.db2.gz QTMCHDMTZADGHG-XMMPIXPASA-N 2 0 404.602 4.485 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3C[C@H]4[C@H](C3)c3ccccc3[C@H]4OCC3CC3)c2)CC1 ZINC001164975184 722171650 /nfs/dbraw/zinc/17/16/50/722171650.db2.gz HUCCNYMLULUTOI-RMTZWNOUSA-N 2 0 419.569 4.256 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2cc3c(cccc3F)[nH]2)CC1 ZINC000436253552 861564438 /nfs/dbraw/zinc/56/44/38/861564438.db2.gz NIPYBTMLNGRRPD-UHFFFAOYSA-N 2 0 420.454 4.367 20 0 HIADRP COc1cc(C[NH2+]Cc2ccc(C[NH+](C)C)cc2)ccc1OCc1c(C)noc1C ZINC000017319493 846245928 /nfs/dbraw/zinc/24/59/28/846245928.db2.gz SZDCWQFHQNZHPT-UHFFFAOYSA-N 2 0 409.530 4.230 20 0 HIADRP CC[NH+]1CCC(C[NH2+]Cc2cc(Br)cc(Br)c2OC)CC1 ZINC000044517753 848564788 /nfs/dbraw/zinc/56/47/88/848564788.db2.gz DTEXWBFBKVPRCS-UHFFFAOYSA-N 2 0 420.189 4.042 20 0 HIADRP CCOc1c(Br)cc(C[NH2+]CCCC[NH+](C)C)cc1Br ZINC000045598423 848699044 /nfs/dbraw/zinc/69/90/44/848699044.db2.gz BJRVEZREZHXJEK-UHFFFAOYSA-N 2 0 408.178 4.042 20 0 HIADRP COc1cc(-c2nc(C[N@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)cs2)ccc1O ZINC000436950098 862128820 /nfs/dbraw/zinc/12/88/20/862128820.db2.gz YEMKEYUAOTUYNO-UHFFFAOYSA-N 2 0 424.570 4.268 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccsc1 ZINC000061521080 851394339 /nfs/dbraw/zinc/39/43/39/851394339.db2.gz ZWHUKFAYIFNMQJ-QFIPXVFZSA-N 2 0 414.619 4.226 20 0 HIADRP O=C(NC[C@H](c1ccccc1)[NH+]1CCCC1)NC1CC[NH+](CC2CCCCC2)CC1 ZINC000062529847 851571680 /nfs/dbraw/zinc/57/16/80/851571680.db2.gz YMRWSRVQAPNWTM-XMMPIXPASA-N 2 0 412.622 4.167 20 0 HIADRP FC(F)(F)CN1CCC(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000437071734 862267671 /nfs/dbraw/zinc/26/76/71/862267671.db2.gz IMLCHUXXXYFHOS-FDFHNCONSA-N 2 0 409.540 4.151 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NC[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000063464008 851695432 /nfs/dbraw/zinc/69/54/32/851695432.db2.gz SGGJVXLHOONTRV-HSZRJFAPSA-N 2 0 422.617 4.240 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N2CCC(C[NH+]3CCCCCC3)CC2)C1 ZINC000065522670 852166348 /nfs/dbraw/zinc/16/63/48/852166348.db2.gz PSNSIRSAACDPLZ-URXFXBBRSA-N 2 0 412.622 4.120 20 0 HIADRP CC(C)[C@H](C[NH2+]Cc1ccc(Oc2cc(F)cc(F)c2)cc1)N1CC[NH+](C)CC1 ZINC000065890269 852304989 /nfs/dbraw/zinc/30/49/89/852304989.db2.gz JDQUAYUAEYTZEY-QHCPKHFHSA-N 2 0 403.517 4.119 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2F)cc1 ZINC000065937661 852327038 /nfs/dbraw/zinc/32/70/38/852327038.db2.gz CHBKRGVALFTVDJ-UHFFFAOYSA-N 2 0 403.517 4.011 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC2CC[NH+](CC3CCCCC3)CC2)cc1 ZINC000066038069 852362795 /nfs/dbraw/zinc/36/27/95/852362795.db2.gz GESNDWSVPDRZKI-UHFFFAOYSA-N 2 0 414.638 4.372 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000071902077 852427495 /nfs/dbraw/zinc/42/74/95/852427495.db2.gz CLNMCDPJEDHELX-UHFFFAOYSA-N 2 0 424.589 4.193 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)Nc1ccc(N2CC[NH+](CC)CC2)cc1C)c1ccccc1 ZINC000111034112 853190010 /nfs/dbraw/zinc/19/00/10/853190010.db2.gz WRLLDMCYHXJFLT-DEOSSOPVSA-N 2 0 408.590 4.159 20 0 HIADRP CC(C)c1nn(-c2ccccc2)c(Cl)c1C[NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1 ZINC000236688302 853912205 /nfs/dbraw/zinc/91/22/05/853912205.db2.gz BGFLNONVTSCUJG-NRFANRHFSA-N 2 0 418.029 4.011 20 0 HIADRP c1cnn(-c2ccc(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)cc2)c1 ZINC000236721785 853915517 /nfs/dbraw/zinc/91/55/17/853915517.db2.gz ZHOIJLXJZCHRPB-UHFFFAOYSA-N 2 0 404.558 4.033 20 0 HIADRP c1csc(-c2n[nH]cc2C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000236712306 853915589 /nfs/dbraw/zinc/91/55/89/853915589.db2.gz QOJWAIDBIBMMOS-UHFFFAOYSA-N 2 0 410.587 4.299 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(-n3ccnc3)cc2)CC1 ZINC000236853069 853928970 /nfs/dbraw/zinc/92/89/70/853928970.db2.gz NMGKGNUZYXUUOH-IBGZPJMESA-N 2 0 407.537 4.004 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2ccc(-c3cccc(Br)c3)s2)CC1 ZINC000236974087 853945523 /nfs/dbraw/zinc/94/55/23/853945523.db2.gz FSSGKGIXJFDLIZ-INIZCTEOSA-N 2 0 422.436 4.293 20 0 HIADRP Cc1ccc(COc2ccc(C[NH2+]Cc3ccnc(N4CC[NH+](C)CC4)c3)cc2)cc1 ZINC000237105216 853965593 /nfs/dbraw/zinc/96/55/93/853965593.db2.gz ROMVTHHWHZZOIR-UHFFFAOYSA-N 2 0 416.569 4.011 20 0 HIADRP Cc1ccc(-c2ccc(C[NH2+]Cc3ccc(C(=O)NCC[NH+](C)C)cc3)s2)cc1 ZINC000237177264 853976765 /nfs/dbraw/zinc/97/67/65/853976765.db2.gz OGJJJTCXQIXVGG-UHFFFAOYSA-N 2 0 407.583 4.305 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc(Cl)c1OC ZINC000237215963 853984714 /nfs/dbraw/zinc/98/47/14/853984714.db2.gz UJTRPGZTZIOKIN-IRXDYDNUSA-N 2 0 418.965 4.256 20 0 HIADRP COc1cc2c(c(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)c1)O[C@@H](C)C2 ZINC000237396099 854022346 /nfs/dbraw/zinc/02/23/46/854022346.db2.gz GYZSYGVGKMLXSH-FQEVSTJZSA-N 2 0 424.585 4.180 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Br)cc2)C[C@@H](C)O1 ZINC000237411645 854026698 /nfs/dbraw/zinc/02/66/98/854026698.db2.gz ITJUMPWYGFVFMG-IAGOWNOFSA-N 2 0 403.364 4.348 20 0 HIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)c1 ZINC000237451608 854035872 /nfs/dbraw/zinc/03/58/72/854035872.db2.gz XKXJTSOWLXXCTP-VSKRKVRLSA-N 2 0 423.601 4.420 20 0 HIADRP Cc1nn(-c2ccccc2)cc1C[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000237575219 854057007 /nfs/dbraw/zinc/05/70/07/854057007.db2.gz ATRDFPMDHNVDMW-WOJBJXKFSA-N 2 0 404.558 4.080 20 0 HIADRP C[C@H](C[NH2+]Cc1ccc(-c2ccc(C(F)(F)F)cc2)s1)CN1CC[NH+](C)CC1 ZINC000237578741 854057090 /nfs/dbraw/zinc/05/70/90/854057090.db2.gz SYJWHMNHZCFMED-MRXNPFEDSA-N 2 0 411.537 4.407 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccc(-c4ccccc4)s3)c2)C1 ZINC000237940341 854122805 /nfs/dbraw/zinc/12/28/05/854122805.db2.gz FYTHAXOWSHUGRG-QFIPXVFZSA-N 2 0 419.594 4.402 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+]Cc1sc(Sc2ccccc2)nc1Cl ZINC000237978251 854128863 /nfs/dbraw/zinc/12/88/63/854128863.db2.gz XIJGUGTVKDKGNT-OAHLLOKOSA-N 2 0 412.024 4.274 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2csc(-c3ccc4c(c3)OCO4)n2)CC1 ZINC000303099846 854760079 /nfs/dbraw/zinc/76/00/79/854760079.db2.gz BQWCPRSPXQCICA-UHFFFAOYSA-N 2 0 401.576 4.483 20 0 HIADRP COc1ccc2cc(CN(C)C(=O)[C@H](C)[NH+]3CCC(C[NH+]4CCCC4)CC3)ccc2c1 ZINC000303144160 854783515 /nfs/dbraw/zinc/78/35/15/854783515.db2.gz DIYJTJVPERCHND-FQEVSTJZSA-N 2 0 423.601 4.003 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NCCCC[N@@H+]2CCC[C@H](C)C2)CC1 ZINC000303630920 855089183 /nfs/dbraw/zinc/08/91/83/855089183.db2.gz FRVIEDQBCHIMGJ-LEWJYISDSA-N 2 0 400.611 4.023 20 0 HIADRP CC(C)(C)OC(=O)N1CCC[C@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000309689653 855363226 /nfs/dbraw/zinc/36/32/26/855363226.db2.gz CNGZEEIKEJVHPZ-VXKWHMMOSA-N 2 0 401.595 4.278 20 0 HIADRP C[C@H]([NH2+]C1CCC(NC(=O)OC(C)(C)C)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309722474 855364302 /nfs/dbraw/zinc/36/43/02/855364302.db2.gz OGLDSAHXOGJMBA-GRTSPXDGSA-N 2 0 401.595 4.323 20 0 HIADRP CC(C)(C)OC(=O)N1CCC[C@H]([NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000309710182 855364543 /nfs/dbraw/zinc/36/45/43/855364543.db2.gz JAAARKXARXPWCX-URXFXBBRSA-N 2 0 401.595 4.278 20 0 HIADRP COc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1Br ZINC000310788940 855367349 /nfs/dbraw/zinc/36/73/49/855367349.db2.gz DEWAFJMDDKKIRN-VQIMIIECSA-N 2 0 403.364 4.458 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)NC[C@H](c2cccs2)[NH+](C)C)CC1 ZINC000410336936 855936249 /nfs/dbraw/zinc/93/62/49/855936249.db2.gz GDCQUOXQMDRFOA-OAQYLSRUSA-N 2 0 414.619 4.082 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)NCCCC[N@@H+]2CCC[C@H](C)C2)CC1 ZINC000410344748 855939293 /nfs/dbraw/zinc/93/92/93/855939293.db2.gz LLONMLJPQSCOLM-QFIPXVFZSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N[C@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000410347095 855941794 /nfs/dbraw/zinc/94/17/94/855941794.db2.gz YSGFTJGLCYOVMN-BWKNWUBXSA-N 2 0 420.601 4.135 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC[C@@H](c3ccsc3)[NH+](C)C)cc2)C1 ZINC000410370094 855955790 /nfs/dbraw/zinc/95/57/90/855955790.db2.gz XFSICNWKCDANDI-AVRDEDQJSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NCc2ccccc2C[NH+]2CCCC[C@@H]2C)C1 ZINC000410372532 855958016 /nfs/dbraw/zinc/95/80/16/855958016.db2.gz OHGYXUOZQQSRGU-YADHBBJMSA-N 2 0 414.638 4.372 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000425926531 856002964 /nfs/dbraw/zinc/00/29/64/856002964.db2.gz YLGLXHWPHUTDRE-HSZRJFAPSA-N 2 0 400.998 4.026 20 0 HIADRP C[NH+](C)CCCN(C(=O)C1CC[NH+](C2CC2)CC1)C(c1ccccc1)c1ccccc1 ZINC000426456936 856299193 /nfs/dbraw/zinc/29/91/93/856299193.db2.gz GOLOQCPQAPHSIJ-UHFFFAOYSA-N 2 0 419.613 4.431 20 0 HIADRP C[C@H]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000437461967 862825707 /nfs/dbraw/zinc/82/57/07/862825707.db2.gz MFRQAUSGUFOXBS-XUZZJYLKSA-N 2 0 423.576 4.161 20 0 HIADRP Cc1ccc([C@@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)C2CCC2)cc1 ZINC000427694477 856911240 /nfs/dbraw/zinc/91/12/40/856911240.db2.gz JJDKJRUKEZNLPM-DQEYMECFSA-N 2 0 405.586 4.323 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[NH+]2CCCC2)o1 ZINC000428688192 857297737 /nfs/dbraw/zinc/29/77/37/857297737.db2.gz ZJOPVQDGEWNJDL-VJBMBRPKSA-N 2 0 424.589 4.077 20 0 HIADRP COc1ccccc1-n1nccc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000430028143 858002039 /nfs/dbraw/zinc/00/20/39/858002039.db2.gz UNVRJJMPNYREHY-HXUWFJFHSA-N 2 0 404.558 4.403 20 0 HIADRP COc1ccccc1-n1nccc1C[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000430028476 858002788 /nfs/dbraw/zinc/00/27/88/858002788.db2.gz SNSDITKLVINXJI-UHFFFAOYSA-N 2 0 404.558 4.403 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)C2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000430620733 858238264 /nfs/dbraw/zinc/23/82/64/858238264.db2.gz BQAXPVZAGMTFGU-OFVILXPXSA-N 2 0 405.586 4.068 20 0 HIADRP C[C@H](c1ccc(OC(F)F)cc1)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430939948 858376791 /nfs/dbraw/zinc/37/67/91/858376791.db2.gz NBNKSAOIWFNPIB-GOSISDBHSA-N 2 0 409.565 4.477 20 0 HIADRP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000431339182 858571749 /nfs/dbraw/zinc/57/17/49/858571749.db2.gz XKLYWGCHPTVBME-HXUWFJFHSA-N 2 0 422.013 4.078 20 0 HIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000431354277 858576589 /nfs/dbraw/zinc/57/65/89/858576589.db2.gz WSFMACYUQHKFLJ-HSZRJFAPSA-N 2 0 409.574 4.105 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)NC2CC[NH+]([C@H](C)c3ccccc3)CC2)CC1 ZINC000431622792 858694687 /nfs/dbraw/zinc/69/46/87/858694687.db2.gz QCVUTKPPCKHTHK-OAQYLSRUSA-N 2 0 414.638 4.269 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CC1 ZINC000431626620 858698098 /nfs/dbraw/zinc/69/80/98/858698098.db2.gz WMQRYSLVPFDGMA-UNMCSNQZSA-N 2 0 420.667 4.188 20 0 HIADRP C[C@H]1C[C@H](NC(=O)NC2CC[NH+](C3CCCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000431667319 858725444 /nfs/dbraw/zinc/72/54/44/858725444.db2.gz YMWDMUWKAKRDQN-NZQKXSOJSA-N 2 0 412.622 4.136 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)Nc1cccc(OCC[NH+](C)C)c1 ZINC000437735207 863062643 /nfs/dbraw/zinc/06/26/43/863062643.db2.gz RXHFLPSHHWUKNV-JOCHJYFZSA-N 2 0 424.589 4.003 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CC(c3cccc(Br)c3)C2)[C@H](C)C1 ZINC000432414983 859153797 /nfs/dbraw/zinc/15/37/97/859153797.db2.gz UMUJEDPNQGUDTF-RWCFQUGRSA-N 2 0 409.412 4.422 20 0 HIADRP C[C@H](c1ccccc1)N(C)C(=O)C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433174253 859553981 /nfs/dbraw/zinc/55/39/81/859553981.db2.gz IUDVZVRMZCPGTI-JOCHJYFZSA-N 2 0 405.586 4.194 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)c1 ZINC000467748237 881550985 /nfs/dbraw/zinc/55/09/85/881550985.db2.gz VIBHSDQSHSULBP-ZEQRLZLVSA-N 2 0 416.009 4.342 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cc2sc(C)nc2cc1Cl ZINC000435182517 860683684 /nfs/dbraw/zinc/68/36/84/860683684.db2.gz RPDBPSWLQFZLAI-HNNXBMFYSA-N 2 0 424.014 4.138 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(Cl)c1OC(C)C ZINC000438495462 863915838 /nfs/dbraw/zinc/91/58/38/863915838.db2.gz VXWCTJPMEDVLTF-QGZVFWFLSA-N 2 0 410.990 4.007 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)CC1 ZINC000438832683 864327258 /nfs/dbraw/zinc/32/72/58/864327258.db2.gz FNLVUQVQVPDOMJ-UHFFFAOYSA-N 3 0 421.629 4.176 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)NC2(C[NH+](C)C)CCC2)cc1)C[C@@H]1CCCCO1 ZINC000439373082 864806865 /nfs/dbraw/zinc/80/68/65/864806865.db2.gz SJQRFCFFTBPBFE-QFIPXVFZSA-N 2 0 416.610 4.072 20 0 HIADRP COc1ccc(NC(=O)[C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)cc1 ZINC000439610868 864932406 /nfs/dbraw/zinc/93/24/06/864932406.db2.gz MSGTVOQNRHRTIV-SFHVURJKSA-N 2 0 407.514 4.037 20 0 HIADRP CCC[NH+]1CCC(N(C)C(=O)NC[C@H](CC(C)C)[NH2+][C@@H](C)c2ccccc2)CC1 ZINC000468015052 881853158 /nfs/dbraw/zinc/85/31/58/881853158.db2.gz AUDMBISQMKKGBM-UNMCSNQZSA-N 2 0 402.627 4.268 20 0 HIADRP Cc1ccc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1NC(=O)CC[NH+](C)C ZINC000468039000 881869502 /nfs/dbraw/zinc/86/95/02/881869502.db2.gz NIXAREMRIIVUIW-OFNKIYASSA-N 2 0 408.590 4.350 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc3cc(Br)ccc3[nH]2)[C@H](C)C1 ZINC000468049640 881875527 /nfs/dbraw/zinc/87/55/27/881875527.db2.gz OSNOLZISIKFKBI-BEFAXECRSA-N 2 0 408.384 4.157 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(CCC(F)(F)F)c1 ZINC000441089535 866183694 /nfs/dbraw/zinc/18/36/94/866183694.db2.gz BJIBDHKMCQLSJG-LJQANCHMSA-N 2 0 414.516 4.061 20 0 HIADRP COc1ccc2cc(CN(C)C(=O)[C@H](C)N(C)CC[C@H]3CCCC[N@@H+]3C)ccc2c1 ZINC000441327243 866398149 /nfs/dbraw/zinc/39/81/49/866398149.db2.gz GKNOBYARVCANMI-WMZHIEFXSA-N 2 0 411.590 4.002 20 0 HIADRP Cc1ccccc1[C@H](OC[C@@H](O)C[N@H+](C)CC[C@H]1CCCC[NH+]1C)c1ccccc1 ZINC000441364261 866434375 /nfs/dbraw/zinc/43/43/75/866434375.db2.gz ZACFCDUQCDNCID-RMTZWNOUSA-N 2 0 410.602 4.268 20 0 HIADRP Cc1ccc([C@H](OC[C@H](O)C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c2ccccc2)cc1 ZINC000441460635 866536554 /nfs/dbraw/zinc/53/65/54/866536554.db2.gz YYVDASFUOPACJL-XSBVVTFOSA-N 2 0 422.613 4.270 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC1 ZINC000442007822 867062157 /nfs/dbraw/zinc/06/21/57/867062157.db2.gz WJBDNGDTLZLPFU-UHFFFAOYSA-N 2 0 417.395 4.460 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H]3CC[C@H](c4ccc(C(F)(F)F)cc4)C3)ccn2)CC1 ZINC000442722699 867649035 /nfs/dbraw/zinc/64/90/35/867649035.db2.gz VZODQMHGDLUXFM-PZJWPPBQSA-N 2 0 418.507 4.278 20 0 HIADRP Cc1c([C@H](C)[NH2+]CCN2CC[N@H+](C)C(C)(C)C2)cnn1-c1ccc(Cl)cc1Cl ZINC000442872153 867706804 /nfs/dbraw/zinc/70/68/04/867706804.db2.gz HJIXBDUVFJVHPO-HNNXBMFYSA-N 2 0 424.420 4.164 20 0 HIADRP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000442877629 867711185 /nfs/dbraw/zinc/71/11/85/867711185.db2.gz RIJATLQJJBVEGX-ZDUSSCGKSA-N 2 0 411.434 4.401 20 0 HIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000442999864 867785790 /nfs/dbraw/zinc/78/57/90/867785790.db2.gz MFINIKOKUNOPCY-UHFFFAOYSA-N 2 0 419.491 4.129 20 0 HIADRP C[C@H](c1nc(-c2ccc(N3CCC[NH+](C)CC3)c(Cl)c2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000443199362 867871559 /nfs/dbraw/zinc/87/15/59/867871559.db2.gz DHVXCVCHGNLUKW-IXDOHACOSA-N 2 0 417.985 4.466 20 0 HIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)NCCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000443693040 868293946 /nfs/dbraw/zinc/29/39/46/868293946.db2.gz LLTCJDVIYLBTRS-RDGATRHJSA-N 2 0 422.617 4.061 20 0 HIADRP O=C(CC[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1)N[C@H](c1cccs1)c1ccccc1 ZINC000444214561 868669732 /nfs/dbraw/zinc/66/97/32/868669732.db2.gz RRQHTFDCQNIQCQ-RDPSFJRHSA-N 2 0 411.615 4.152 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NCC1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000446432941 870351447 /nfs/dbraw/zinc/35/14/47/870351447.db2.gz MLRFACLKHVSSNF-FQEVSTJZSA-N 2 0 411.512 4.079 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000446562732 870473998 /nfs/dbraw/zinc/47/39/98/870473998.db2.gz CYPMXMCRQXNHFX-NOZRDPDXSA-N 2 0 420.601 4.309 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1NC(=O)Nc1ccccc1CC[NH+](C)C ZINC000446565576 870477262 /nfs/dbraw/zinc/47/72/62/870477262.db2.gz PLMUMQXRRZKQSI-PMACEKPBSA-N 2 0 408.590 4.069 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccccc2CC[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000446595981 870502591 /nfs/dbraw/zinc/50/25/91/870502591.db2.gz XSTYAIHLIAWTGZ-OFNKIYASSA-N 2 0 408.590 4.308 20 0 HIADRP Cc1nccnc1[C@@H](C)[NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000446743539 870651987 /nfs/dbraw/zinc/65/19/87/870651987.db2.gz KSKOJKIPSWWECD-QGZVFWFLSA-N 2 0 421.511 4.057 20 0 HIADRP Cc1ccc([C@H](CCn2cncn2)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC000446748936 870656183 /nfs/dbraw/zinc/65/61/83/870656183.db2.gz VNGMFDAVCCQTTP-VWLOTQADSA-N 2 0 403.574 4.494 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000446819853 870734800 /nfs/dbraw/zinc/73/48/00/870734800.db2.gz VWEGDLVMUMPLHY-IBGZPJMESA-N 2 0 414.819 4.171 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCC(O)CC3)cc1)CCCS2 ZINC000446832245 870747734 /nfs/dbraw/zinc/74/77/34/870747734.db2.gz NUQBWDXNFUWCPE-QHCPKHFHSA-N 2 0 412.599 4.369 20 0 HIADRP Cc1cc(Br)cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1OC(F)F ZINC000446885960 870806471 /nfs/dbraw/zinc/80/64/71/870806471.db2.gz CJYDLJNJYOMRFK-UHFFFAOYSA-N 2 0 403.311 4.323 20 0 HIADRP COc1ccc(C)cc1NC(=O)[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000447032580 870907168 /nfs/dbraw/zinc/90/71/68/870907168.db2.gz ZEUGFDSBMQBHEA-XMMPIXPASA-N 2 0 407.558 4.147 20 0 HIADRP Cc1ccc(C[NH+]2CCC(C(=O)NCC[N@@H+](C)Cc3ccccc3)CC2)c(Cl)c1 ZINC000447315489 871208046 /nfs/dbraw/zinc/20/80/46/871208046.db2.gz QUWRSLNKYUNMOG-UHFFFAOYSA-N 2 0 413.993 4.109 20 0 HIADRP CC(C)(C)c1cnc(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)s1 ZINC000447928008 871815649 /nfs/dbraw/zinc/81/56/49/871815649.db2.gz CNGLPBKYMCDPCU-UHFFFAOYSA-N 2 0 400.636 4.128 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)[C@H](C)C1 ZINC000448464027 872433065 /nfs/dbraw/zinc/43/30/65/872433065.db2.gz BZFHXKKQSRSFQX-CJFMBICVSA-N 2 0 422.617 4.287 20 0 HIADRP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cccc(Cl)c1F ZINC000461105528 874024801 /nfs/dbraw/zinc/02/48/01/874024801.db2.gz XQXMVHNJFGBHSP-WIYYLYMNSA-N 2 0 417.956 4.417 20 0 HIADRP Cc1cccc(NC[C@H]2CCN(Cc3nnc(-c4cc5c(s4)CCCC5)o3)C2)[nH+]1 ZINC000461394930 874402362 /nfs/dbraw/zinc/40/23/62/874402362.db2.gz RBBNZLPBAKKNEY-MRXNPFEDSA-N 2 0 409.559 4.314 20 0 HIADRP CC[NH+]1CCC([NH2+]Cc2ccc(NC(=O)CCCOc3ccccc3C)cc2)CC1 ZINC000461793023 874909353 /nfs/dbraw/zinc/90/93/53/874909353.db2.gz CBTYTALWYHEYDO-UHFFFAOYSA-N 2 0 409.574 4.367 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccc(C4CCCC4)cc3)c2)C1 ZINC000462787617 875840412 /nfs/dbraw/zinc/84/04/12/875840412.db2.gz COXOWCSZLSNGPU-RUZDIDTESA-N 2 0 405.586 4.331 20 0 HIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CCCN2CCCCC2=O)c2ccc(F)cc2)CC1 ZINC000462815035 875857622 /nfs/dbraw/zinc/85/76/22/875857622.db2.gz BIKRFCUMNBHRKN-HSZRJFAPSA-N 2 0 403.586 4.371 20 0 HIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CC2(S(C)(=O)=O)CCCC2)c2ccc(F)cc2)CC1 ZINC000462817919 875859180 /nfs/dbraw/zinc/85/91/80/875859180.db2.gz ORCDQLZINUVXOY-JOCHJYFZSA-N 2 0 424.626 4.326 20 0 HIADRP Cc1[nH+]c2ccc(Br)cc2c(NCC2([NH+]3CCCC3)CCOCC2)c1C ZINC000462830282 875864842 /nfs/dbraw/zinc/86/48/42/875864842.db2.gz VMRVLTCOGLYHDS-UHFFFAOYSA-N 2 0 418.379 4.093 20 0 HIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000463080170 876111276 /nfs/dbraw/zinc/11/12/76/876111276.db2.gz SJCGLVGZWZIPHQ-OYRHEFFESA-N 2 0 412.622 4.336 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[C@H]1CCCC[NH+]1CCC[N@H+]1CCCC[C@H]1[C@H]1CCCC[C@H]1O ZINC000463196948 876255524 /nfs/dbraw/zinc/25/55/24/876255524.db2.gz NOXXRQKJIXAVLP-RRLSKXGXSA-N 2 0 406.655 4.188 20 0 HIADRP COc1cc(OC)cc(N2CC[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000463233902 876287512 /nfs/dbraw/zinc/28/75/12/876287512.db2.gz QGVUSXNWAJDLCQ-MBJRSGMTSA-N 2 0 421.585 4.068 20 0 HIADRP Fc1ccc(-n2ccc(CC[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)n2)cc1 ZINC000463236845 876294174 /nfs/dbraw/zinc/29/41/74/876294174.db2.gz SGJJLSSFOBJNPI-WINZOAQQSA-N 2 0 404.533 4.339 20 0 HIADRP c1cc(C[NH+]2CCC(OCC3CC3)CC2)ccc1C[NH+]1CCC(OCC2CC2)CC1 ZINC000464821518 878075086 /nfs/dbraw/zinc/07/50/86/878075086.db2.gz IRXXCVMPSMOQIG-UHFFFAOYSA-N 2 0 412.618 4.469 20 0 HIADRP CC(C)(CCc1ccccc1)[NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000464892392 878194177 /nfs/dbraw/zinc/19/41/77/878194177.db2.gz XTMBNBZBQIHNLB-UHFFFAOYSA-N 2 0 411.615 4.175 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)NC[C@H](c2ccccc2Cl)[NH+](CC)CC)C1 ZINC000465421381 878851089 /nfs/dbraw/zinc/85/10/89/878851089.db2.gz KRKPBSUOYYEBLX-WIYYLYMNSA-N 2 0 409.018 4.096 20 0 HIADRP CCc1ccc([C@@H](CNC(=O)N(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)[NH+](C)C)cc1 ZINC000465427300 878857484 /nfs/dbraw/zinc/85/74/84/878857484.db2.gz DXJDCVQTQUTCQJ-ILBGXUMGSA-N 2 0 422.617 4.015 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000465428208 878859555 /nfs/dbraw/zinc/85/95/55/878859555.db2.gz ZHODTKCVGHXTEU-ZCYQVOJMSA-N 2 0 422.617 4.233 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)c2cccs2)CC1 ZINC000465435747 878868541 /nfs/dbraw/zinc/86/85/41/878868541.db2.gz SXNIHNKBYUHILH-UXHICEINSA-N 2 0 406.640 4.037 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCC[NH+](C)C1CCCCC1 ZINC000465541041 879002666 /nfs/dbraw/zinc/00/26/66/879002666.db2.gz IYQIXDXTJMUBLM-HSZRJFAPSA-N 2 0 414.638 4.195 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCc1ccc(C[NH+]3CCC[C@H](C)C3)cc1)CC2 ZINC000465562370 879034471 /nfs/dbraw/zinc/03/44/71/879034471.db2.gz FKKSKVCGZQMEQM-ZTCOLXNVSA-N 2 0 412.622 4.075 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@@H]1CCC[NH+](C)[C@H]1c1cccs1 ZINC000465591935 879076636 /nfs/dbraw/zinc/07/66/36/879076636.db2.gz GACAFLQXKMCFOM-SVFBPWRDSA-N 2 0 406.640 4.085 20 0 HIADRP C[C@@H]1CCN(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000465607279 879100133 /nfs/dbraw/zinc/10/01/33/879100133.db2.gz UJQMVZNFOMTWPC-RDGATRHJSA-N 2 0 420.601 4.130 20 0 HIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000465888946 879543530 /nfs/dbraw/zinc/54/35/30/879543530.db2.gz MORYELWURWOJNU-GGAORHGYSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)CCCC1)c1ccccc1 ZINC000465911889 879573848 /nfs/dbraw/zinc/57/38/48/879573848.db2.gz SBTAIYFDFHPHRF-RBBKRZOGSA-N 2 0 400.611 4.166 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000503475989 912515871 /nfs/dbraw/zinc/51/58/71/912515871.db2.gz VAAQSBZWBDGLKE-XMMPIXPASA-N 2 0 421.585 4.115 20 0 HIADRP O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000503505452 912553847 /nfs/dbraw/zinc/55/38/47/912553847.db2.gz UQTYIKZIKSTKDB-FGZHOGPDSA-N 2 0 416.610 4.104 20 0 HIADRP CCN(C(=O)C[NH+]1CCC(OCC[NH+](CC)CC)CC1)c1cccc2ccccc21 ZINC000466719585 880508677 /nfs/dbraw/zinc/50/86/77/880508677.db2.gz XIIMPJHCFFQZEQ-UHFFFAOYSA-N 2 0 411.590 4.016 20 0 HIADRP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000467365559 881136329 /nfs/dbraw/zinc/13/63/29/881136329.db2.gz QMBCATLFSXKBLQ-KRWDZBQOSA-N 2 0 406.492 4.383 20 0 HIADRP CCC(CC)(CNC(=O)CC1([NH+]2CCOCC2)CCCC1)[NH2+][C@@H](C)c1ccccc1 ZINC000469499217 883743097 /nfs/dbraw/zinc/74/30/97/883743097.db2.gz HHZKBEPPXUPVQC-NRFANRHFSA-N 2 0 415.622 4.047 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)[C@H]1c1cccs1 ZINC000469732961 883891532 /nfs/dbraw/zinc/89/15/32/883891532.db2.gz FXKWKFZFKWWGRA-GCJKJVERSA-N 2 0 406.555 4.122 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C(=O)Nc3ccccc3)cc2)[C@H](C)C1 ZINC000469769266 883942537 /nfs/dbraw/zinc/94/25/37/883942537.db2.gz OHGRMPRDZRQQNM-YKSBVNFPSA-N 2 0 409.574 4.166 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC(CC[NH+](C)C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000503691171 912794093 /nfs/dbraw/zinc/79/40/93/912794093.db2.gz VYWZVTWJLZZFGZ-FQEVSTJZSA-N 2 0 402.627 4.269 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@H]([NH+]2CCCCC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000503723966 912810585 /nfs/dbraw/zinc/81/05/85/912810585.db2.gz HFVPURVVGLFEND-UNMCSNQZSA-N 2 0 400.611 4.166 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)N(CC[NH+](C)C)Cc1ccc(F)cc1)c1ccccc1 ZINC000503725049 912810742 /nfs/dbraw/zinc/81/07/42/912810742.db2.gz JUXUUEMADDAZIR-LJQANCHMSA-N 2 0 414.569 4.028 20 0 HIADRP CC[N@H+](CC(=O)NC1CC[NH+](CC)CC1)[C@@H](C)c1ccc(-c2cccc(OC)c2)cc1 ZINC000470153428 884423570 /nfs/dbraw/zinc/42/35/70/884423570.db2.gz YOAZLEPAASFUIG-FQEVSTJZSA-N 2 0 423.601 4.346 20 0 HIADRP CC(C)[NH+](CCCNC(=O)N(C)[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000470493553 884880779 /nfs/dbraw/zinc/88/07/79/884880779.db2.gz LFFWKFNSDMSTPR-GMAHTHKFSA-N 2 0 402.627 4.190 20 0 HIADRP COc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000503949105 912879123 /nfs/dbraw/zinc/87/91/23/912879123.db2.gz XQJULJDDMGIWGN-UHFFFAOYSA-N 2 0 404.558 4.369 20 0 HIADRP CC[NH+](CC)C[C@@H]1CCN(C(=O)[C@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)C1 ZINC000470544965 884951589 /nfs/dbraw/zinc/95/15/89/884951589.db2.gz BESLBWCUSVXTCM-PXNSSMCTSA-N 2 0 413.528 4.279 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@@H](C[N@H+](C)CC2CC2)C1)c1ccccc1Cl ZINC000470735967 885190884 /nfs/dbraw/zinc/19/08/84/885190884.db2.gz HTWPMAIWDSPIPZ-SIKLNZKXSA-N 2 0 421.029 4.096 20 0 HIADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CCC(=O)N[C@@H](c2cccs2)c2ccccc2)C1 ZINC000470972619 885472873 /nfs/dbraw/zinc/47/28/73/885472873.db2.gz YMLJBYREDZMTSM-HYBUGGRVSA-N 2 0 411.615 4.008 20 0 HIADRP C[C@@H](c1cccc(Cl)c1)[NH+]1CCC(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1 ZINC000471214374 885788738 /nfs/dbraw/zinc/78/87/38/885788738.db2.gz ATJAHNAMKKBNOJ-IBGZPJMESA-N 2 0 413.993 4.361 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000471596431 886310646 /nfs/dbraw/zinc/31/06/46/886310646.db2.gz LKNHTTCWSMEPOV-QFBILLFUSA-N 2 0 419.038 4.457 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000471601254 886315249 /nfs/dbraw/zinc/31/52/49/886315249.db2.gz HQNCMGVPRGMBAS-KBPBESRZSA-N 2 0 411.434 4.401 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH+]2CCC(c3nc4cc(Cl)ccc4o3)CC2)CC1 ZINC000472571604 887458359 /nfs/dbraw/zinc/45/83/59/887458359.db2.gz QYKAIQFXRYEFQM-UHFFFAOYSA-N 2 0 404.986 4.077 20 0 HIADRP CCN(C(=O)NC1CC[NH+](C2CCCC2)CC1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473740202 888522333 /nfs/dbraw/zinc/52/23/33/888522333.db2.gz POPPFNSLYGMSCM-HYBUGGRVSA-N 2 0 412.622 4.260 20 0 HIADRP CCN(C(=O)Nc1cccc(OCC[NH+](C)C)c1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473748828 888534477 /nfs/dbraw/zinc/53/44/77/888534477.db2.gz UGIXIZHBZNFWNY-REWPJTCUSA-N 2 0 424.589 4.316 20 0 HIADRP CCc1cccc(F)c1C[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000474722081 889578851 /nfs/dbraw/zinc/57/88/51/889578851.db2.gz XEGKTTHOJZDGTK-UHFFFAOYSA-N 2 0 400.538 4.168 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccsc1 ZINC000475138812 890006297 /nfs/dbraw/zinc/00/62/97/890006297.db2.gz NECSYPLCVVSVIX-NRFANRHFSA-N 2 0 406.640 4.227 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CC(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000475153473 890018199 /nfs/dbraw/zinc/01/81/99/890018199.db2.gz NQNBOVPOHIYDJV-DYESRHJHSA-N 2 0 422.598 4.188 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000475153482 890018768 /nfs/dbraw/zinc/01/87/68/890018768.db2.gz NQNBOVPOHIYDJV-UTKZUKDTSA-N 2 0 422.598 4.188 20 0 HIADRP C[C@H](CCc1ccc(I)cc1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000475190638 890059900 /nfs/dbraw/zinc/05/99/00/890059900.db2.gz GZDVIGVUEJEUDF-OAHLLOKOSA-N 2 0 412.359 4.076 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475279151 890174836 /nfs/dbraw/zinc/17/48/36/890174836.db2.gz KZAWCZRQOACHBG-MJGOQNOKSA-N 2 0 415.965 4.177 20 0 HIADRP C[C@@H]1CCC[C@H]([NH+]2CCC(NC3CC([NH+]4CCC(C(F)(F)F)CC4)C3)CC2)C1 ZINC000475353766 890278775 /nfs/dbraw/zinc/27/87/75/890278775.db2.gz LGRPHFUPNOSBCH-ZEXAPNKDSA-N 2 0 401.561 4.424 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1cc2cccc(F)c2o1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000475712870 890650179 /nfs/dbraw/zinc/65/01/79/890650179.db2.gz GWRXUZLMCPWNSY-ROUUACIJSA-N 2 0 423.532 4.392 20 0 HIADRP c1cc(C[N@@H+]2CCC[C@]3(CCCOC3)C2)ccc1C[NH+]1CCC[C@]2(CCCOC2)C1 ZINC000477044472 891970144 /nfs/dbraw/zinc/97/01/44/891970144.db2.gz CANZSIPLWHWIIR-UIOOFZCWSA-N 2 0 412.618 4.472 20 0 HIADRP COc1cccc(NC(=O)CC[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)c1 ZINC000477048389 891976796 /nfs/dbraw/zinc/97/67/96/891976796.db2.gz HHYBRZWRZSSVRY-VWLOTQADSA-N 2 0 407.558 4.012 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@@H](c2cccs2)[NH+](C)C)CC1 ZINC000477603822 892686372 /nfs/dbraw/zinc/68/63/72/892686372.db2.gz COKPKSZIUSPCNO-QUCCMNQESA-N 2 0 406.640 4.037 20 0 HIADRP Cc1cc(NC2CC[NH+](CCC(F)(F)F)CC2)cc(N2CC[NH+](C(C)C)CC2)c1 ZINC000477868122 892927241 /nfs/dbraw/zinc/92/72/41/892927241.db2.gz VCOGDXVCFJKKSQ-UHFFFAOYSA-N 2 0 412.544 4.354 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)[C@@H](C)C1 ZINC000477917990 893001385 /nfs/dbraw/zinc/00/13/85/893001385.db2.gz OOOANYIVHGLNDS-DHLKQENFSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000477918477 893001949 /nfs/dbraw/zinc/00/19/49/893001949.db2.gz PTIOUWWGIHOMOV-IBGZPJMESA-N 2 0 415.603 4.141 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000478615740 893877419 /nfs/dbraw/zinc/87/74/19/893877419.db2.gz AINPXJGLFUCEPY-JOCHJYFZSA-N 2 0 411.634 4.402 20 0 HIADRP CC[C@H]([NH2+][C@H](C)CN1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479055456 894314574 /nfs/dbraw/zinc/31/45/74/894314574.db2.gz FUEFMAYTOAVOFV-DYVFJYSZSA-N 2 0 422.333 4.145 20 0 HIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@H]2CCCc3nn(-c4ccccc4)cc32)cc1 ZINC000479064048 894326368 /nfs/dbraw/zinc/32/63/68/894326368.db2.gz DWOOPJQSDQVQHO-DEOSSOPVSA-N 2 0 404.558 4.022 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479264345 894534660 /nfs/dbraw/zinc/53/46/60/894534660.db2.gz COHXOCYIMRDARN-PGRDOPGGSA-N 2 0 416.407 4.154 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](C)c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000479267374 894538652 /nfs/dbraw/zinc/53/86/52/894538652.db2.gz SZQRJFRSCOFVHD-KBPBESRZSA-N 2 0 422.333 4.145 20 0 HIADRP COc1cc2c(cc1OC)[C@H]([NH2+]Cc1ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc1)CC2 ZINC000479360655 894660068 /nfs/dbraw/zinc/66/00/68/894660068.db2.gz MRZLVVXORPHWBI-PMAPCBKXSA-N 2 0 410.558 4.090 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3cc(Br)ccc32)CC1 ZINC000479383598 894684566 /nfs/dbraw/zinc/68/45/66/894684566.db2.gz CWEUYENKTWQGRR-QHAWAJNXSA-N 2 0 407.396 4.184 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)CC1 ZINC000479433862 894749404 /nfs/dbraw/zinc/74/94/04/894749404.db2.gz CCFCHFGQOZFLDO-JOCHJYFZSA-N 2 0 406.659 4.185 20 0 HIADRP COc1ccc(-c2ccncc2)cc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000479446688 894762536 /nfs/dbraw/zinc/76/25/36/894762536.db2.gz OCYFXPRVYZHBCC-VWLOTQADSA-N 2 0 417.553 4.004 20 0 HIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCN(Cc4ccccn4)C[C@H]3C)cc2)CC1 ZINC000480256287 895666632 /nfs/dbraw/zinc/66/66/32/895666632.db2.gz ACENQHLYTYGUPE-ATIYNZHBSA-N 2 0 406.618 4.314 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H](C)c1ccc(OCc2ccc(F)cc2)cc1)N1CC[NH+](C)CC1 ZINC000480553030 895914039 /nfs/dbraw/zinc/91/40/39/895914039.db2.gz LOCVTRGVZBAGIT-NLFFAJNJSA-N 2 0 413.581 4.327 20 0 HIADRP CC(C)(C)C(=O)N1CCC(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000480566075 895926407 /nfs/dbraw/zinc/92/64/07/895926407.db2.gz XCOMZJNUULTACG-RPWUZVMVSA-N 2 0 411.634 4.258 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC[C@@H](C)C3)cc2)[C@H](C)C1 ZINC000480600989 895964202 /nfs/dbraw/zinc/96/42/02/895964202.db2.gz MUPUSAFQYDWWBH-RQTOMXEWSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000480617771 895984817 /nfs/dbraw/zinc/98/48/17/895984817.db2.gz VVIJKNZVFOJGHS-OALUTQOASA-N 2 0 415.603 4.141 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)C1 ZINC000480621960 895989423 /nfs/dbraw/zinc/98/94/23/895989423.db2.gz UQNLPBRDFQTAHE-TVZXLZGTSA-N 2 0 406.618 4.314 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)[C@H](C)C1 ZINC000480630957 896000639 /nfs/dbraw/zinc/00/06/39/896000639.db2.gz MCOMCYQFSAPTTF-SLSDLSHTSA-N 3 0 401.639 4.288 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](CCC(C)C)c3ccc(OC)cc3)cn2)CC1 ZINC000480696413 896058166 /nfs/dbraw/zinc/05/81/66/896058166.db2.gz XDCIBZHUQWJVFF-XMMPIXPASA-N 2 0 410.606 4.499 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cc(Cl)ccc1OC ZINC000480699364 896060660 /nfs/dbraw/zinc/06/06/60/896060660.db2.gz PKVRJMKEKCGERL-FQEVSTJZSA-N 2 0 402.970 4.126 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H]3CCCOc4c(Cl)c(Cl)ccc43)ccn2)CC1 ZINC000480720222 896079382 /nfs/dbraw/zinc/07/93/82/896079382.db2.gz JFRFDUGAVYFWGX-GOSISDBHSA-N 2 0 421.372 4.144 20 0 HIADRP COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000480724791 896084914 /nfs/dbraw/zinc/08/49/14/896084914.db2.gz WGAHREPNHVEEBG-NRFANRHFSA-N 2 0 416.997 4.372 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C3CCN(Cc4cccnc4)CC3)cc2)C1 ZINC000480727191 896086590 /nfs/dbraw/zinc/08/65/90/896086590.db2.gz NGYRRGZURMSEMX-SZPZYZBQSA-N 2 0 406.618 4.314 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H](CCc3ccccc3)c3ccccc3)ccn2)CC1 ZINC000480728696 896089906 /nfs/dbraw/zinc/08/99/06/896089906.db2.gz GLADJMMAOOCLGQ-VWLOTQADSA-N 2 0 400.570 4.297 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cccc(-c4ccncc4)c3)cn2)CC1 ZINC000480741214 896102796 /nfs/dbraw/zinc/10/27/96/896102796.db2.gz RQKHBGUUOQRTIQ-HXUWFJFHSA-N 2 0 401.558 4.136 20 0 HIADRP CC[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)[C@H]1CCOC1 ZINC000480748646 896111804 /nfs/dbraw/zinc/11/18/04/896111804.db2.gz YEIVTZIBRBUDAU-GHTZIAJQSA-N 2 0 413.528 4.012 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H](C)[C@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000480776531 896140306 /nfs/dbraw/zinc/14/03/06/896140306.db2.gz CICRUSBNZDIQHX-SJORKVTESA-N 2 0 402.410 4.157 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)c1 ZINC000481149735 896479852 /nfs/dbraw/zinc/47/98/52/896479852.db2.gz BTBUFFPAFNXHRX-UPVQGACJSA-N 2 0 406.574 4.267 20 0 HIADRP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000481234033 896583171 /nfs/dbraw/zinc/58/31/71/896583171.db2.gz PXQMRUCUVSXWQM-CVEARBPZSA-N 2 0 423.388 4.086 20 0 HIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000481239607 896590302 /nfs/dbraw/zinc/59/03/02/896590302.db2.gz GJYJVWZWSGETMD-QFIPXVFZSA-N 2 0 406.599 4.277 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3cccc(N4CCOCC4)c3)CC2)cc1 ZINC000481715829 897108455 /nfs/dbraw/zinc/10/84/55/897108455.db2.gz JOGDUMACZRWXEM-OAQYLSRUSA-N 2 0 423.601 4.095 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(-n4ccnc4)cc3)CC2)cc1 ZINC000481724810 897119667 /nfs/dbraw/zinc/11/96/67/897119667.db2.gz IBWDFWBDFWOUCV-FQEVSTJZSA-N 2 0 404.558 4.444 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000481731781 897125851 /nfs/dbraw/zinc/12/58/51/897125851.db2.gz DNDZBKDJBBYZAY-GJZUVCINSA-N 2 0 406.618 4.458 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000481776400 897160089 /nfs/dbraw/zinc/16/00/89/897160089.db2.gz IICAAANVCPFZKS-RCZVLFRGSA-N 2 0 422.617 4.203 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000481776403 897160392 /nfs/dbraw/zinc/16/03/92/897160392.db2.gz IICAAANVCPFZKS-RDGATRHJSA-N 2 0 422.617 4.203 20 0 HIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000481919064 897302241 /nfs/dbraw/zinc/30/22/41/897302241.db2.gz HTQBKTCQFTTYPN-QGZVFWFLSA-N 2 0 406.492 4.383 20 0 HIADRP COC(=O)c1ccccc1-c1ccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)o1 ZINC000482056740 897484669 /nfs/dbraw/zinc/48/46/69/897484669.db2.gz RHNQAARIYIPIDN-UHFFFAOYSA-N 2 0 405.498 4.134 20 0 HIADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000482228748 897707158 /nfs/dbraw/zinc/70/71/58/897707158.db2.gz DMGRSJVGTLGNNS-IQGLISFBSA-N 2 0 412.549 4.338 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@@H]2C[C@H](C)Sc3sccc32)c1 ZINC000482232982 897713062 /nfs/dbraw/zinc/71/30/62/897713062.db2.gz VPXQNDWFGPIRJK-OXJNMPFZSA-N 2 0 406.617 4.420 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CCCc3sccc32)c1)C1CCOCC1 ZINC000482255039 897736501 /nfs/dbraw/zinc/73/65/01/897736501.db2.gz CXZUQWXQNLRAOP-JOCHJYFZSA-N 2 0 400.588 4.405 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CCCOc3ccccc32)c1)C1CCOCC1 ZINC000482257415 897739970 /nfs/dbraw/zinc/73/99/70/897739970.db2.gz CTQKYWWGQDWPKP-XMMPIXPASA-N 2 0 410.558 4.180 20 0 HIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC2CC[NH+](CCN(C)C)CC2)CCC3)cc1 ZINC000482358630 897875290 /nfs/dbraw/zinc/87/52/90/897875290.db2.gz NAODINNZJWUOLZ-NRFANRHFSA-N 2 0 412.647 4.359 20 0 HIADRP Cc1c([C@@H](C)[NH2+]C[C@H](C)CN2CC[NH+](C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000482459895 898032660 /nfs/dbraw/zinc/03/26/60/898032660.db2.gz CGFGXTUAWGREDZ-JKSUJKDBSA-N 2 0 424.420 4.022 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000482498766 898079122 /nfs/dbraw/zinc/07/91/22/898079122.db2.gz BZRHXCPRKARELR-XLIONFOSSA-N 2 0 416.610 4.190 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000482498767 898079342 /nfs/dbraw/zinc/07/93/42/898079342.db2.gz BZRHXCPRKARELR-YLJYHZDGSA-N 2 0 416.610 4.190 20 0 HIADRP C[C@H](C[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)CN1CC[NH+](C)CC1 ZINC000482502269 898084866 /nfs/dbraw/zinc/08/48/66/898084866.db2.gz COSYQZWMJRJDQL-VQIMIIECSA-N 2 0 419.038 4.314 20 0 HIADRP CC(C)Cc1ccc([C@H](CNC(=O)Nc2ccccc2CC[NH+](C)C)[NH+](C)C)cc1 ZINC000482505660 898088090 /nfs/dbraw/zinc/08/80/90/898088090.db2.gz ROZMZLSCNGSEHE-DEOSSOPVSA-N 2 0 410.606 4.414 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2sc(-c3ccccc3F)nc2C)CC1 ZINC000482509420 898093169 /nfs/dbraw/zinc/09/31/69/898093169.db2.gz LZWFABOIMTZFPC-IAGOWNOFSA-N 2 0 404.599 4.182 20 0 HIADRP C[C@@H](C[NH2+][C@@H](Cc1ccc(F)cc1)c1ccccc1Cl)CN1CC[NH+](C)CC1 ZINC000482513577 898098850 /nfs/dbraw/zinc/09/88/50/898098850.db2.gz REYXKNSFBMDNOT-MBSDFSHPSA-N 2 0 403.973 4.236 20 0 HIADRP COc1cc(OC)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1Cl ZINC000482531659 898119546 /nfs/dbraw/zinc/11/95/46/898119546.db2.gz GADUHMAIJJULKW-INIZCTEOSA-N 2 0 418.965 4.165 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCc4ccc(OC(F)(F)F)cc43)cc2)CC1 ZINC000482541804 898130134 /nfs/dbraw/zinc/13/01/34/898130134.db2.gz GOYNRVJLWRXESW-QFIPXVFZSA-N 2 0 420.475 4.319 20 0 HIADRP COCCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000482564865 898156290 /nfs/dbraw/zinc/15/62/90/898156290.db2.gz LXHJNKWRSACURB-MOPGFXCFSA-N 2 0 415.553 4.015 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2ccc([S@@](C)=O)cc2)CC1 ZINC000482568990 898163849 /nfs/dbraw/zinc/16/38/49/898163849.db2.gz KVXLVQNDVKRYSN-ZQWKUMLXSA-N 2 0 417.594 4.117 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2ccc(OC)cc2OC)CC1 ZINC000482570412 898165346 /nfs/dbraw/zinc/16/53/46/898165346.db2.gz WNNIAMORQMADQT-MSOLQXFVSA-N 2 0 415.553 4.397 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2ccccc2Br)s1 ZINC000482632492 898235964 /nfs/dbraw/zinc/23/59/64/898235964.db2.gz GTHAFIUHTMJIQJ-CVEARBPZSA-N 2 0 422.436 4.464 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2ccc(Br)cc2)s1 ZINC000482637409 898242026 /nfs/dbraw/zinc/24/20/26/898242026.db2.gz OUAZPRRFIMCTOB-HOTGVXAUSA-N 2 0 422.436 4.464 20 0 HIADRP Cc1cc(C)c2c(c1)[C@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c1)CCCO2 ZINC000482809029 898419906 /nfs/dbraw/zinc/41/99/06/898419906.db2.gz CADWMCOYUULFEP-ISKFKSNPSA-N 2 0 421.585 4.004 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000482886228 898500701 /nfs/dbraw/zinc/50/07/01/898500701.db2.gz IMRUZZFKVFVFCI-URXFXBBRSA-N 2 0 405.586 4.240 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(-c3nc4ccccc4[nH]3)cc2)[C@H](C)C1 ZINC000482949971 898577583 /nfs/dbraw/zinc/57/75/83/898577583.db2.gz WOQREZSGNAVTEP-KNQAVFIVSA-N 2 0 406.574 4.457 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000483043765 898711737 /nfs/dbraw/zinc/71/17/37/898711737.db2.gz GBNLMEXSSXUZOL-LADGPHEKSA-N 2 0 411.634 4.402 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000483043772 898711877 /nfs/dbraw/zinc/71/18/77/898711877.db2.gz GBNLMEXSSXUZOL-UPVQGACJSA-N 2 0 411.634 4.402 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)NC(C)(C)CC[NH+]2CCCCCC2)[C@@H]1c1cccs1 ZINC000483105117 898799711 /nfs/dbraw/zinc/79/97/11/898799711.db2.gz XUZYDBBNOQTVCW-PZJWPPBQSA-N 2 0 420.667 4.475 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](N[C@@H](C)c2ccc(F)cc2Br)[C@H](C)C1 ZINC000483131794 898814094 /nfs/dbraw/zinc/81/40/94/898814094.db2.gz RKCVKLTYNOMVPP-VCBZYWHSSA-N 2 0 401.364 4.376 20 0 HIADRP C[C@@H]([NH2+][C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483191369 898849036 /nfs/dbraw/zinc/84/90/36/898849036.db2.gz FJGZZQUCYMBCCV-IEBWSBKVSA-N 2 0 419.516 4.158 20 0 HIADRP C[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000483207050 898859587 /nfs/dbraw/zinc/85/95/87/898859587.db2.gz VDBJRAXHPIBIDJ-CVEARBPZSA-N 2 0 402.526 4.493 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cnn1-c1cc(C)ccc1C ZINC000483536036 899198804 /nfs/dbraw/zinc/19/88/04/899198804.db2.gz AYKVKIJRPGSDOR-JOCHJYFZSA-N 2 0 423.649 4.398 20 0 HIADRP Cc1cc(-n2ccnc2)ccc1C[NH+]1CCC(c2nc(-c3ccccn3)no2)CC1 ZINC000483596036 899247546 /nfs/dbraw/zinc/24/75/46/899247546.db2.gz BYLZQNBQROZJFB-UHFFFAOYSA-N 2 0 400.486 4.005 20 0 HIADRP O=C(NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)NC1CC[NH+](C2CCCC2)CC1 ZINC000483706727 899361355 /nfs/dbraw/zinc/36/13/55/899361355.db2.gz GCLBKKLYMICWEL-UHFFFAOYSA-N 2 0 419.013 4.011 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000483714357 899370336 /nfs/dbraw/zinc/37/03/36/899370336.db2.gz WEFDXGISZHERDR-FQEVSTJZSA-N 2 0 412.622 4.267 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CCCN(C)[C@@H]1c1cccs1)c1cccc(OCC[NH+](C)C)c1 ZINC000483728956 899388778 /nfs/dbraw/zinc/38/87/78/899388778.db2.gz PKKSEARZACGBHL-NOXFTYBFSA-N 2 0 401.620 4.422 20 0 HIADRP C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)OCO2 ZINC000483752374 899415443 /nfs/dbraw/zinc/41/54/43/899415443.db2.gz LPFFDSFLJHMWBE-HNNXBMFYSA-N 2 0 421.463 4.037 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)C[C@@H]1C ZINC000483765953 899426949 /nfs/dbraw/zinc/42/69/49/899426949.db2.gz ZUVPOCWXVVEFJO-NZQKXSOJSA-N 2 0 400.611 4.077 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000483946367 899600152 /nfs/dbraw/zinc/60/01/52/899600152.db2.gz UKGCDUQXKHATSZ-XUZZJYLKSA-N 2 0 422.617 4.238 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)NC2CC[NH+](C3CCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000483994637 899633224 /nfs/dbraw/zinc/63/32/24/899633224.db2.gz QRBLKZLWCVNKQX-HYBUGGRVSA-N 2 0 412.622 4.088 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccccc3Br)CC2)[C@@H](C)C1 ZINC000484138680 899759453 /nfs/dbraw/zinc/75/94/53/899759453.db2.gz FEENLGLGEIOTJI-FXAWDEMLSA-N 2 0 409.412 4.207 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+][C@@H](Cc2cccc(F)c2)c2ccc(Cl)c(Cl)c2)CC1 ZINC000484146425 899766519 /nfs/dbraw/zinc/76/65/19/899766519.db2.gz NSTZQLJGXIYRJJ-FQEVSTJZSA-N 2 0 411.348 4.463 20 0 HIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(Oc2ccc(Br)cc2)cc1 ZINC000484167928 899788205 /nfs/dbraw/zinc/78/82/05/899788205.db2.gz CAMVZIQRCUSPPK-MRXNPFEDSA-N 2 0 419.363 4.349 20 0 HIADRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+][C@H]2CCSc3c(Cl)cccc32)CC1 ZINC000484274252 899845348 /nfs/dbraw/zinc/84/53/48/899845348.db2.gz HCPZHUCEXNRGFW-SFHVURJKSA-N 2 0 410.027 4.093 20 0 HIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H]1CCCc2nc(-c3ccc(OC)cc3)sc21 ZINC000484283100 899851058 /nfs/dbraw/zinc/85/10/58/899851058.db2.gz PMHUXSNPIYDSME-OALUTQOASA-N 2 0 403.592 4.143 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(Cl)cc1Cl ZINC000484302687 899863633 /nfs/dbraw/zinc/86/36/33/899863633.db2.gz QPFDPXYMHOLLML-CQSZACIVSA-N 2 0 400.394 4.271 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000484480109 899973126 /nfs/dbraw/zinc/97/31/26/899973126.db2.gz KUDFOSALYGDCGX-MRXNPFEDSA-N 2 0 408.464 4.393 20 0 HIADRP C[C@H]([NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)c1cccc(N2CCOCC2)c1 ZINC000484500669 899990960 /nfs/dbraw/zinc/99/09/60/899990960.db2.gz NIKVVWCYZAEDON-FKBYEOEOSA-N 2 0 407.602 4.330 20 0 HIADRP CCC[NH+]1CCC([N@H+](C)C[C@@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)CC1 ZINC000484914194 900291543 /nfs/dbraw/zinc/29/15/43/900291543.db2.gz VKCHGLLQLQRQRS-CLJLJLNGSA-N 2 0 410.602 4.268 20 0 HIADRP CCOc1ccccc1NC(=O)CC[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000485440118 900736873 /nfs/dbraw/zinc/73/68/73/900736873.db2.gz QRNCACHAKKBCFO-SANMLTNESA-N 2 0 421.585 4.402 20 0 HIADRP C[NH+](C)Cc1ccccc1C(=O)NCCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000486267387 901450259 /nfs/dbraw/zinc/45/02/59/901450259.db2.gz OQHBSDMXJJWBIL-UHFFFAOYSA-N 2 0 407.602 4.213 20 0 HIADRP C[NH+](Cc1ccccc1C[N@@H+](C)[C@H](CO)c1ccccc1)[C@@H](CO)c1ccccc1 ZINC000487441873 902212525 /nfs/dbraw/zinc/21/25/25/902212525.db2.gz FZLPFCKDFXKFKT-WMPKNSHKSA-N 2 0 404.554 4.017 20 0 HIADRP c1ccc(C[N@@H+]2CCC[C@H]([C@H]3CCOC3)C2)c(C[NH+]2CCC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000487915691 902449970 /nfs/dbraw/zinc/44/99/70/902449970.db2.gz PTUQBMWUQWFGGJ-ASDGIDEWSA-N 2 0 412.618 4.184 20 0 HIADRP CN(C(=O)C[NH+]1CCC(C[NH+]2CCCC2)CC1)C(c1ccccc1)c1ccccc1 ZINC000488341506 902776546 /nfs/dbraw/zinc/77/65/46/902776546.db2.gz DSPDLUPIZNUKRE-UHFFFAOYSA-N 2 0 405.586 4.042 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000489436817 903383284 /nfs/dbraw/zinc/38/32/84/903383284.db2.gz MKENPEJVFZAHNP-SQJMNOBHSA-N 2 0 422.617 4.238 20 0 HIADRP Cc1ccc(C)c([C@H]([NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)c2ccccc2)c1 ZINC000490128849 903781620 /nfs/dbraw/zinc/78/16/20/903781620.db2.gz ATUNQPQMPIMVTC-AREMUKBSSA-N 2 0 400.570 4.329 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H](c1ccc(F)cc1)c1ccc(Cl)cc1)N1CC[NH+](C)CC1 ZINC000490162615 903804204 /nfs/dbraw/zinc/80/42/04/903804204.db2.gz ALTRMHQTSIRSEH-GOTSBHOMSA-N 2 0 403.973 4.430 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2ccc(Br)c3cccnc23)CC1 ZINC000490398246 903983100 /nfs/dbraw/zinc/98/31/00/903983100.db2.gz ICNPACPHJZMOKO-UHFFFAOYSA-N 2 0 420.395 4.320 20 0 HIADRP CSc1cccc([C@H]([NH2+]C[C@H](C)N2CC[NH+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491025643 904376627 /nfs/dbraw/zinc/37/66/27/904376627.db2.gz WUAZDEKBRSVKIH-AOMKIAJQSA-N 2 0 405.558 4.002 20 0 HIADRP Cc1ccc([C@H]([NH2+]CCCC[NH+]2CCN(c3ncccn3)CC2)c2ccccc2)cc1 ZINC000491035704 904389662 /nfs/dbraw/zinc/38/96/62/904389662.db2.gz JSQZHYLFTUNUDP-RUZDIDTESA-N 2 0 415.585 4.066 20 0 HIADRP CCOc1ccc([C@@H]([NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000491062833 904405410 /nfs/dbraw/zinc/40/54/10/904405410.db2.gz XKAZDEOCSLFSGO-NTKDMRAZSA-N 2 0 416.009 4.301 20 0 HIADRP CC(C)Oc1ccc(C[NH+]2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)cc1Cl ZINC000493240731 905063154 /nfs/dbraw/zinc/06/31/54/905063154.db2.gz WUEJZOICOSLIAO-UHFFFAOYSA-N 2 0 424.029 4.043 20 0 HIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1cc(Br)cs1 ZINC000493883373 905242693 /nfs/dbraw/zinc/24/26/93/905242693.db2.gz OGNSALRVXYMBRW-OAHLLOKOSA-N 2 0 400.430 4.112 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1cc(Br)cs1 ZINC000493929461 905281264 /nfs/dbraw/zinc/28/12/64/905281264.db2.gz YOLMJJJSIRIOCF-CQSZACIVSA-N 2 0 409.393 4.318 20 0 HIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(Br)c(Cl)c2)(N2CCCCC2)CC1 ZINC000494049334 905388668 /nfs/dbraw/zinc/38/86/68/905388668.db2.gz NKOBDYIIKVVTMF-UHFFFAOYSA-N 2 0 414.819 4.142 20 0 HIADRP Clc1cccc(OCCCN2CCN([C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000512451448 921170171 /nfs/dbraw/zinc/17/01/71/921170171.db2.gz ZSMUICGFUSVMLC-HSZRJFAPSA-N 2 0 413.993 4.001 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NCc1ccccc1C[NH+]1CCCCCC1)c1ccsc1 ZINC000494583172 905849237 /nfs/dbraw/zinc/84/92/37/905849237.db2.gz DAQBLLJEDBFGEC-JOCHJYFZSA-N 2 0 414.619 4.226 20 0 HIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)CC2 ZINC000494743770 905942784 /nfs/dbraw/zinc/94/27/84/905942784.db2.gz CQDRKIARRUAVBW-SFTDATJTSA-N 2 0 415.375 4.101 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495092389 906232280 /nfs/dbraw/zinc/23/22/80/906232280.db2.gz LYKSIHXMCQWZFB-CLOONOSVSA-N 2 0 412.549 4.040 20 0 HIADRP COc1cccc([C@@H]2[C@H]([NH2+][C@H](C)c3cccc(OCC[NH+](C)C)c3)CCN2C2CC2)c1 ZINC000495403370 906429049 /nfs/dbraw/zinc/42/90/49/906429049.db2.gz UZOXRYBGJIVNJM-WGURPXDASA-N 2 0 423.601 4.264 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(C(F)(F)F)cc1 ZINC000495465759 906466988 /nfs/dbraw/zinc/46/69/88/906466988.db2.gz SFAIZHBPZSEBQI-OXJNMPFZSA-N 2 0 419.491 4.254 20 0 HIADRP C[C@H]1C[C@H](CCNC(=O)c2cccc(C[NH+]3CCCC3)c2)C[N@@H+]1Cc1ccccc1 ZINC000512575414 921245698 /nfs/dbraw/zinc/24/56/98/921245698.db2.gz ZCMLWFSSVFJHJP-URXFXBBRSA-N 2 0 405.586 4.313 20 0 HIADRP Cc1ccccc1[C@@H](OC[C@@H](O)C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1ccccc1 ZINC000512582121 921248954 /nfs/dbraw/zinc/24/89/54/921248954.db2.gz LAPXAKURYMIOOX-IZJXXVMLSA-N 2 0 408.586 4.019 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]Cc4ccnc(OC5CCOCC5)c4)[C@@H]3C2)cc1 ZINC000512621621 921264885 /nfs/dbraw/zinc/26/48/85/921264885.db2.gz ZXBDRGQTTAFCQX-CAOCKLPOSA-N 2 0 421.585 4.030 20 0 HIADRP CCC(CC)C(=O)N1CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000512653445 921275902 /nfs/dbraw/zinc/27/59/02/921275902.db2.gz FJDUPPAUMPTTFY-ZKMPZPQNSA-N 2 0 411.634 4.304 20 0 HIADRP C[NH+](C)CCOc1cccc(NC(=O)NCc2ccccc2C[NH+]2CCCCCC2)c1 ZINC000497480295 906959972 /nfs/dbraw/zinc/95/99/72/906959972.db2.gz JOZVYWZLKKDJOO-UHFFFAOYSA-N 2 0 424.589 4.325 20 0 HIADRP CCc1noc(C2CCC([NH2+]Cc3ccccc3C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)n1 ZINC000497518444 907008813 /nfs/dbraw/zinc/00/88/13/907008813.db2.gz DZKOLRQEVSDLII-BXRCABCMSA-N 2 0 412.578 4.057 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NC2CC[NH+](CC3CCCC3)CC2)CC1 ZINC000497569280 907054709 /nfs/dbraw/zinc/05/47/09/907054709.db2.gz HRLRPQVBWODZOY-FQEVSTJZSA-N 2 0 412.622 4.166 20 0 HIADRP CN(c1ccccc1C[NH+]1CCC(Oc2ccc(F)cc2)CC1)C1CC[NH+](C)CC1 ZINC000512705505 921292803 /nfs/dbraw/zinc/29/28/03/921292803.db2.gz LIZNVGVFNMGMHX-UHFFFAOYSA-N 2 0 411.565 4.400 20 0 HIADRP C[NH+](C)CCN(Cc1ccccc1)C(=O)NCc1ccccc1C[NH+]1CCCCCC1 ZINC000497721775 907221159 /nfs/dbraw/zinc/22/11/59/907221159.db2.gz VDVOBSIRXFRFQG-UHFFFAOYSA-N 2 0 422.617 4.336 20 0 HIADRP C[N@H+](CCc1cccc(NC(=O)[C@@H]2C[NH+](C(C)(C)C)C[C@H]2C(F)(F)F)c1)C1CC1 ZINC000497774159 907266993 /nfs/dbraw/zinc/26/69/93/907266993.db2.gz FSESBEUTUDQHPI-RTBURBONSA-N 2 0 411.512 4.171 20 0 HIADRP CCS[C@@H]1CC[C@@H]([NH+](C)CC2(C[N@@H+](C)[C@H]3CC[C@@H](SCC)C3)COC2)C1 ZINC000497848939 907329749 /nfs/dbraw/zinc/32/97/49/907329749.db2.gz SRLQQGLUZIJMEZ-IYWMVGAKSA-N 2 0 400.698 4.215 20 0 HIADRP CCCCN(C(=O)NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)[C@H](C)c1ccccc1 ZINC000498711005 908137030 /nfs/dbraw/zinc/13/70/30/908137030.db2.gz RXPQABDSOFDJRO-JOCHJYFZSA-N 2 0 423.605 4.167 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@H](C)[C@H]2CC[NH+](Cc3ccccc3)C2)CC1 ZINC000498724001 908149474 /nfs/dbraw/zinc/14/94/74/908149474.db2.gz ZFAZNFLOBPIHFH-QPPBQGQZSA-N 2 0 414.638 4.051 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccco1 ZINC000498901001 908309278 /nfs/dbraw/zinc/30/92/78/908309278.db2.gz LALMKWKTABNGDC-BLKABHOGSA-N 2 0 412.578 4.061 20 0 HIADRP C[C@@H]1CN(Cc2cccc(C[NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2)CCO1 ZINC000499144128 908502097 /nfs/dbraw/zinc/50/20/97/908502097.db2.gz VHMHWWXCJUXDFL-ORZNUPDKSA-N 2 0 419.613 4.193 20 0 HIADRP C[C@H](c1ccncc1)N1CCC([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499176988 908531422 /nfs/dbraw/zinc/53/14/22/908531422.db2.gz NTYQMBOTTLMKCN-FSAHKVHBSA-N 2 0 404.602 4.392 20 0 HIADRP FC(F)(F)c1cccnc1OCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499188759 908543668 /nfs/dbraw/zinc/54/36/68/908543668.db2.gz LDQMUQKNXQDPRR-REPLKXPHSA-N 2 0 405.464 4.264 20 0 HIADRP O=C(CCc1ccccc1)N1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000499243302 908611967 /nfs/dbraw/zinc/61/19/67/908611967.db2.gz JYKXNIRXTXWNSX-SSUZURRFSA-N 2 0 417.597 4.005 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@@H](C)C[NH+]2CCCC2)cc1 ZINC000513085604 921535911 /nfs/dbraw/zinc/53/59/11/921535911.db2.gz DLGIKXNSTMFTPK-OAQYLSRUSA-N 2 0 418.585 4.429 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H]2CCN(c3ccc(C(F)(F)F)cc3)C2=O)CC1 ZINC000501004164 910227125 /nfs/dbraw/zinc/22/71/25/910227125.db2.gz OYYKGMDJRGFPLB-FQEVSTJZSA-N 2 0 411.512 4.255 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CCCN1CC[NH+](C(C)C)CC1 ZINC000501028849 910246482 /nfs/dbraw/zinc/24/64/82/910246482.db2.gz KWQNMXHUCBCAHE-KRWDZBQOSA-N 2 0 404.599 4.324 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000501049279 910258063 /nfs/dbraw/zinc/25/80/63/910258063.db2.gz ASFQRPFYHVQPMW-UGKGYDQZSA-N 2 0 421.029 4.288 20 0 HIADRP CCc1ccc([C@@H](C)NC(=O)[C@@H](C)[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000501048267 910258257 /nfs/dbraw/zinc/25/82/57/910258257.db2.gz QKLBSXWDVZRBFC-WOJBJXKFSA-N 2 0 408.590 4.058 20 0 HIADRP CCc1ccc([C@H](C)NC(=O)[C@H](C)[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000501048264 910258614 /nfs/dbraw/zinc/25/86/14/910258614.db2.gz QKLBSXWDVZRBFC-PMACEKPBSA-N 2 0 408.590 4.058 20 0 HIADRP Cc1c(Cl)cccc1NC(=O)[C@@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501050915 910261494 /nfs/dbraw/zinc/26/14/94/910261494.db2.gz MELGBJPCLDAVEN-QGZVFWFLSA-N 2 0 400.954 4.219 20 0 HIADRP Clc1ccc(-n2cc(C[NH2+]CCCC[NH+]3CCN(c4ccccc4)CC3)cn2)cc1 ZINC000513132850 921575345 /nfs/dbraw/zinc/57/53/45/921575345.db2.gz ZFFZOAVEPBXMCI-UHFFFAOYSA-N 2 0 423.992 4.218 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000501544991 910648567 /nfs/dbraw/zinc/64/85/67/910648567.db2.gz GFYKZHATQFMNDA-HXUWFJFHSA-N 2 0 408.590 4.089 20 0 HIADRP C[C@@H](CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)[N@@H+]1CCCC[C@@H]1C ZINC000501547299 910650432 /nfs/dbraw/zinc/65/04/32/910650432.db2.gz ASFAHOQZGYVSMZ-SFTDATJTSA-N 2 0 422.617 4.477 20 0 HIADRP COc1ccc([C@@H]2CCCCCN2C(=O)C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000501768228 910823756 /nfs/dbraw/zinc/82/37/56/910823756.db2.gz AUWDAKXIPOMLAL-DEOSSOPVSA-N 2 0 415.622 4.193 20 0 HIADRP CN(C(=O)C[NH+]1CCC(CCC[NH+](C)C)CC1)C(c1ccccc1)c1ccccc1 ZINC000501791815 910844434 /nfs/dbraw/zinc/84/44/34/910844434.db2.gz GJCQWEOCQZPYDV-UHFFFAOYSA-N 2 0 407.602 4.288 20 0 HIADRP CCCn1nccc1C1CC[NH+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC1 ZINC000502315216 911285824 /nfs/dbraw/zinc/28/58/24/911285824.db2.gz HWZZEURAEGPYLV-UHFFFAOYSA-N 2 0 409.622 4.203 20 0 HIADRP C[C@@H]1C[NH+](CCOc2ccc(CC[NH2+][C@H]3CCCC34CCOCC4)cc2)C[C@H]1C ZINC000502395395 911380961 /nfs/dbraw/zinc/38/09/61/911380961.db2.gz VJRQFQGHTYAABX-LGVFNWMJSA-N 2 0 400.607 4.135 20 0 HIADRP Cc1cccc(CN(CC[NH+](C)C)C(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000502831870 911845497 /nfs/dbraw/zinc/84/54/97/911845497.db2.gz RFBICENEMMGLPU-UHFFFAOYSA-N 2 0 414.638 4.111 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)NCc2cccc(C[NH+](C)C)c2)CCCC1)c1ccccc1 ZINC000502910399 911897125 /nfs/dbraw/zinc/89/71/25/911897125.db2.gz BBAWOZUVZCMAKD-HXUWFJFHSA-N 2 0 408.590 4.211 20 0 HIADRP CN(C(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000502936213 911921917 /nfs/dbraw/zinc/92/19/17/911921917.db2.gz RYRLXIMWORHEJZ-VWLOTQADSA-N 2 0 420.601 4.130 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NCc1cccc(C[NH+]2CCCC2)c1)c1ccccc1 ZINC000502960383 911941196 /nfs/dbraw/zinc/94/11/96/911941196.db2.gz NXBQKGHFNDNDAC-HXUWFJFHSA-N 2 0 408.590 4.211 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)NCc2ccc(C[NH+](C)C)cc2)CCCC1)c1ccccc1 ZINC000503133221 912094041 /nfs/dbraw/zinc/09/40/41/912094041.db2.gz SHFRFYBHVMYXLO-FQEVSTJZSA-N 2 0 408.590 4.211 20 0 HIADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)CC1 ZINC000513329197 921716632 /nfs/dbraw/zinc/71/66/32/921716632.db2.gz BPYVAKVBYQDGCF-HNNXBMFYSA-N 2 0 404.908 4.185 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)N[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000506311420 914900400 /nfs/dbraw/zinc/90/04/00/914900400.db2.gz SSLIWKWPUIGVLV-IRLDBZIGSA-N 2 0 424.589 4.364 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000506469344 915067521 /nfs/dbraw/zinc/06/75/21/915067521.db2.gz HTWUCALDEPLBKC-ROUUACIJSA-N 2 0 422.411 4.364 20 0 HIADRP c1ccc(C[C@@H]([NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c2cccnc2)nc1 ZINC000513404933 921772436 /nfs/dbraw/zinc/77/24/36/921772436.db2.gz PVBYMQZOOBOENN-RUZDIDTESA-N 2 0 402.542 4.025 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1)c1ccccc1 ZINC000506800748 915540297 /nfs/dbraw/zinc/54/02/97/915540297.db2.gz KKMKSJJJXIXWAA-FKBYEOEOSA-N 2 0 414.638 4.412 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000506904780 915702977 /nfs/dbraw/zinc/70/29/77/915702977.db2.gz XASCEYCCMRILBU-ZJSXRUAMSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000506904778 915703694 /nfs/dbraw/zinc/70/36/94/915703694.db2.gz XASCEYCCMRILBU-XUZZJYLKSA-N 2 0 412.622 4.078 20 0 HIADRP Cc1ccc([C@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000507438311 916208414 /nfs/dbraw/zinc/20/84/14/916208414.db2.gz CQPUOBMIRBQPRA-HSZRJFAPSA-N 2 0 414.615 4.118 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)[C@H]1CCCOC1 ZINC000507459674 916228691 /nfs/dbraw/zinc/22/86/91/916228691.db2.gz GKZOUDJKAQBXLL-OALUTQOASA-N 2 0 413.528 4.012 20 0 HIADRP Clc1ccc(-c2noc(CC[NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)n2)cc1 ZINC000507508605 916273161 /nfs/dbraw/zinc/27/31/61/916273161.db2.gz JGLUBFRWNFBRGE-KSEOMHKRSA-N 2 0 422.960 4.433 20 0 HIADRP O=C(Nc1ccc(-n2ccnc2)c(F)c1)[C@@H]1C[N@H+](Cc2ccccc2)CCC1(F)F ZINC000507749774 916539291 /nfs/dbraw/zinc/53/92/91/916539291.db2.gz TZTPOKZNRMWUFI-SFHVURJKSA-N 2 0 414.431 4.107 20 0 HIADRP Cc1cc(C[NH+]2CCC(C(=O)NCC[N@@H+](C)Cc3ccccc3)CC2)ccc1Cl ZINC000507799636 916583916 /nfs/dbraw/zinc/58/39/16/916583916.db2.gz WADHNKUEWSESGF-UHFFFAOYSA-N 2 0 413.993 4.109 20 0 HIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2ccc(OC(F)F)c(Br)c2)C[C@H](C)O1 ZINC000507920360 916800536 /nfs/dbraw/zinc/80/05/36/916800536.db2.gz UQZNLAJKWXBFHH-KBPBESRZSA-N 2 0 421.326 4.030 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](CCC(=O)N[C@@H](c2cccs2)c2ccccc2)CC1 ZINC000507964908 916818493 /nfs/dbraw/zinc/81/84/93/916818493.db2.gz IXENAWXPLGOLFF-XMMPIXPASA-N 2 0 413.631 4.398 20 0 HIADRP C[C@H](Nc1ccccc1C[NH+]1CCC(CO)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508699518 917460687 /nfs/dbraw/zinc/46/06/87/917460687.db2.gz OICMRIBWLJVKPD-XUZZJYLKSA-N 2 0 407.602 4.213 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703064 917464065 /nfs/dbraw/zinc/46/40/65/917464065.db2.gz XHQDFFLKBJVNGK-SQJMNOBHSA-N 2 0 405.586 4.313 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)ccc2NC1=O ZINC000508709400 917468985 /nfs/dbraw/zinc/46/89/85/917468985.db2.gz HLDOLMOYFCENEO-OXHIVJRSSA-N 2 0 407.558 4.357 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@H](C)[C@H](c2ccccc2)[NH+](C)C)CC1)CC1CC1 ZINC000508869825 917623627 /nfs/dbraw/zinc/62/36/27/917623627.db2.gz JDBCTVKIKHBRRP-HYBUGGRVSA-N 2 0 414.638 4.221 20 0 HIADRP CCC[N@H+](C)[C@@H](CNC(=O)N1CCC(CC[NH+](C)C)CC1)c1ccc(Cl)cc1 ZINC000509028467 917783828 /nfs/dbraw/zinc/78/38/28/917783828.db2.gz BEEYATNZFVOEAG-NRFANRHFSA-N 2 0 409.018 4.096 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000509132185 917861848 /nfs/dbraw/zinc/86/18/48/917861848.db2.gz OHGZRIVMKBYMIX-GGAORHGYSA-N 2 0 424.589 4.016 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N(C)[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000509613193 918261252 /nfs/dbraw/zinc/26/12/52/918261252.db2.gz JNCWOLCIUSKGME-KSEOMHKRSA-N 2 0 412.578 4.015 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000511162495 919784602 /nfs/dbraw/zinc/78/46/02/919784602.db2.gz RPIPTFZDKDUJIE-QFIPXVFZSA-N 2 0 419.613 4.447 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000511375895 919973951 /nfs/dbraw/zinc/97/39/51/919973951.db2.gz FVCJVALODMVCMG-BJKOFHAPSA-N 2 0 416.009 4.342 20 0 HIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2cnn(-c3ccc(C(F)(F)F)cc3)c2)ccc1F ZINC000512011043 920784075 /nfs/dbraw/zinc/78/40/75/920784075.db2.gz VADVGHOEIOJDNC-UHFFFAOYSA-N 2 0 406.427 4.382 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000512132462 920880475 /nfs/dbraw/zinc/88/04/75/920880475.db2.gz SCMKJTCGFBUVGB-BPLDGKMQSA-N 2 0 403.876 4.292 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000512150903 920891967 /nfs/dbraw/zinc/89/19/67/920891967.db2.gz XCLGMZXRTHHMFK-SRCQZFHVSA-N 2 0 403.876 4.292 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)CC2(C)C)c1 ZINC000512159336 920898691 /nfs/dbraw/zinc/89/86/91/920898691.db2.gz QSDZFJQSEBWJNA-XMMPIXPASA-N 2 0 422.617 4.238 20 0 HIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2c[nH]nc2-c2ccc3c(c2)OCO3)C[N@@H+]1Cc1ccccc1 ZINC000513501608 921851223 /nfs/dbraw/zinc/85/12/23/921851223.db2.gz UMUXDQBQBRSTJA-QUCCMNQESA-N 2 0 418.541 4.196 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N[C@H]2CC[N@H+](C3CC3)[C@H]2c2cccc(OC)c2)cc1 ZINC000513652892 921974576 /nfs/dbraw/zinc/97/45/76/921974576.db2.gz BVYYLMRKJYKWQM-DQEYMECFSA-N 2 0 421.585 4.245 20 0 HIADRP COc1ccc(-n2ccc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)n2)cc1 ZINC000513673322 921995771 /nfs/dbraw/zinc/99/57/71/921995771.db2.gz PHNLTWXYKMRLSC-UHFFFAOYSA-N 2 0 404.558 4.414 20 0 HIADRP c1ncn(Cc2ccc(C[NH2+][C@@H]3CCCC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)cc2)n1 ZINC000513761152 922079054 /nfs/dbraw/zinc/07/90/54/922079054.db2.gz MJGRREQINJRLCO-JIMJEQGWSA-N 2 0 415.585 4.107 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC4(CCCCC4)Oc4ccccc43)cn2)CC1 ZINC000513788425 922114823 /nfs/dbraw/zinc/11/48/23/922114823.db2.gz QQRPJYXHRDMLRU-QFIPXVFZSA-N 2 0 406.574 4.150 20 0 HIADRP CCC1(CNC(=O)NC2CCC(C[NH+](C)C)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000514028496 922351585 /nfs/dbraw/zinc/35/15/85/922351585.db2.gz FUDYFUKASQAVSR-UHFFFAOYSA-N 2 0 414.638 4.098 20 0 HIADRP CN(C)C(=O)c1cccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000514092164 922414253 /nfs/dbraw/zinc/41/42/53/922414253.db2.gz CHONJANRPRGXPU-CCDWMCETSA-N 2 0 405.586 4.169 20 0 HIADRP Cc1nc(COc2ccc(C[NH+]3CCC(C[N@@H+](C)Cc4ccccc4)CC3)cc2)no1 ZINC000514091223 922415030 /nfs/dbraw/zinc/41/50/30/922415030.db2.gz YJKMIKKAWHQRDS-UHFFFAOYSA-N 2 0 420.557 4.301 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccc(OC(F)(F)F)cc1 ZINC000514100653 922426607 /nfs/dbraw/zinc/42/66/07/922426607.db2.gz XAOIQXRUQBEZPH-FQEVSTJZSA-N 2 0 422.495 4.363 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000514102302 922430728 /nfs/dbraw/zinc/43/07/28/922430728.db2.gz NLSZPNLWFWUAKJ-UHFFFAOYSA-N 2 0 419.613 4.480 20 0 HIADRP COc1ccc(-c2ccccc2)cc1C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000514250432 922591950 /nfs/dbraw/zinc/59/19/50/922591950.db2.gz UMAPNQSMHQMXQV-VWLOTQADSA-N 2 0 402.538 4.219 20 0 HIADRP CC[NH+]1CCC(C[NH2+][C@@H](c2cccc(S(C)(=O)=O)c2)c2ccc(C)cc2C)CC1 ZINC000514882637 922830813 /nfs/dbraw/zinc/83/08/13/922830813.db2.gz XYLCDBFEQSKUOD-DEOSSOPVSA-N 2 0 414.615 4.118 20 0 HIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000515326954 923051644 /nfs/dbraw/zinc/05/16/44/923051644.db2.gz XCUUNYQTPCATRD-GHRIWEEISA-N 2 0 419.491 4.190 20 0 HIADRP COc1ccc(NC(=O)[C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000515523505 923154040 /nfs/dbraw/zinc/15/40/40/923154040.db2.gz QNQDPUVNNRUFIC-UFYCRDLUSA-N 2 0 409.574 4.290 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(CNC(=O)NC3CC[NH+](C(C)(C)C)CC3)cc2)C1 ZINC000515820259 923373083 /nfs/dbraw/zinc/37/30/83/923373083.db2.gz FUXXTPJTCMFASX-BGYRXZFFSA-N 2 0 414.638 4.227 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)C1 ZINC000515819970 923373379 /nfs/dbraw/zinc/37/33/79/923373379.db2.gz YUVBSAZYHLCYJZ-WOJBJXKFSA-N 2 0 414.638 4.227 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)Nc2cccc(OCC[NH+](C)C)c2)c2ccccc2)CC1 ZINC000516468730 923747666 /nfs/dbraw/zinc/74/76/66/923747666.db2.gz BPXIFYLYNFKBJI-DEOSSOPVSA-N 2 0 424.589 4.222 20 0 HIADRP O[C@@H](C[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)COCc1ccccc1Cl ZINC000516709655 923857027 /nfs/dbraw/zinc/85/70/27/923857027.db2.gz NPFWILIUCAEBIQ-GGAORHGYSA-N 2 0 416.993 4.109 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000516765773 923882187 /nfs/dbraw/zinc/88/21/87/923882187.db2.gz QKBBTWADVRTMNX-PZJWPPBQSA-N 2 0 415.578 4.053 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2ccccc2OC2CCCC2)CC1 ZINC000517537298 924252403 /nfs/dbraw/zinc/25/24/03/924252403.db2.gz PAEDGHQIQJMYKX-UHFFFAOYSA-N 2 0 407.602 4.435 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000518353166 927215672 /nfs/dbraw/zinc/21/56/72/927215672.db2.gz GDJIRCXALWYVLT-RUZDIDTESA-N 2 0 405.586 4.201 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)c1 ZINC000518403098 927243383 /nfs/dbraw/zinc/24/33/83/927243383.db2.gz FNJOGLOWUVPKQC-HYBUGGRVSA-N 2 0 408.590 4.163 20 0 HIADRP CC(C)(C)[N@@H+]1CCCN(C(=O)NCC2CC[NH+](Cc3ccccc3Cl)CC2)CC1 ZINC000518564294 927347537 /nfs/dbraw/zinc/34/75/37/927347537.db2.gz DGNNJALACSLUEH-UHFFFAOYSA-N 2 0 421.029 4.068 20 0 HIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000518591498 927368271 /nfs/dbraw/zinc/36/82/71/927368271.db2.gz KQQIEWWEKBIVPA-GCZGMXNJSA-N 2 0 419.613 4.061 20 0 HIADRP COc1cc(C[NH2+]Cc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)cc2c1OCCO2 ZINC000518764230 927481573 /nfs/dbraw/zinc/48/15/73/927481573.db2.gz CFJAIKHHMFGURJ-RTBURBONSA-N 2 0 410.558 4.234 20 0 HIADRP C[C@H](C[NH2+]Cc1ccc(OCc2c(F)cccc2Cl)cc1)CN1CC[NH+](C)CC1 ZINC000518777536 927488113 /nfs/dbraw/zinc/48/81/13/927488113.db2.gz JBPIPZVYUVAZDH-GOSISDBHSA-N 2 0 419.972 4.031 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000519433414 927944350 /nfs/dbraw/zinc/94/43/50/927944350.db2.gz VDXGLSFDWPXGAP-QFIPXVFZSA-N 2 0 409.549 4.315 20 0 HIADRP CCCC[N@@H+]1CCCC[C@H]1CNC(=O)NC1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000520377733 928531021 /nfs/dbraw/zinc/53/10/21/928531021.db2.gz NBHWHECPYLDJOD-NHYNNZIHSA-N 2 0 412.622 4.136 20 0 HIADRP Cc1ccccc1[C@@H]1C[C@H](C)[N@@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000524593617 929704297 /nfs/dbraw/zinc/70/42/97/929704297.db2.gz JDGLRIXJVYLEHU-XUZZJYLKSA-N 2 0 405.586 4.085 20 0 HIADRP O=C(NC[C@H]1CCC[N@H+](Cc2cccs2)C1)[C@@H]1CCCC[NH+]1Cc1ccccc1 ZINC000524968857 929933741 /nfs/dbraw/zinc/93/37/41/929933741.db2.gz VPNVPKLVOOUSAB-GGAORHGYSA-N 2 0 411.615 4.131 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000525857922 930469613 /nfs/dbraw/zinc/46/96/13/930469613.db2.gz GSQXDMZZAUOVOV-IBGZPJMESA-N 2 0 414.819 4.171 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(CN3CC[NH+](C)CC3)cc1)CCCS2 ZINC000525858212 930469674 /nfs/dbraw/zinc/46/96/74/930469674.db2.gz RRZDYFWXKQCLLF-HSZRJFAPSA-N 2 0 411.615 4.159 20 0 HIADRP CC[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Br)cc1Cl ZINC000525868407 930472438 /nfs/dbraw/zinc/47/24/38/930472438.db2.gz OVMTZTKCVYAPNG-GOSISDBHSA-N 2 0 402.808 4.169 20 0 HIADRP C[C@@H](C[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc(F)cc1 ZINC000527361588 930648072 /nfs/dbraw/zinc/64/80/72/930648072.db2.gz NGNLWDOGOOSZFM-IBGZPJMESA-N 2 0 400.538 4.209 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)CC1 ZINC000530727911 930810052 /nfs/dbraw/zinc/81/00/52/930810052.db2.gz UXCNWKDYPDZJKE-UHFFFAOYSA-N 2 0 406.574 4.274 20 0 HIADRP Cc1ccc(NC(=O)NC[C@H](c2ccc(Cl)cc2)[NH+](C)C)c(OCC[NH+](C)C)c1 ZINC000530845264 930839422 /nfs/dbraw/zinc/83/94/22/930839422.db2.gz GTVOJVSRHPPKSY-HXUWFJFHSA-N 2 0 418.969 4.013 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@H](c2ccccc2)c2ccccc2C)C[C@@H]1C ZINC000530902272 930854207 /nfs/dbraw/zinc/85/42/07/930854207.db2.gz QTIRHFHPQLYBHA-FNFLUXIASA-N 2 0 410.602 4.267 20 0 HIADRP Cc1cc2cc(C[NH2+]Cc3cccc(C[N@@H+]4CCC[C@H](C(N)=O)C4)c3)oc2cc1C ZINC000530914474 930857955 /nfs/dbraw/zinc/85/79/55/930857955.db2.gz BAKNNAVQOZBPHY-NRFANRHFSA-N 2 0 405.542 4.037 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)Nc2ccc(C[NH+]3CCSCC3)cc2C)CC1 ZINC000530966355 930871011 /nfs/dbraw/zinc/87/10/11/930871011.db2.gz DJKZMBGXSZFEAK-UHFFFAOYSA-N 2 0 424.614 4.102 20 0 HIADRP COc1ccc([C@@H](CNC(=O)[C@H]2CCCC[N@@H+]2Cc2ccccc2)[NH+]2CCCC2)cc1 ZINC000531281676 930999568 /nfs/dbraw/zinc/99/95/68/930999568.db2.gz XZYVKKFYFUIDNW-JWQCQUIFSA-N 2 0 421.585 4.003 20 0 HIADRP CN(c1ccccc1C[NH2+]CCCOc1cccc2cccnc21)C1CC[NH+](C)CC1 ZINC000531594422 931113390 /nfs/dbraw/zinc/11/33/90/931113390.db2.gz JZLLPKOVTGXODB-UHFFFAOYSA-N 2 0 418.585 4.324 20 0 HIADRP CO[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000531594410 931113420 /nfs/dbraw/zinc/11/34/20/931113420.db2.gz GQBZXUZIYJJYCJ-HSZRJFAPSA-N 2 0 401.982 4.348 20 0 HIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000531595353 931114666 /nfs/dbraw/zinc/11/46/66/931114666.db2.gz KRZBDDOFMVTLTD-RDGATRHJSA-N 3 0 420.645 4.360 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccc(C(=O)OC(C)(C)C)cc1)C1CC[NH+](C)CC1 ZINC000531596304 931115373 /nfs/dbraw/zinc/11/53/73/931115373.db2.gz VCMBZCMKGXBFMW-UHFFFAOYSA-N 2 0 423.601 4.462 20 0 HIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CC(=O)Nc2cc(Cl)ccc2OC)c1 ZINC000531702662 931165100 /nfs/dbraw/zinc/16/51/00/931165100.db2.gz MEFXTKPTEFQIJE-INIZCTEOSA-N 2 0 403.954 4.307 20 0 HIADRP CC[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(Br)c1 ZINC000531710544 931168856 /nfs/dbraw/zinc/16/88/56/931168856.db2.gz XDASGSBWKHGZDA-VXKWHMMOSA-N 2 0 416.407 4.479 20 0 HIADRP Fc1ccc(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)c2ncccc12 ZINC000531837463 931214727 /nfs/dbraw/zinc/21/47/27/931214727.db2.gz XBCIPXQYPHSILT-UHFFFAOYSA-N 2 0 406.549 4.062 20 0 HIADRP COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000531942257 931255654 /nfs/dbraw/zinc/25/56/54/931255654.db2.gz DJHPNYKMLQZKRL-OAQYLSRUSA-N 2 0 416.997 4.372 20 0 HIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CC(=O)N(C)Cc2cccc(Cl)c2)c1 ZINC000531958482 931264711 /nfs/dbraw/zinc/26/47/11/931264711.db2.gz FMKAWOGJZUVBBK-SFHVURJKSA-N 2 0 401.982 4.319 20 0 HIADRP COc1ccc(OC(F)F)c(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000532105405 931313062 /nfs/dbraw/zinc/31/30/62/931313062.db2.gz GIFJWXVCFNFHLC-UHFFFAOYSA-N 2 0 419.516 4.117 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c2ccccc2n1 ZINC000532104509 931313494 /nfs/dbraw/zinc/31/34/94/931313494.db2.gz PACPTDJRBMXAPO-UHFFFAOYSA-N 2 0 404.558 4.064 20 0 HIADRP CC[C@@H](C)C(=O)Nc1cccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000532107689 931315602 /nfs/dbraw/zinc/31/56/02/931315602.db2.gz FXHXVUQHAJJPOL-HXUWFJFHSA-N 2 0 422.617 4.491 20 0 HIADRP COc1cc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c(-c2ccccc2)cc1OC ZINC000532270309 931378879 /nfs/dbraw/zinc/37/88/79/931378879.db2.gz ZGIMVMBUKSGAEY-ZEQRLZLVSA-N 2 0 424.585 4.228 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000532449740 931439782 /nfs/dbraw/zinc/43/97/82/931439782.db2.gz SDWKLXAZPXZYIZ-LJQANCHMSA-N 2 0 419.038 4.458 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(NC(=O)c2ccco2)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000532472124 931451333 /nfs/dbraw/zinc/45/13/33/931451333.db2.gz CRKKTRRBSYIPQP-GOSISDBHSA-N 2 0 407.514 4.323 20 0 HIADRP C(CCN1CCC[NH+](C2CCCC2)CC1)CCN1CCC[N@@H+](C2CCCC2)CC1 ZINC000532575600 931535362 /nfs/dbraw/zinc/53/53/62/931535362.db2.gz BYPMXIXKZGCWDK-UHFFFAOYSA-N 2 0 404.687 4.057 20 0 HIADRP CCC1(C[NH2+]Cc2ccccc2N2CCOCC2)CC[NH+](Cc2ccccc2)CC1 ZINC000532805514 931634796 /nfs/dbraw/zinc/63/47/96/931634796.db2.gz ZQZVBDDALDCHPV-UHFFFAOYSA-N 2 0 407.602 4.305 20 0 HIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(C[NH+]3CCC(CC[NH+](C)C)CC3)cc2)CC1 ZINC000532927085 931698017 /nfs/dbraw/zinc/69/80/17/931698017.db2.gz ILYQYESJTJXXNQ-UHFFFAOYSA-N 4 0 414.682 4.014 20 0 HIADRP COc1ccc(NC(=O)CC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)cc1 ZINC000533025090 931743946 /nfs/dbraw/zinc/74/39/46/931743946.db2.gz YNSUHCFOXBHQHP-ZJSXRUAMSA-N 2 0 407.558 4.010 20 0 HIADRP O=C(C[NH2+][C@@H](c1ccccc1)C1CCC1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000533046153 931751200 /nfs/dbraw/zinc/75/12/00/931751200.db2.gz KWJZEIUGPVNYAQ-DEOSSOPVSA-N 2 0 409.599 4.305 20 0 HIADRP O=C(C[NH2+][C@H](c1ccccc1)C1CCC1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000533046154 931751345 /nfs/dbraw/zinc/75/13/45/931751345.db2.gz KWJZEIUGPVNYAQ-XMMPIXPASA-N 2 0 409.599 4.305 20 0 HIADRP C[C@@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000533248289 931818628 /nfs/dbraw/zinc/81/86/28/931818628.db2.gz OYTODLLIKJXINH-SFHVURJKSA-N 2 0 415.578 4.109 20 0 HIADRP CCSc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000533784981 932031375 /nfs/dbraw/zinc/03/13/75/932031375.db2.gz XZNKRKIRSNEWTR-XMSQKQJNSA-N 2 0 411.615 4.347 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)[C@@H](c2ccccc2)C1 ZINC000534352023 932389685 /nfs/dbraw/zinc/38/96/85/932389685.db2.gz IHAVVLAGXFBEEA-HDYLNDSGSA-N 2 0 407.602 4.123 20 0 HIADRP c1nc2ccccc2n1-c1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000537620558 938335886 /nfs/dbraw/zinc/33/58/86/938335886.db2.gz WNBMYWVOHHFYDG-UHFFFAOYSA-N 2 0 404.558 4.102 20 0 HIADRP C[NH+](C)CCOC1CC[NH+](Cc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000537631501 938341567 /nfs/dbraw/zinc/34/15/67/938341567.db2.gz OPSLTRVRAZKTOV-UHFFFAOYSA-N 2 0 424.408 4.115 20 0 HIADRP OC[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1 ZINC000537958501 938433590 /nfs/dbraw/zinc/43/35/90/938433590.db2.gz WFCCSUPJXVSJSB-OAQYLSRUSA-N 2 0 420.519 4.153 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(Cn3cnc4ccccc43)c2)[C@H](C)C1 ZINC000537959285 938434200 /nfs/dbraw/zinc/43/42/00/938434200.db2.gz AKMRVRUJCNXVIY-QPPBQGQZSA-N 2 0 420.601 4.311 20 0 HIADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000563314349 945176129 /nfs/dbraw/zinc/17/61/29/945176129.db2.gz IXNHOWFOEUZFSX-TZIWHRDSSA-N 2 0 415.603 4.011 20 0 HIADRP CC[N@H+](CCC1CC[NH+](CCC(=O)N2CCc3sccc3C2)CC1)CC(C)C ZINC000537995636 938455373 /nfs/dbraw/zinc/45/53/73/938455373.db2.gz LXKBYHWEYNUBJM-UHFFFAOYSA-N 2 0 405.652 4.103 20 0 HIADRP CC[C@@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2ccccc2C1 ZINC000538268917 938580004 /nfs/dbraw/zinc/58/00/04/938580004.db2.gz QLTGNLKPBDRMKK-UKILVPOCSA-N 2 0 419.613 4.401 20 0 HIADRP CN(C)c1cc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c2ccccc2n1 ZINC000538293637 938585087 /nfs/dbraw/zinc/58/50/87/938585087.db2.gz KVHYCNRADWSIOB-QHCPKHFHSA-N 2 0 416.569 4.379 20 0 HIADRP Cc1cccc([C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C(=O)NC2CC[NH+](C(C)C)CC2)c1 ZINC000563467996 945192987 /nfs/dbraw/zinc/19/29/87/945192987.db2.gz OSMXISYMYFLDKO-FTJBHMTQSA-N 2 0 419.613 4.200 20 0 HIADRP CSc1cccc([C@@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2ccc(F)c(F)c2)c1 ZINC000538709466 938687463 /nfs/dbraw/zinc/68/74/63/938687463.db2.gz SEPTZAXJCCJMNM-HSZRJFAPSA-N 2 0 419.585 4.393 20 0 HIADRP Cc1cc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)ccc1-n1cncn1 ZINC000538797906 938714698 /nfs/dbraw/zinc/71/46/98/938714698.db2.gz FAIZOIXSHZDBBV-NOZRDPDXSA-N 2 0 401.558 4.062 20 0 HIADRP CC[N@H+](CCC1CC[NH+]([C@H](C)C(=O)N(C)Cc2cccc(F)c2)CC1)CC1CC1 ZINC000538948578 938745571 /nfs/dbraw/zinc/74/55/71/938745571.db2.gz IMTZCZNMRQAQQH-LJQANCHMSA-N 2 0 403.586 4.007 20 0 HIADRP Clc1ccc(OC[C@@H]2CCCO2)c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000538969251 938754974 /nfs/dbraw/zinc/75/49/74/938754974.db2.gz MFBPHXOPVKZUNV-QFIPXVFZSA-N 2 0 415.965 4.299 20 0 HIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1I ZINC000539038263 938777225 /nfs/dbraw/zinc/77/72/25/938777225.db2.gz TYXRJPUOVXMSRC-HNNXBMFYSA-N 2 0 421.326 4.253 20 0 HIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000539041072 938778353 /nfs/dbraw/zinc/77/83/53/938778353.db2.gz HAZCNCUXENDABX-HBFSDRIKSA-N 2 0 418.578 4.181 20 0 HIADRP COc1ccc(NC(=O)C[C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000539045557 938780919 /nfs/dbraw/zinc/78/09/19/938780919.db2.gz BCPGJMZZRPPLDI-ONTIZHBOSA-N 2 0 409.574 4.303 20 0 HIADRP COc1ccc(OC)c(NC(=O)C[C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000539047012 938782017 /nfs/dbraw/zinc/78/20/17/938782017.db2.gz QALZSOUCPKIFAX-XEVCZEQESA-N 2 0 417.594 4.054 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000539063534 938788935 /nfs/dbraw/zinc/78/89/35/938788935.db2.gz JXKNJSOXSOBUOG-GDIGMMSISA-N 2 0 402.526 4.369 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000539063536 938789401 /nfs/dbraw/zinc/78/94/01/938789401.db2.gz JXKNJSOXSOBUOG-KYNGSXCRSA-N 2 0 402.526 4.369 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@H]2CCCc3ccc(Cl)cc32)cc1 ZINC000539071096 938792830 /nfs/dbraw/zinc/79/28/30/938792830.db2.gz NQDOFTNDNCBVQD-QHCPKHFHSA-N 2 0 411.977 4.333 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)cc1 ZINC000539070387 938793123 /nfs/dbraw/zinc/79/31/23/938793123.db2.gz GJDPANNKVVZHSS-QHCPKHFHSA-N 2 0 419.569 4.048 20 0 HIADRP Cc1c([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cnn1-c1cccc(Cl)c1 ZINC000539072666 938794144 /nfs/dbraw/zinc/79/41/44/938794144.db2.gz FIVFVDOXFPHPAW-KSZLIROESA-N 2 0 404.986 4.374 20 0 HIADRP Cc1c([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)cnn1-c1cccc(Cl)c1 ZINC000539072668 938794208 /nfs/dbraw/zinc/79/42/08/938794208.db2.gz FIVFVDOXFPHPAW-KURKYZTESA-N 2 0 404.986 4.374 20 0 HIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000539072325 938794269 /nfs/dbraw/zinc/79/42/69/938794269.db2.gz PMUUNNGZOISQQW-UFYCRDLUSA-N 2 0 404.599 4.100 20 0 HIADRP CC(C)Oc1ccccc1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000563501734 945206691 /nfs/dbraw/zinc/20/66/91/945206691.db2.gz CBIGEWQQULYMFZ-DEOSSOPVSA-N 2 0 408.586 4.492 20 0 HIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ncc(Br)s1 ZINC000539297094 938836028 /nfs/dbraw/zinc/83/60/28/938836028.db2.gz FQNOWSRXTGWMAP-OAHLLOKOSA-N 2 0 424.408 4.274 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccccc2OC(F)F)CC1 ZINC000539309869 938838540 /nfs/dbraw/zinc/83/85/40/938838540.db2.gz BNRRPYIXZKMAQD-MRXNPFEDSA-N 2 0 407.480 4.420 20 0 HIADRP C[C@@H]([NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1cccc(N2CCCC2=O)c1 ZINC000539361951 938848762 /nfs/dbraw/zinc/84/87/62/938848762.db2.gz MELFTMLOQISNAW-XXBNENTESA-N 2 0 419.569 4.452 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cccc(-n3cccn3)c2)CC1 ZINC000539494323 938868210 /nfs/dbraw/zinc/86/82/10/938868210.db2.gz DSDGVARANCYCPA-IBGZPJMESA-N 2 0 407.537 4.004 20 0 HIADRP COc1ccc2ccccc2c1C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000539822749 938945422 /nfs/dbraw/zinc/94/54/22/938945422.db2.gz KKBISHBHMBZYLT-UHFFFAOYSA-N 2 0 409.618 4.477 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccccc1N(C)C ZINC000539857752 938959316 /nfs/dbraw/zinc/95/93/16/938959316.db2.gz DUBJKIKKQJGHFS-HXUWFJFHSA-N 2 0 411.590 4.093 20 0 HIADRP Cc1ccc(COc2ccc(C[N@H+]3CC[C@H](N4CC[NH+](C(C)C)CC4)C3)cc2)cc1 ZINC000539862712 938960696 /nfs/dbraw/zinc/96/06/96/938960696.db2.gz URNLHLFFGWFQGC-VWLOTQADSA-N 2 0 407.602 4.174 20 0 HIADRP CCc1ccc([C@@H](C)NC(=O)C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000540044835 939047855 /nfs/dbraw/zinc/04/78/55/939047855.db2.gz PBRZEDAGNQBPSB-HXUWFJFHSA-N 2 0 408.590 4.060 20 0 HIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000540140959 939088739 /nfs/dbraw/zinc/08/87/39/939088739.db2.gz BPMZZKOUUJUFLP-ZJOUEHCJSA-N 2 0 400.588 4.041 20 0 HIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(N2CCOCC2)c1 ZINC000540145700 939090909 /nfs/dbraw/zinc/09/09/09/939090909.db2.gz LKOSUFXSAZKUOH-AOHZBQACSA-N 2 0 407.602 4.475 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H](CO)Cc1ccccc1C(F)(F)F ZINC000540161843 939097514 /nfs/dbraw/zinc/09/75/14/939097514.db2.gz YWFONWLKXPAWQZ-KKLQWCBXSA-N 2 0 420.519 4.357 20 0 HIADRP CCSc1ccccc1[C@H](C)[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000540168652 939101061 /nfs/dbraw/zinc/10/10/61/939101061.db2.gz FREKBRNLGKMPSI-IBGZPJMESA-N 2 0 411.615 4.475 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1cccc(C(F)(F)F)c1 ZINC000540261171 939176349 /nfs/dbraw/zinc/17/63/49/939176349.db2.gz UKVMLPRAKNIASV-NRFANRHFSA-N 2 0 406.496 4.339 20 0 HIADRP C[C@H](C[NH2+][C@H](c1ccccc1)[C@H]1CCOC1)C[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000540389408 939226975 /nfs/dbraw/zinc/22/69/75/939226975.db2.gz MLPMNIJQGVPLTD-OCKUVUBHSA-N 2 0 408.586 4.357 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@@H](c1ccccc1)C(C)(C)CO)c1ccccc1O2 ZINC000540494301 939275011 /nfs/dbraw/zinc/27/50/11/939275011.db2.gz VMTIPZJWTDICBZ-GOTSBHOMSA-N 2 0 408.586 4.367 20 0 HIADRP CCC[C@@H]1CN(C(=O)C2CCN(c3cc[nH+]cc3C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000540533735 939293476 /nfs/dbraw/zinc/29/34/76/939293476.db2.gz ZVUZFDGUTJSJHS-XMMPIXPASA-N 2 0 420.601 4.120 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc2cc(Cl)ccc2o1 ZINC000540594719 939314226 /nfs/dbraw/zinc/31/42/26/939314226.db2.gz YXPBUYZVHBSUCD-QGZVFWFLSA-N 2 0 413.953 4.129 20 0 HIADRP CCOc1cccc2cc([C@H](C)[NH2+]Cc3ccc(CN4CC[NH+](C)CC4)cc3)oc21 ZINC000540598404 939316000 /nfs/dbraw/zinc/31/60/00/939316000.db2.gz IPJDOLDIKDSSQA-IBGZPJMESA-N 2 0 407.558 4.430 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2c(C)nn(C(C)(C)C)c2C)CC1 ZINC000540609558 939318729 /nfs/dbraw/zinc/31/87/29/939318729.db2.gz UXBFKNYMDLUMLJ-KRWDZBQOSA-N 2 0 415.601 4.387 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(SCC(F)F)cc1 ZINC000540987910 939425681 /nfs/dbraw/zinc/42/56/81/939425681.db2.gz BZEZNDKXFDCXGS-OXQOHEQNSA-N 2 0 406.542 4.461 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H](Cc3ccccn3)c3cccnc3)cc2)CC1 ZINC000563683569 945253403 /nfs/dbraw/zinc/25/34/03/945253403.db2.gz VEDLYZTVKLFOQK-VWLOTQADSA-N 2 0 402.542 4.023 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000541214990 939486037 /nfs/dbraw/zinc/48/60/37/939486037.db2.gz PATWOSBKAHYHNW-INIZCTEOSA-N 2 0 407.986 4.310 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000541214991 939486059 /nfs/dbraw/zinc/48/60/59/939486059.db2.gz PATWOSBKAHYHNW-MRXNPFEDSA-N 2 0 407.986 4.310 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000541386272 939503008 /nfs/dbraw/zinc/50/30/08/939503008.db2.gz NLLWGXWFNNTMCR-UHFFFAOYSA-N 2 0 412.419 4.070 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000541550139 939552130 /nfs/dbraw/zinc/55/21/30/939552130.db2.gz XACNAISOJCYXAQ-HXUWFJFHSA-N 2 0 410.558 4.465 20 0 HIADRP CC(CN[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)C[NH2+][C@H](C)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000541600499 939564902 /nfs/dbraw/zinc/56/49/02/939564902.db2.gz JRDSQDCQQSAJFW-MOUTVQLLSA-N 3 0 418.714 4.108 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H]3CCCc4c(Cl)cccc43)c2)C1 ZINC000541744620 939618824 /nfs/dbraw/zinc/61/88/24/939618824.db2.gz UCZLLOPCLUXHNP-CVDCTZTESA-N 2 0 411.977 4.205 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H]3CCCc4c(Cl)cccc43)c2)C1 ZINC000541744621 939618940 /nfs/dbraw/zinc/61/89/40/939618940.db2.gz UCZLLOPCLUXHNP-WMZHIEFXSA-N 2 0 411.977 4.205 20 0 HIADRP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000541785628 939629448 /nfs/dbraw/zinc/62/94/48/939629448.db2.gz WJRHSENRWAQDNF-NJYVYQBISA-N 2 0 414.638 4.036 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cccc(OC(F)(F)F)c1 ZINC000541917890 939653760 /nfs/dbraw/zinc/65/37/60/939653760.db2.gz HDVIRDHYLWONMT-OXQOHEQNSA-N 2 0 408.464 4.393 20 0 HIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)c1 ZINC000541917993 939653828 /nfs/dbraw/zinc/65/38/28/939653828.db2.gz KDKQDNBTZODGDT-XLIONFOSSA-N 2 0 404.501 4.404 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(Br)c(F)c1 ZINC000541917409 939653939 /nfs/dbraw/zinc/65/39/39/939653939.db2.gz NAYBGZJTHWSGCX-KSSFIOAISA-N 2 0 407.327 4.006 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000542477653 939829933 /nfs/dbraw/zinc/82/99/33/939829933.db2.gz ONHWXRARZDNNKO-PMACEKPBSA-N 2 0 410.558 4.321 20 0 HIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCCc2nc(-c3ccc(F)cc3)no2)CC1 ZINC000542483605 939831345 /nfs/dbraw/zinc/83/13/45/939831345.db2.gz QSEAAGXLYMPENH-UTKZUKDTSA-N 2 0 400.542 4.441 20 0 HIADRP CCC(CC)(CNC(=O)N(C)[C@@H](C)C1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000542748223 939858716 /nfs/dbraw/zinc/85/87/16/939858716.db2.gz FVZGUZDTJPSTCX-PMACEKPBSA-N 2 0 402.627 4.268 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000542851057 939863095 /nfs/dbraw/zinc/86/30/95/939863095.db2.gz FSMYKFHGDYPHCK-DENIHFKCSA-N 2 0 420.475 4.319 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)cc1 ZINC000542852107 939863159 /nfs/dbraw/zinc/86/31/59/939863159.db2.gz QOPMHNBWZZXDDJ-HRAATJIYSA-N 2 0 403.364 4.257 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC1 ZINC000542981325 939890988 /nfs/dbraw/zinc/89/09/88/939890988.db2.gz MDKOSKQULBEVRL-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)Cc2ccn(C(C)C)n2)CC1 ZINC000543075844 939927206 /nfs/dbraw/zinc/92/72/06/939927206.db2.gz RDWYBDXNGPSBKA-MOPGFXCFSA-N 2 0 401.574 4.027 20 0 HIADRP CCC1(C[NH2+]Cc2cn(-c3cc[nH+]cc3)nc2C)CC[NH+](Cc2ccccc2)CC1 ZINC000543238852 940004652 /nfs/dbraw/zinc/00/46/52/940004652.db2.gz KADAPJRAKBELAE-UHFFFAOYSA-N 3 0 403.574 4.358 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1cccc(NC(=O)c2cccc(F)c2)c1 ZINC000543251006 940008059 /nfs/dbraw/zinc/00/80/59/940008059.db2.gz XEIZCFQQGROWPB-UHFFFAOYSA-N 2 0 415.472 4.257 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC000543289024 940019543 /nfs/dbraw/zinc/01/95/43/940019543.db2.gz USOBBRLWBXMQNU-XMMPIXPASA-N 2 0 405.586 4.267 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]C2CC(c3ccc(Cl)cc3)C2)cc1 ZINC000543414423 940057952 /nfs/dbraw/zinc/05/79/52/940057952.db2.gz CFSWBXYGVSTXKP-UHFFFAOYSA-N 2 0 411.977 4.201 20 0 HIADRP CC1(C(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000543415826 940058519 /nfs/dbraw/zinc/05/85/19/940058519.db2.gz CMNPDESECVZSPG-XMMPIXPASA-N 2 0 405.586 4.070 20 0 HIADRP NC(=O)[C@H](Cc1ccccc1)[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000543651796 940150612 /nfs/dbraw/zinc/15/06/12/940150612.db2.gz HYHQVMOZIPRJTN-SANMLTNESA-N 2 0 413.565 4.136 20 0 HIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)ccc1SC ZINC000543774504 940181514 /nfs/dbraw/zinc/18/15/14/940181514.db2.gz FUXXSLMKCYBQJQ-DYESRHJHSA-N 2 0 400.588 4.225 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000543775261 940182462 /nfs/dbraw/zinc/18/24/62/940182462.db2.gz QTJXXKZYFBIWEX-VGOFRKELSA-N 2 0 422.598 4.321 20 0 HIADRP COc1cc(OC)c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1Cl ZINC000543777105 940183703 /nfs/dbraw/zinc/18/37/03/940183703.db2.gz JUPKUWATOJYLMO-LPHOPBHVSA-N 2 0 418.965 4.165 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCCC4)C1 ZINC000543777606 940184163 /nfs/dbraw/zinc/18/41/63/940184163.db2.gz URGBUPAZUIIOAD-ILBGXUMGSA-N 2 0 406.570 4.136 20 0 HIADRP CCC1(C[NH2+]C2CCN(Cc3ccccn3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000544003089 940293640 /nfs/dbraw/zinc/29/36/40/940293640.db2.gz VJVSSKXHNYUMKK-UHFFFAOYSA-N 2 0 406.618 4.328 20 0 HIADRP C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000544004619 940293905 /nfs/dbraw/zinc/29/39/05/940293905.db2.gz ZKIBKEVCTDBQOE-AWEZNQCLSA-N 2 0 411.443 4.413 20 0 HIADRP c1cn(-c2csc(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)c2)cn1 ZINC000544110543 940328960 /nfs/dbraw/zinc/32/89/60/940328960.db2.gz OYDLTNIBZUMSPW-UHFFFAOYSA-N 2 0 410.587 4.095 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CN1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000544349390 940396950 /nfs/dbraw/zinc/39/69/50/940396950.db2.gz UOPFLMZDGMTCCQ-DHLKQENFSA-N 2 0 401.558 4.062 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000563849165 945314492 /nfs/dbraw/zinc/31/44/92/945314492.db2.gz LRWQGYOFGYWJGN-OZOXKJRCSA-N 2 0 423.384 4.233 20 0 HIADRP Cc1ccc(-c2noc(CCC[NH2+][C@@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)n2)cc1F ZINC000544421237 940420255 /nfs/dbraw/zinc/42/02/55/940420255.db2.gz KDOREKWDHMLNQR-HKUYNNGSSA-N 2 0 400.542 4.359 20 0 HIADRP C[C@@H](CS(=O)(=O)c1ccccc1)[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000544578534 940483743 /nfs/dbraw/zinc/48/37/43/940483743.db2.gz BODIWLABJBZUAU-FQEVSTJZSA-N 2 0 422.594 4.367 20 0 HIADRP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)Nc1cccc(CC[NH+]2CCC(C)CC2)c1 ZINC000544610107 940490116 /nfs/dbraw/zinc/49/01/16/940490116.db2.gz KJUQULIZSRZQHH-FQEVSTJZSA-N 2 0 400.611 4.155 20 0 HIADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000544619709 940491790 /nfs/dbraw/zinc/49/17/90/940491790.db2.gz PMXAWZGRXINAAQ-HXUWFJFHSA-N 2 0 414.638 4.323 20 0 HIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+][C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)CC1 ZINC000544623472 940492440 /nfs/dbraw/zinc/49/24/40/940492440.db2.gz CPRAANKIKLIPGZ-AUSIDOKSSA-N 2 0 417.956 4.241 20 0 HIADRP CCC1(C[NH2+][C@H](Cc2ccc(Cl)cc2)C(N)=O)CC[NH+](Cc2ccccc2)CC1 ZINC000546886668 940901271 /nfs/dbraw/zinc/90/12/71/940901271.db2.gz AYVTZIRCOHQAKT-JOCHJYFZSA-N 2 0 413.993 4.018 20 0 HIADRP Cc1cc(NC(=O)CC[N@@H+](C)C2CCCCC2)n([C@H]2CC[NH+](Cc3ccccc3)C2)n1 ZINC000548392581 941099247 /nfs/dbraw/zinc/09/92/47/941099247.db2.gz IJYJFUHIOBEVKP-QHCPKHFHSA-N 2 0 423.605 4.232 20 0 HIADRP CCCOC[C@@H](Cc1cccc(Br)c1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000548485511 941108595 /nfs/dbraw/zinc/10/85/95/941108595.db2.gz GVWQSPSPPPFUJQ-OAQYLSRUSA-N 2 0 409.412 4.251 20 0 HIADRP C[NH+](C)C[C@H](NC(=O)NCc1cccc(C[NH+]2CCCC2)c1)c1ccc(Cl)cc1 ZINC000549104710 941159795 /nfs/dbraw/zinc/15/97/95/941159795.db2.gz QQKHNEWDQDHYJO-QFIPXVFZSA-N 2 0 414.981 4.038 20 0 HIADRP Cc1cc(NC[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c2ccccc2[nH+]1 ZINC000549617288 941201554 /nfs/dbraw/zinc/20/15/54/941201554.db2.gz IORUSCCGZDOYEV-QFIPXVFZSA-N 2 0 401.554 4.306 20 0 HIADRP CCc1nc(C(C)C)ccc1C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000549866432 941220385 /nfs/dbraw/zinc/22/03/85/941220385.db2.gz VXEIEKLHUZWSGV-UHFFFAOYSA-N 2 0 400.655 4.396 20 0 HIADRP COc1ccc2c(c1)C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CC2 ZINC000549868342 941220852 /nfs/dbraw/zinc/22/08/52/941220852.db2.gz UIVRFMBSICOAIK-DQEYMECFSA-N 2 0 420.597 4.071 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+]([C@@H]2CCN([C@H](C)c3ccc(F)cc3)C2=O)CC1 ZINC000549932064 941241729 /nfs/dbraw/zinc/24/17/29/941241729.db2.gz PFBGCNQPSIMCKJ-AUSIDOKSSA-N 2 0 403.586 4.322 20 0 HIADRP Brc1cccc2c1C[C@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CC2 ZINC000550199760 941297619 /nfs/dbraw/zinc/29/76/19/941297619.db2.gz KEFWYUZEYBRHGY-GOSISDBHSA-N 2 0 400.364 4.208 20 0 HIADRP CC(C)(C)[N@@H+]1C[C@@H](C(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)[C@H](C(F)(F)F)C1 ZINC000550259680 941305157 /nfs/dbraw/zinc/30/51/57/941305157.db2.gz SGTDKFPPYAXMSX-IPMKNSEASA-N 2 0 417.560 4.010 20 0 HIADRP CN1CC[C@H]([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)C[C@H]1c1ccccc1 ZINC000550700358 941355659 /nfs/dbraw/zinc/35/56/59/941355659.db2.gz GCXDOGODEGCMCP-AHWVRZQESA-N 2 0 407.602 4.129 20 0 HIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1OC ZINC000550881856 941378504 /nfs/dbraw/zinc/37/85/04/941378504.db2.gz DVFXXDGWUBVTNB-REWPJTCUSA-N 2 0 424.585 4.283 20 0 HIADRP CC(C)[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccc(F)cn1 ZINC000550883315 941378850 /nfs/dbraw/zinc/37/88/50/941378850.db2.gz YPOXYHYYOKBCLO-QPPBQGQZSA-N 2 0 411.565 4.436 20 0 HIADRP CCOc1cccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c1OC(F)F ZINC000551226793 941431231 /nfs/dbraw/zinc/43/12/31/941431231.db2.gz DIDLGEYTSJNKRP-UHFFFAOYSA-N 2 0 420.500 4.450 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(Oc4cnccn4)cc3)cc2)CC1 ZINC000551233277 941432505 /nfs/dbraw/zinc/43/25/05/941432505.db2.gz NIVNWENIFZEXBF-UHFFFAOYSA-N 2 0 404.514 4.032 20 0 HIADRP Cc1c([C@@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cnn1C(C)C ZINC000551264722 941438886 /nfs/dbraw/zinc/43/88/86/941438886.db2.gz MNHSTDGNNYGSSY-OFNKIYASSA-N 2 0 410.606 4.352 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]C4CCN(Cc5ccncc5)CC4)[C@H]3C2)cc1 ZINC000552040907 941571885 /nfs/dbraw/zinc/57/18/85/941571885.db2.gz KFOUHMNKVSQYNS-DOEKTCAHSA-N 2 0 418.629 4.326 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]C4CCN(Cc5ccncc5)CC4)[C@@H]3C2)cc1 ZINC000552040908 941571996 /nfs/dbraw/zinc/57/19/96/941571996.db2.gz KFOUHMNKVSQYNS-OIKPOIBNSA-N 2 0 418.629 4.326 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)CC1 ZINC000552073654 941579435 /nfs/dbraw/zinc/57/94/35/941579435.db2.gz MWRBRWPBDIAMBE-XABBQPORSA-N 2 0 410.562 4.200 20 0 HIADRP CCC[N@H+](C)[C@@H](CNC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1)c1ccc(Cl)cc1 ZINC000554251274 942078886 /nfs/dbraw/zinc/07/88/86/942078886.db2.gz NFZRHUHTIAXRDH-UNMCSNQZSA-N 2 0 421.029 4.096 20 0 HIADRP CCC[N@H+](C)[C@@H](CNC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1)c1ccc(Cl)cc1 ZINC000554251272 942079267 /nfs/dbraw/zinc/07/92/67/942079267.db2.gz NFZRHUHTIAXRDH-IRLDBZIGSA-N 2 0 421.029 4.096 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(NC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)c1 ZINC000554392362 942124324 /nfs/dbraw/zinc/12/43/24/942124324.db2.gz MUAWPPYFXQOQPV-XXBNENTESA-N 2 0 400.611 4.422 20 0 HIADRP CC[N@H+](CCNC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C)C(C)C ZINC000554915866 942318265 /nfs/dbraw/zinc/31/82/65/942318265.db2.gz BUKDSBDHGZMZMA-ZXJUBJKJSA-N 2 0 421.029 4.283 20 0 HIADRP Cc1cc(NC(=O)c2ccc(C[NH+]3CCCC3)cc2)ccc1OCC[NH+]1CCCC1 ZINC000555043326 942368381 /nfs/dbraw/zinc/36/83/81/942368381.db2.gz PFTTZVNFOPMGJI-UHFFFAOYSA-N 2 0 407.558 4.318 20 0 HIADRP FC(F)Oc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000555612337 942669739 /nfs/dbraw/zinc/66/97/39/942669739.db2.gz LFTWBPLFLOPHOF-OAQYLSRUSA-N 2 0 416.512 4.306 20 0 HIADRP Cc1cccc([C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C(=O)N(C)CC2CC[NH+](C)CC2)c1 ZINC000555870505 942761240 /nfs/dbraw/zinc/76/12/40/942761240.db2.gz AFXRYSMTWJGHRN-FTJBHMTQSA-N 2 0 419.613 4.011 20 0 HIADRP Cc1ccccc1[C@H](OC[C@H](O)C[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccccc1 ZINC000555889361 942767826 /nfs/dbraw/zinc/76/78/26/942767826.db2.gz RMOXWMKMSOWOIQ-ISKFKSNPSA-N 2 0 410.602 4.361 20 0 HIADRP C[N@H+](Cc1ccccc1C[NH2+]C1CCC(CS(C)(=O)=O)CC1)C1CCCCC1 ZINC000556059666 942799666 /nfs/dbraw/zinc/79/96/66/942799666.db2.gz VHSDLYQUVCMWJA-UHFFFAOYSA-N 2 0 406.636 4.144 20 0 HIADRP COc1ccc(C[C@@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000556233801 942824545 /nfs/dbraw/zinc/82/45/45/942824545.db2.gz SVNGKMDRCHVFGJ-QPPBQGQZSA-N 2 0 408.586 4.145 20 0 HIADRP COc1ncc([C@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cc1Cl ZINC000556584084 942906308 /nfs/dbraw/zinc/90/63/08/942906308.db2.gz PWJDJZYKGOMWKE-SFHVURJKSA-N 2 0 417.981 4.466 20 0 HIADRP c1ncn(-c2ccc(C[NH2+][C@H]3CCCC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)cc2)n1 ZINC000556869869 942944135 /nfs/dbraw/zinc/94/41/35/942944135.db2.gz ACAYGRYXCUVMLZ-CAOCKLPOSA-N 2 0 401.558 4.048 20 0 HIADRP CCc1cc(N2CCC([NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)CC2)ncn1 ZINC000556874051 942946516 /nfs/dbraw/zinc/94/65/16/942946516.db2.gz ZUGVGGKLOSPFHS-UHFFFAOYSA-N 2 0 407.606 4.041 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2nc(-c3ccccc3)c(C)s2)[C@H](C)C1 ZINC000557278199 943065393 /nfs/dbraw/zinc/06/53/93/943065393.db2.gz YWTYFFULVYUSHC-WIYYLYMNSA-N 2 0 401.620 4.388 20 0 HIADRP Cc1ccc(C[N@H+]2CC[C@H](CN(C)C(=O)[C@H]3CCC[NH+]3Cc3ccccc3)C2)s1 ZINC000557387371 943096776 /nfs/dbraw/zinc/09/67/76/943096776.db2.gz MYDJFJIIEPNGCY-FYYLOGMGSA-N 2 0 411.615 4.001 20 0 HIADRP Cc1ccc(C[N@H+]2CC[C@H](CN(C)C(=O)[C@@H]3CCC[NH+]3Cc3ccccc3)C2)s1 ZINC000557387380 943097128 /nfs/dbraw/zinc/09/71/28/943097128.db2.gz MYDJFJIIEPNGCY-GGAORHGYSA-N 2 0 411.615 4.001 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1cccc(-n2ccnn2)c1 ZINC000558242056 943455235 /nfs/dbraw/zinc/45/52/35/943455235.db2.gz YFHXCMISOATPMU-LJQANCHMSA-N 2 0 401.514 4.343 20 0 HIADRP CC[NH+](CC)Cc1ccc(C[NH2+]CCC(=O)Nc2cccc(Br)c2)cc1 ZINC000558339744 943516080 /nfs/dbraw/zinc/51/60/80/943516080.db2.gz BVCUKPOZXNPGKZ-UHFFFAOYSA-N 2 0 418.379 4.409 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000558970614 943776315 /nfs/dbraw/zinc/77/63/15/943776315.db2.gz KPXKZBRRSACILH-PCCBWWKXSA-N 2 0 407.396 4.184 20 0 HIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c2ccccc21 ZINC000558976889 943780712 /nfs/dbraw/zinc/78/07/12/943780712.db2.gz YIZXPLZYMXWHPJ-SDUSCBPUSA-N 2 0 406.570 4.322 20 0 HIADRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c2ccccc21 ZINC000558976888 943781355 /nfs/dbraw/zinc/78/13/55/943781355.db2.gz YIZXPLZYMXWHPJ-NQHRYMMQSA-N 2 0 406.570 4.322 20 0 HIADRP CCOC(=O)C1CCC([N@H+](CC)Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC1 ZINC000559080355 943829710 /nfs/dbraw/zinc/82/97/10/943829710.db2.gz DPPVEQLVBQXSAX-UHFFFAOYSA-N 2 0 415.622 4.161 20 0 HIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)ccn1 ZINC000559894941 944078918 /nfs/dbraw/zinc/07/89/18/944078918.db2.gz OMGFERBENCYTEF-OAQYLSRUSA-N 2 0 416.569 4.263 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cccc(OCc4ccccn4)c3)cc2)CC1 ZINC000560065889 944146548 /nfs/dbraw/zinc/14/65/48/944146548.db2.gz TYDJSYLNGKNZDJ-UHFFFAOYSA-N 2 0 417.553 4.423 20 0 HIADRP CCc1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000560268599 944213982 /nfs/dbraw/zinc/21/39/82/944213982.db2.gz ZDDSLIKBGILCPV-IBGZPJMESA-N 2 0 409.574 4.229 20 0 HIADRP CCC[C@H](NC(=O)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000560822718 944345873 /nfs/dbraw/zinc/34/58/73/944345873.db2.gz FWKPHBBIWACZGT-DEOSSOPVSA-N 2 0 408.590 4.278 20 0 HIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccc(Oc5cnccn5)cc4)C[C@@H]3C2)cc1 ZINC000562214335 945022838 /nfs/dbraw/zinc/02/28/38/945022838.db2.gz PLYQFTHSJHDNLS-GOTSBHOMSA-N 2 0 400.526 4.223 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000564367596 945533169 /nfs/dbraw/zinc/53/31/69/945533169.db2.gz DFQWLPOHXHACSR-LJQANCHMSA-N 2 0 408.571 4.313 20 0 HIADRP C[C@@H]([NH2+]Cc1cc(O)cc(C(F)(F)F)c1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000564407593 945559581 /nfs/dbraw/zinc/55/95/81/945559581.db2.gz IHKBYOGEAVBKQA-CQSZACIVSA-N 2 0 411.443 4.153 20 0 HIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](CC(Cc3ccccc3)Cc3ccccc3)C2)CC1 ZINC000564526940 945653666 /nfs/dbraw/zinc/65/36/66/945653666.db2.gz AOWJEOCLFAJWIK-MHZLTWQESA-N 2 0 405.630 4.188 20 0 HIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000569395725 946866186 /nfs/dbraw/zinc/86/61/86/946866186.db2.gz HPIAETFUKUJFSD-CAVPUYEOSA-N 2 0 416.512 4.438 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+]2C[C@H](c3ccc(F)cc3)C[C@H]2C)CC1 ZINC000570949333 947395521 /nfs/dbraw/zinc/39/55/21/947395521.db2.gz DSJMHDYSTDZAEL-NFBKMPQASA-N 2 0 423.576 4.093 20 0 HIADRP CSc1ccc(C[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)s1 ZINC000571093026 947491302 /nfs/dbraw/zinc/49/13/02/947491302.db2.gz XNQYUDCUEIPTIN-UHFFFAOYSA-N 2 0 406.617 4.249 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000572887570 948029985 /nfs/dbraw/zinc/02/99/85/948029985.db2.gz URICPOGGTJPGTC-UHFFFAOYSA-N 2 0 415.553 4.146 20 0 HIADRP CCOC(=O)C(C)(C)C1CC[NH+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC1 ZINC000573366510 948169011 /nfs/dbraw/zinc/16/90/11/948169011.db2.gz QWWOOCBFBJNIAO-UHFFFAOYSA-N 2 0 415.622 4.018 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000573942888 948329383 /nfs/dbraw/zinc/32/93/83/948329383.db2.gz HBSPTLKDDHDONB-UNMCSNQZSA-N 2 0 420.475 4.393 20 0 HIADRP C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)[C@H](n2cncn2)C1 ZINC000574343810 948417147 /nfs/dbraw/zinc/41/71/47/948417147.db2.gz UKFAELLIFSISQD-ZPMCFJSWSA-N 2 0 401.986 4.163 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]Cc1ccc(-n3ccnc3)c(F)c1)c1ccccc1O2 ZINC000574699913 948506173 /nfs/dbraw/zinc/50/61/73/948506173.db2.gz MTTRKGNXHLWWCT-OAQYLSRUSA-N 2 0 406.505 4.089 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c2ccccc2C1 ZINC000575031745 948578701 /nfs/dbraw/zinc/57/87/01/948578701.db2.gz WICHTXXKIJNVDY-OZXSUGGESA-N 2 0 405.586 4.372 20 0 HIADRP CSC1(C[NH2+]Cc2cn(Cc3ccccc3)nc2C(C)(C)C)CC[NH+](C)CC1 ZINC000575066953 948583930 /nfs/dbraw/zinc/58/39/30/948583930.db2.gz NHPYAYWVKFRPBZ-UHFFFAOYSA-N 2 0 400.636 4.146 20 0 HIADRP c1csc(-c2noc(CCC[N@@H+]3C[C@@H]4CC[NH+](Cc5ccccc5)C[C@H]4C3)n2)c1 ZINC000575840378 948733506 /nfs/dbraw/zinc/73/35/06/948733506.db2.gz QRRNJNNXSAUQEJ-VQTJNVASSA-N 2 0 408.571 4.185 20 0 HIADRP CC[NH+]1CCN(c2ccc(NC(=O)c3ccc(C[NH+]4CCCCC4)cc3)cc2)CC1 ZINC000011951156 845843051 /nfs/dbraw/zinc/84/30/51/845843051.db2.gz NZDPBZHYPDPODH-UHFFFAOYSA-N 2 0 406.574 4.067 20 0 HIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)cc1 ZINC000017319418 846245196 /nfs/dbraw/zinc/24/51/96/846245196.db2.gz YLPXOCFJQQADBC-UHFFFAOYSA-N 2 0 411.553 4.345 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NC[C@@H](c3cccs3)[NH+](C)C)cc2)CC1 ZINC000026381454 847137678 /nfs/dbraw/zinc/13/76/78/847137678.db2.gz QHUYFVVASVJJKD-NRFANRHFSA-N 2 0 414.619 4.082 20 0 HIADRP C[NH+]1CCN(C(C)(C)C[NH2+]Cc2ccc(-c3cccc(Br)c3)s2)CC1 ZINC000030664120 847755420 /nfs/dbraw/zinc/75/54/20/847755420.db2.gz OXXFKNDUEKRGKJ-UHFFFAOYSA-N 2 0 422.436 4.293 20 0 HIADRP COc1ccccc1[C@H](CNC(=O)Nc1cccc(C[NH+](C)C)c1)[NH+]1CCCCC1 ZINC000048076536 849160709 /nfs/dbraw/zinc/16/07/09/849160709.db2.gz OEZABWGZTIOCLB-QFIPXVFZSA-N 2 0 410.562 4.106 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c1 ZINC000048717327 849259267 /nfs/dbraw/zinc/25/92/67/849259267.db2.gz MKOBQFWQDRPFKA-UHFFFAOYSA-N 2 0 418.463 4.121 20 0 HIADRP CCc1cc2c(C[NH2+]Cc3ccccc3C[NH+]3CCCCC3)cc(=O)oc2cc1O ZINC000052816759 849630628 /nfs/dbraw/zinc/63/06/28/849630628.db2.gz MFJGPXFNIUAURN-UHFFFAOYSA-N 2 0 406.526 4.337 20 0 HIADRP Cc1c(O)ccc2c(C[NH2+]Cc3ccccc3C[NH+]3CCC(C)CC3)cc(=O)oc12 ZINC000056155001 850259726 /nfs/dbraw/zinc/25/97/26/850259726.db2.gz XHXOEZFQSFQQLC-UHFFFAOYSA-N 2 0 406.526 4.329 20 0 HIADRP Cc1ccccc1[C@H](OC[C@H](O)C[NH+]1CCC(CC[NH+](C)C)CC1)c1ccccc1 ZINC000056523042 850382747 /nfs/dbraw/zinc/38/27/47/850382747.db2.gz SHGOAKYYKJGNOU-AOYPEHQESA-N 2 0 410.602 4.126 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)CC1 ZINC000056845854 850499896 /nfs/dbraw/zinc/49/98/96/850499896.db2.gz FFBWUFTWYCAPEI-UHFFFAOYSA-N 2 0 414.638 4.180 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)N2CCC([NH+]3CCCCC3)CC2)c2ccccc2)CC1 ZINC000057854551 850733420 /nfs/dbraw/zinc/73/34/20/850733420.db2.gz MPODUJISNQLCGV-DEOSSOPVSA-N 2 0 412.622 4.120 20 0 HIADRP CC1CC[NH+](C[C@@H]2CCCN(C(=O)[C@@H]3CCC[N@H+](Cc4cccc(F)c4)C3)C2)CC1 ZINC000060275550 851058444 /nfs/dbraw/zinc/05/84/44/851058444.db2.gz BHFYXAGSZJLJPB-XZOQPEGZSA-N 2 0 415.597 4.008 20 0 HIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]CCCC[NH+]1CCOCC1 ZINC000060526569 851133853 /nfs/dbraw/zinc/13/38/53/851133853.db2.gz HFMVIFJNZRSYGW-UHFFFAOYSA-N 2 0 404.558 4.050 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)C1 ZINC000060566656 851149403 /nfs/dbraw/zinc/14/94/03/851149403.db2.gz GDHRBKVGMYLRAE-JOCHJYFZSA-N 2 0 414.638 4.374 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NCc2ccccc2C[NH+]2CCCCC2)c1 ZINC000061856096 851461460 /nfs/dbraw/zinc/46/14/60/851461460.db2.gz QMZBUBSPFXEJBB-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP COc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)cc1 ZINC000062427110 851550416 /nfs/dbraw/zinc/55/04/16/851550416.db2.gz RSKHZMDLFXTEOC-FQEVSTJZSA-N 2 0 404.558 4.368 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=S)NC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000063145507 851621661 /nfs/dbraw/zinc/62/16/61/851621661.db2.gz SFFABZOUEZOLKK-UHFFFAOYSA-N 2 0 424.658 4.157 20 0 HIADRP COc1ccc([C@H](CNC(=O)c2cccc(C[NH+]3CCCC3)c2)[NH+]2CCCCC2)cc1 ZINC000108712745 852874553 /nfs/dbraw/zinc/87/45/53/852874553.db2.gz CFFKNWCJJBQKBX-VWLOTQADSA-N 2 0 421.585 4.248 20 0 HIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CCC(=O)Nc3ccccc3Br)C2)CC1 ZINC000112648249 853236591 /nfs/dbraw/zinc/23/65/91/853236591.db2.gz KBSGXEMSTQAWCQ-SFHVURJKSA-N 2 0 422.411 4.222 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCSCC2)cc1)c1cccc(C[NH+]2CCCC2)c1 ZINC000146051644 853561806 /nfs/dbraw/zinc/56/18/06/853561806.db2.gz UGTKXHBHRRNQDO-UHFFFAOYSA-N 2 0 409.599 4.126 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]C[C@@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000236813767 853925868 /nfs/dbraw/zinc/92/58/68/853925868.db2.gz KYCYWTLEHUTGJH-AZGAKELHSA-N 2 0 407.602 4.476 20 0 HIADRP CCCOc1c(Br)cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1OC ZINC000236893244 853933130 /nfs/dbraw/zinc/93/31/30/853933130.db2.gz UVSPGAOHZQNTIC-ALOPSCKCSA-N 2 0 411.384 4.351 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2sc(Sc3ccccc3)nc2Cl)CC1 ZINC000236978582 853946273 /nfs/dbraw/zinc/94/62/73/853946273.db2.gz LTYDCAFBFHUTMM-OAHLLOKOSA-N 2 0 411.040 4.063 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(OCC(F)F)cc2)CC1 ZINC000236985254 853947483 /nfs/dbraw/zinc/94/74/83/853947483.db2.gz SZYXTCLDJSWHFG-KRWDZBQOSA-N 2 0 421.507 4.462 20 0 HIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccncc2)ccc1F ZINC000237077622 853961150 /nfs/dbraw/zinc/96/11/50/853961150.db2.gz KIIISABTKLQZDU-UHFFFAOYSA-N 2 0 415.516 4.425 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2cccc3[nH]ccc32)CC1 ZINC000237099862 853963985 /nfs/dbraw/zinc/96/39/85/853963985.db2.gz IKEFACKORMRGSB-UHFFFAOYSA-N 2 0 402.464 4.228 20 0 HIADRP COC(=O)c1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)c[nH]1 ZINC000237126251 853968950 /nfs/dbraw/zinc/96/89/50/853968950.db2.gz HAAKIMMCJVMCGX-UHFFFAOYSA-N 2 0 403.526 4.354 20 0 HIADRP C[NH+]1CCC(CC[NH2+]Cc2cc(Br)ccc2OCc2ccccn2)CC1 ZINC000237157414 853974134 /nfs/dbraw/zinc/97/41/34/853974134.db2.gz DYOVSKVNZUKLAA-UHFFFAOYSA-N 2 0 418.379 4.245 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)cc1 ZINC000237177444 853976897 /nfs/dbraw/zinc/97/68/97/853976897.db2.gz YLPYSZUPQHPUBN-UHFFFAOYSA-N 2 0 411.546 4.135 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2cccc(C(F)(F)F)c2)c1)C1CCOCC1 ZINC000237203507 853981177 /nfs/dbraw/zinc/98/11/77/853981177.db2.gz VUMLCXQFPNLHMM-UHFFFAOYSA-N 2 0 422.491 4.485 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Br)cc2F)C[C@@H](C)O1 ZINC000237411684 854026446 /nfs/dbraw/zinc/02/64/46/854026446.db2.gz LQKIMEXRZKFYGC-HZPDHXFCSA-N 2 0 421.354 4.487 20 0 HIADRP O[C@@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cccc(C(F)(F)F)c1 ZINC000238062166 854139586 /nfs/dbraw/zinc/13/95/86/854139586.db2.gz OPVWLBMJISQMPY-NRFANRHFSA-N 2 0 408.464 4.003 20 0 HIADRP CC(C)[NH+]1CCC(Nc2nc3ccccc3c(NC3CC[NH+](C(C)C)CC3)n2)CC1 ZINC000301140013 854308702 /nfs/dbraw/zinc/30/87/02/854308702.db2.gz ACVHWDXXJRUPJU-UHFFFAOYSA-N 2 0 410.610 4.199 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000302938755 854687362 /nfs/dbraw/zinc/68/73/62/854687362.db2.gz ADKKHDKUKBTIRB-DEOSSOPVSA-N 2 0 423.576 4.340 20 0 HIADRP O=C(N[C@@H](C[NH+]1CCCC1)c1ccccc1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000303140303 854781322 /nfs/dbraw/zinc/78/13/22/854781322.db2.gz BAPJFUNACKKSQG-VWNXMTODSA-N 2 0 412.622 4.121 20 0 HIADRP C[C@@H](C(=O)NCc1ccccc1Cl)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000303210370 854818801 /nfs/dbraw/zinc/81/88/01/854818801.db2.gz RCQPHEDRKYSCRT-IBGZPJMESA-N 2 0 413.993 4.189 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000303241096 854831814 /nfs/dbraw/zinc/83/18/14/854831814.db2.gz JSKJNGNUUHCDFT-DEOSSOPVSA-N 2 0 412.622 4.223 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)c2cccs2)CC1 ZINC000303276779 854847867 /nfs/dbraw/zinc/84/78/67/854847867.db2.gz IYMZMMWHZFNCIU-NHCUHLMSSA-N 2 0 418.651 4.181 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NC[C@@H](c1cccc(OC)c1)[NH+]1CCCC1)c1ccccc1 ZINC000303306582 854863031 /nfs/dbraw/zinc/86/30/31/854863031.db2.gz ZVNQNCDUNPJWOL-ZEQRLZLVSA-N 2 0 409.574 4.031 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCC(=O)Nc2ccccc2Br)C1 ZINC000303582787 855056873 /nfs/dbraw/zinc/05/68/73/855056873.db2.gz KSKJMKVHHKIYFX-ROUUACIJSA-N 2 0 422.411 4.364 20 0 HIADRP CC(C)(C)OC(=O)N1CCC[C@@H]([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000309689651 855362895 /nfs/dbraw/zinc/36/28/95/855362895.db2.gz CNGZEEIKEJVHPZ-FGZHOGPDSA-N 2 0 401.595 4.278 20 0 HIADRP C[C@H]([NH2+]C1CCC(NC(=O)OC(C)(C)C)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309722477 855363968 /nfs/dbraw/zinc/36/39/68/855363968.db2.gz OGLDSAHXOGJMBA-UBHSMVFVSA-N 2 0 401.595 4.323 20 0 HIADRP C[C@H]([NH2+]C1CCN(C(=O)OCc2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309697259 855364493 /nfs/dbraw/zinc/36/44/93/855364493.db2.gz DVWPBCXHRXBBIX-XUZZJYLKSA-N 2 0 421.585 4.288 20 0 HIADRP C[C@H]([NH2+][C@H]1CCCN(C(=O)OC(C)(C)C)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309807026 855365229 /nfs/dbraw/zinc/36/52/29/855365229.db2.gz UUZSGTMVZYRLTI-BVSLBCMMSA-N 2 0 401.595 4.276 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H](C)c1cc2cc(Br)ccc2o1)N1CC[NH+](C)CC1 ZINC000326501730 855410510 /nfs/dbraw/zinc/41/05/10/855410510.db2.gz PPRNVCWZSAANMO-CRAIPNDOSA-N 2 0 408.384 4.118 20 0 HIADRP CC(C)(C)OC(=O)NC1CCC([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000390775679 855456381 /nfs/dbraw/zinc/45/63/81/855456381.db2.gz MUKHHNMUNSTBIY-ITAUSPCMSA-N 2 0 401.595 4.324 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CN(Cc2ccccc2)CCCO1)c1cc(Br)cs1 ZINC000390846814 855456970 /nfs/dbraw/zinc/45/69/70/855456970.db2.gz FRLRWUIAYKWQHE-YJBOKZPZSA-N 2 0 409.393 4.452 20 0 HIADRP CC(C)(C)OC(=O)N[C@@H]1C[C@@H]([NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)C1(C)C ZINC000404887190 855481709 /nfs/dbraw/zinc/48/17/09/855481709.db2.gz GAFZOHLXMTVYHB-YOSAUDMPSA-N 2 0 401.595 4.180 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NCCC[NH2+]C3CCCCC3)cc2)CC1 ZINC000410335916 855935207 /nfs/dbraw/zinc/93/52/07/855935207.db2.gz YIFFJPVZNAPDLI-UHFFFAOYSA-N 2 0 400.611 4.030 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NCc2ccc(C[NH+]3CCCC[C@H]3C)cc2)C1 ZINC000410337761 855936129 /nfs/dbraw/zinc/93/61/29/855936129.db2.gz PSCNBOBLAYSWRI-FGZHOGPDSA-N 2 0 414.638 4.372 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)cc1 ZINC000410342750 855939417 /nfs/dbraw/zinc/93/94/17/855939417.db2.gz BBTUKEYTSUUZGI-NFBKMPQASA-N 2 0 424.589 4.290 20 0 HIADRP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NCCC[N@H+]1CCCC[C@H]1C ZINC000410364469 855952464 /nfs/dbraw/zinc/95/24/64/855952464.db2.gz ILFDLRRDUVLGKP-NHCUHLMSSA-N 2 0 400.611 4.125 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)C1 ZINC000410369054 855956197 /nfs/dbraw/zinc/95/61/97/855956197.db2.gz QXNQEGFIZCHAQQ-PGRDOPGGSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NCCC[NH2+]C2CCCCC2)C1 ZINC000410374985 855959789 /nfs/dbraw/zinc/95/97/89/855959789.db2.gz OGXIVUYDSIGBPN-HXUWFJFHSA-N 2 0 400.611 4.030 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000426049740 856072788 /nfs/dbraw/zinc/07/27/88/856072788.db2.gz JXVLDVJWQFRXPT-DQEYMECFSA-N 2 0 421.972 4.375 20 0 HIADRP C[N@H+](Cc1cc(F)cc(Br)c1)C1CCN(CCc2ccccn2)CC1 ZINC000427025860 856601193 /nfs/dbraw/zinc/60/11/93/856601193.db2.gz GBUCWNFQPXKNGI-UHFFFAOYSA-N 2 0 406.343 4.122 20 0 HIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)CCS2 ZINC000427723736 856923626 /nfs/dbraw/zinc/92/36/26/856923626.db2.gz ZIWJNSFOFQVSIM-FQEVSTJZSA-N 2 0 403.636 4.057 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCc2ncc(C(F)(F)F)cc21 ZINC000427847282 856979938 /nfs/dbraw/zinc/97/99/38/856979938.db2.gz JVJAQBKNVNBYFJ-TZIWHRDSSA-N 2 0 419.491 4.224 20 0 HIADRP O=C(c1ccco1)N1CCC([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000428239076 857122835 /nfs/dbraw/zinc/12/28/35/857122835.db2.gz MWFSIDBIZPZRHZ-YFNKSVMNSA-N 2 0 421.585 4.165 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@@H]([NH2+]C4CCN(c5ccccn5)CC4)[C@@H]3C2)cc1 ZINC000428243435 857123935 /nfs/dbraw/zinc/12/39/35/857123935.db2.gz BTXPUQPNLDRGHG-ICDZXHCJSA-N 2 0 404.602 4.331 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)cc1 ZINC000429428275 857660983 /nfs/dbraw/zinc/66/09/83/857660983.db2.gz IRMIMQIMOQGZLE-RUZDIDTESA-N 2 0 419.544 4.191 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@H]2CN(Cc3ccccc3)CCCO2)CC1 ZINC000429694483 857838420 /nfs/dbraw/zinc/83/84/20/857838420.db2.gz BSXIRAPMFCRLSB-MHZLTWQESA-N 2 0 421.629 4.122 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)cc1)C1CC1 ZINC000430622281 858239299 /nfs/dbraw/zinc/23/92/99/858239299.db2.gz FGMUXCFPKOIOOX-YKSBVNFPSA-N 2 0 405.586 4.454 20 0 HIADRP Cc1oc(-c2ccccc2)nc1C[N@@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430910765 858366701 /nfs/dbraw/zinc/36/67/01/858366701.db2.gz XPQUAJPTOQCRGI-UHFFFAOYSA-N 2 0 410.606 4.278 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3coc(-c4cccc(F)c4)n3)CC2)CC1 ZINC000430914300 858368135 /nfs/dbraw/zinc/36/81/35/858368135.db2.gz IZMLDHJZJPAPRM-UHFFFAOYSA-N 3 0 414.569 4.109 20 0 HIADRP COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000433126773 859531208 /nfs/dbraw/zinc/53/12/08/859531208.db2.gz PPKGZMMINJAVPO-FQEVSTJZSA-N 2 0 407.558 4.010 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000434898593 860543732 /nfs/dbraw/zinc/54/37/32/860543732.db2.gz VZAWTQQWPHAQKG-DNRQZRRGSA-N 2 0 405.586 4.034 20 0 HIADRP Cc1cc(C[NH2+]Cc2c(Cl)cccc2N2CC[NH+](C)CC2)ccc1Br ZINC000467778324 881599177 /nfs/dbraw/zinc/59/91/77/881599177.db2.gz PNSTYAOGZYOHIL-UHFFFAOYSA-N 2 0 422.798 4.453 20 0 HIADRP CN(c1ccccc1)c1ccc(C[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cn1 ZINC000435789284 861061698 /nfs/dbraw/zinc/06/16/98/861061698.db2.gz WRVSXTCZWQPNKQ-UHFFFAOYSA-N 2 0 416.569 4.096 20 0 HIADRP CN(C(=O)NC[C@H]1CCC[N@@H+]1C1CCCCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000438324715 863803280 /nfs/dbraw/zinc/80/32/80/863803280.db2.gz FQZASAVYJURLEF-XMMPIXPASA-N 2 0 412.622 4.090 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H](c2ccccc2)N2CCOCC2)CC1 ZINC000438834898 864329030 /nfs/dbraw/zinc/32/90/30/864329030.db2.gz LCLHIIXBUFCSFH-WNMGUVTHSA-N 2 0 407.602 4.093 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000439138121 864570798 /nfs/dbraw/zinc/57/07/98/864570798.db2.gz JSVBRGPUIMJVCI-FCEWJHQRSA-N 2 0 413.425 4.319 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N(CC[NH+](C)C)Cc2cccs2)CC1 ZINC000439294609 864719289 /nfs/dbraw/zinc/71/92/89/864719289.db2.gz LSMXXZWETJINPL-LJQANCHMSA-N 2 0 414.619 4.047 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C(=O)N1CCSc2ccccc21 ZINC000439547515 864875094 /nfs/dbraw/zinc/87/50/94/864875094.db2.gz KAMCHQMLMMBXHL-IBGZPJMESA-N 2 0 409.599 4.290 20 0 HIADRP CC(=O)c1cccc(NC(=O)[C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c1 ZINC000439597795 864920013 /nfs/dbraw/zinc/92/00/13/864920013.db2.gz PGNXWZKVXMMSGP-GOSISDBHSA-N 2 0 419.525 4.231 20 0 HIADRP CC[C@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000439788413 865110416 /nfs/dbraw/zinc/11/04/16/865110416.db2.gz MVKLEKVISBYMBC-SANMLTNESA-N 2 0 409.618 4.380 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCC([NH+]2CCCC2)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000468031374 881863597 /nfs/dbraw/zinc/86/35/97/881863597.db2.gz VRQPCGSAKGPIFN-IFMALSPDSA-N 2 0 400.611 4.022 20 0 HIADRP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)CC1 ZINC000440183460 865408239 /nfs/dbraw/zinc/40/82/39/865408239.db2.gz GGKGDYOSYSAUNC-VQTJNVASSA-N 2 0 423.605 4.036 20 0 HIADRP Cc1ccc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1NC(=O)CC[NH+](C)C ZINC000468038998 881868166 /nfs/dbraw/zinc/86/81/66/881868166.db2.gz NIXAREMRIIVUIW-NFBKMPQASA-N 2 0 408.590 4.350 20 0 HIADRP Cc1cc(Cl)c(NC(=O)NCCC[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1Cl ZINC000443946149 868482455 /nfs/dbraw/zinc/48/24/55/868482455.db2.gz QRPSYWUANSJQKH-UHFFFAOYSA-N 2 0 422.360 4.031 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CC3CCC(C(F)(F)F)CC3)CC2)CC1 ZINC000468412768 882355551 /nfs/dbraw/zinc/35/55/51/882355551.db2.gz QBBBNIYFAFSGDH-UHFFFAOYSA-N 2 0 403.577 4.483 20 0 HIADRP C[C@H]([NH2+][C@H]1CCC[C@H]1c1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000446005474 869970226 /nfs/dbraw/zinc/97/02/26/869970226.db2.gz YGMZXKIFAVPKHL-OPXMRZJTSA-N 2 0 405.586 4.082 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]1c1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000446005473 869970241 /nfs/dbraw/zinc/97/02/41/869970241.db2.gz YGMZXKIFAVPKHL-KSNOWIBYSA-N 2 0 405.586 4.082 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)N3CC[C@H](C[NH+]4CCCCC4)C3)c2)CC1 ZINC000446274135 870209401 /nfs/dbraw/zinc/20/94/01/870209401.db2.gz AYNRLVXIEJUNGY-HSZRJFAPSA-N 2 0 412.622 4.301 20 0 HIADRP C[C@H]1C[C@@H](CCNC(=O)Nc2ccccc2CC[NH+](C)C)C[N@@H+]1Cc1ccccc1 ZINC000446576668 870488128 /nfs/dbraw/zinc/48/81/28/870488128.db2.gz HNGGQRXWDUQICR-RBBKRZOGSA-N 2 0 408.590 4.213 20 0 HIADRP CCC[C@@H]1CN(C(=O)Nc2ccccc2CC[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000446579283 870489582 /nfs/dbraw/zinc/48/95/82/870489582.db2.gz BMTQQVXPHGOYNF-HSZRJFAPSA-N 2 0 408.590 4.309 20 0 HIADRP Cc1nccnc1[C@H](C)[NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000446743538 870652170 /nfs/dbraw/zinc/65/21/70/870652170.db2.gz KSKOJKIPSWWECD-KRWDZBQOSA-N 2 0 421.511 4.057 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cc2ccccc2s1 ZINC000446819624 870734406 /nfs/dbraw/zinc/73/44/06/870734406.db2.gz YTQPARBWXVCPBP-UWJYYQICSA-N 2 0 407.583 4.449 20 0 HIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(Br)cc1F ZINC000446843690 870763270 /nfs/dbraw/zinc/76/32/70/870763270.db2.gz OUOFZUDSOYWTSC-MRXNPFEDSA-N 2 0 412.391 4.189 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)CCCS2 ZINC000446915283 870831198 /nfs/dbraw/zinc/83/11/98/870831198.db2.gz UMHGHWBIIAXMGG-OFNKIYASSA-N 2 0 412.599 4.369 20 0 HIADRP OC[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1c(F)cccc1Cl ZINC000447545297 871410817 /nfs/dbraw/zinc/41/08/17/871410817.db2.gz QUQQFQSFPGSVBT-NCYKPQTJSA-N 2 0 416.968 4.415 20 0 HIADRP OC[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1cc(F)c(F)c(F)c1 ZINC000447608104 871517404 /nfs/dbraw/zinc/51/74/04/871517404.db2.gz UKUIIKQNDBZTKL-MXEMCNAFSA-N 2 0 418.503 4.040 20 0 HIADRP C[NH+](C)[C@H]1CCOc2c(NC(=O)[C@H]3CCC[N@H+](Cc4cccc(F)c4)C3)cccc21 ZINC000447728727 871676338 /nfs/dbraw/zinc/67/63/38/871676338.db2.gz MIQZPMXJHDOIEG-AVRDEDQJSA-N 2 0 411.521 4.062 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)N3CC[C@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc2)CC1 ZINC000448203792 872094759 /nfs/dbraw/zinc/09/47/59/872094759.db2.gz YVSGBPLQHBQHMA-NOZRDPDXSA-N 2 0 424.633 4.077 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)[C@@H](C)C1 ZINC000448461397 872417577 /nfs/dbraw/zinc/41/75/77/872417577.db2.gz KWLLCWVEPQZJEV-RDPSFJRHSA-N 2 0 414.638 4.323 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](CNC(=O)N(C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000448474355 872455727 /nfs/dbraw/zinc/45/57/27/872455727.db2.gz VVVBKTISIVXQKB-QPTUXGOLSA-N 2 0 414.638 4.049 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](CC(C)C)[NH2+][C@@H](C)c2ccccc2)[C@H](C)C1 ZINC000448519705 872505040 /nfs/dbraw/zinc/50/50/40/872505040.db2.gz FMJJLBBVIVCNHX-VAPSRWTKSA-N 2 0 402.627 4.124 20 0 HIADRP C[N@@H+](Cc1nnc(-c2cc3c(s2)CCCC3)o1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000461372139 874376032 /nfs/dbraw/zinc/37/60/32/874376032.db2.gz NCXQJCBEODVNPR-UHFFFAOYSA-N 2 0 423.586 4.420 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCCC2)cc1)N1C[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000461432444 874475774 /nfs/dbraw/zinc/47/57/74/874475774.db2.gz UPKLJKXGOHNTHQ-IZZNHLLZSA-N 2 0 417.597 4.267 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2C[C@@H]3CC[NH+](Cc4ccccc4)C[C@H]3C2)cc1)C1CC1 ZINC000461444504 874500343 /nfs/dbraw/zinc/50/03/43/874500343.db2.gz LJQVZUJUNIMDDS-DQEYMECFSA-N 2 0 417.597 4.265 20 0 HIADRP O=C(NC[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000461465856 874522638 /nfs/dbraw/zinc/52/26/38/874522638.db2.gz GIQSIQWTZSHKIT-VWLOTQADSA-N 2 0 419.613 4.317 20 0 HIADRP Cc1c([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cnn1C(C)(C)C ZINC000468835239 882882197 /nfs/dbraw/zinc/88/21/97/882882197.db2.gz FVZXNUXIINEJGY-IRXDYDNUSA-N 2 0 401.574 4.249 20 0 HIADRP C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000461999107 875120036 /nfs/dbraw/zinc/12/00/36/875120036.db2.gz BMSBLBCBWWZFEC-IAGOWNOFSA-N 2 0 411.512 4.001 20 0 HIADRP COc1ccc(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)cc1Cl ZINC000462683320 875776955 /nfs/dbraw/zinc/77/69/55/875776955.db2.gz ZCKFNSHFPYLQKJ-UHFFFAOYSA-N 2 0 401.982 4.036 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2cc(C)c(C)cc2OC(F)F)CC1 ZINC000462688642 875779420 /nfs/dbraw/zinc/77/94/20/875779420.db2.gz TZVCMNIXBRRBHH-UHFFFAOYSA-N 2 0 417.544 4.332 20 0 HIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(-n3cnc4ccccc43)cc2)(N2CCCCC2)CC1 ZINC000462733070 875807244 /nfs/dbraw/zinc/80/72/44/875807244.db2.gz BLHWBDWSYXQNQU-UHFFFAOYSA-N 2 0 417.601 4.065 20 0 HIADRP COc1ccc(C[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1OCCC(C)C ZINC000462735286 875808753 /nfs/dbraw/zinc/80/87/53/875808753.db2.gz PKRIDHSKGIMYAE-UHFFFAOYSA-N 2 0 417.638 4.160 20 0 HIADRP C[NH+]1CCC(C[NH2+]Cc2ccccc2OCc2ccccc2)(N2CCCCC2)CC1 ZINC000462740422 875811592 /nfs/dbraw/zinc/81/15/92/875811592.db2.gz ZZZYPFLHHCRERC-UHFFFAOYSA-N 2 0 407.602 4.306 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccc(C4CCCC4)cc3)c2)C1 ZINC000462787618 875839826 /nfs/dbraw/zinc/83/98/26/875839826.db2.gz COXOWCSZLSNGPU-VWLOTQADSA-N 2 0 405.586 4.331 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+]CC2(S(C)(=O)=O)CCCC2)c2ccc(F)cc2)CC1 ZINC000462817920 875858912 /nfs/dbraw/zinc/85/89/12/875858912.db2.gz ORCDQLZINUVXOY-QFIPXVFZSA-N 2 0 424.626 4.326 20 0 HIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000462895297 875920916 /nfs/dbraw/zinc/92/09/16/875920916.db2.gz LHOQJCPOWOZCKC-LJQANCHMSA-N 2 0 405.590 4.161 20 0 HIADRP COc1ccc(C2(C[NH2+]C3CC[NH+](CCc4ccccc4)CC3)CCOCC2)cc1 ZINC000463082450 876114438 /nfs/dbraw/zinc/11/44/38/876114438.db2.gz NUGHUZFGOFJVGW-UHFFFAOYSA-N 2 0 408.586 4.040 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]C3CCN(CCc4ccccc4)CC3)CC2)cc1 ZINC000463117192 876158610 /nfs/dbraw/zinc/15/86/10/876158610.db2.gz RRVUDGRRPGIFJK-UHFFFAOYSA-N 2 0 421.629 4.204 20 0 HIADRP C[C@H]([NH2+]C1(CNC2CC[NH+](CCc3ccccc3)CC2)CCOCC1)c1ccccc1 ZINC000463119433 876161864 /nfs/dbraw/zinc/16/18/64/876161864.db2.gz ISORJWKZCSCGQF-QHCPKHFHSA-N 2 0 421.629 4.183 20 0 HIADRP C[C@@H](CCCOc1ccccc1C(N)=O)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000468936574 883000279 /nfs/dbraw/zinc/00/02/79/883000279.db2.gz IPEGUUUVLVLPFQ-ZSJMHYJMSA-N 2 0 421.585 4.118 20 0 HIADRP Fc1ccc(CC[NH+]2CCC(NC[C@@H](c3cccs3)[NH+]3CCCC3)CC2)cc1 ZINC000463146812 876200020 /nfs/dbraw/zinc/20/00/20/876200020.db2.gz UHWKHGGLCJYTNF-QFIPXVFZSA-N 2 0 401.595 4.321 20 0 HIADRP O=C(CCc1ccccc1)N1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000463242081 876297713 /nfs/dbraw/zinc/29/77/13/876297713.db2.gz JYKXNIRXTXWNSX-TZZBBBQFSA-N 2 0 417.597 4.005 20 0 HIADRP O=C(c1ccccc1Cl)N1CCC([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000463242350 876298147 /nfs/dbraw/zinc/29/81/47/876298147.db2.gz HHOJLIUBPWRXQA-HXUWFJFHSA-N 2 0 411.977 4.056 20 0 HIADRP Cc1ccc(C[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c(-n2cc(Cl)cn2)n1 ZINC000468994026 883060946 /nfs/dbraw/zinc/06/09/46/883060946.db2.gz QQHCJPLRCFBBSH-ACIOBRDBSA-N 2 0 421.976 4.229 20 0 HIADRP Cc1ccc(C[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c(-n2cc(Cl)cn2)n1 ZINC000468994479 883060278 /nfs/dbraw/zinc/06/02/78/883060278.db2.gz QQHCJPLRCFBBSH-MDNUFGMLSA-N 2 0 421.976 4.229 20 0 HIADRP C[C@@H]1CC[N@H+](CCOc2ccc(NC(=O)C3CC[NH+](Cc4ccccc4)CC3)cc2)C1 ZINC000465183434 878574428 /nfs/dbraw/zinc/57/44/28/878574428.db2.gz JUSGKZUXDRISTA-OAQYLSRUSA-N 2 0 421.585 4.258 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)c2cccs2)CC1 ZINC000465435748 878867945 /nfs/dbraw/zinc/86/79/45/878867945.db2.gz SXNIHNKBYUHILH-VQTJNVASSA-N 2 0 406.640 4.037 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)C1 ZINC000465517378 878964576 /nfs/dbraw/zinc/96/45/76/878964576.db2.gz CTSDLPFTEIROJW-LGVFNWMJSA-N 2 0 414.638 4.038 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@H](C)C3)cc2)C1 ZINC000465517379 878964969 /nfs/dbraw/zinc/96/49/69/878964969.db2.gz CTSDLPFTEIROJW-ZFGGDYGUSA-N 2 0 414.638 4.038 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(CNC(=O)N(C)CC[C@H]3CCCC[NH+]3C)cc2)C1 ZINC000465518998 878968995 /nfs/dbraw/zinc/96/89/95/878968995.db2.gz FORTZINZSBOOBD-ZFGGDYGUSA-N 2 0 414.638 4.180 20 0 HIADRP CC[NH+]1CCC(CCNC(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)CC1 ZINC000465534998 878993480 /nfs/dbraw/zinc/99/34/80/878993480.db2.gz VLYJICZCOMRQJV-NHCUHLMSSA-N 2 0 414.638 4.086 20 0 HIADRP CC[NH+](CC)[C@H]1CCN(C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000465580236 879059312 /nfs/dbraw/zinc/05/93/12/879059312.db2.gz YPQYZVOHVUYIBX-QHCPKHFHSA-N 2 0 408.590 4.041 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCC1([NH+](C)C)CCCCCC1 ZINC000465643501 879161089 /nfs/dbraw/zinc/16/10/89/879161089.db2.gz XLLLHZPWWIDXDE-HSZRJFAPSA-N 2 0 414.638 4.195 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)C1 ZINC000465715104 879286657 /nfs/dbraw/zinc/28/66/57/879286657.db2.gz DZIWYOLJXXTLQA-NRFANRHFSA-N 2 0 414.638 4.324 20 0 HIADRP C[C@H]1C[C@@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000465723890 879300513 /nfs/dbraw/zinc/30/05/13/879300513.db2.gz RVGLZPGQPMHLOV-CVDCTZTESA-N 2 0 400.611 4.075 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCC(C)(C)[NH+]1CCC[C@H](C)C1 ZINC000465759968 879356029 /nfs/dbraw/zinc/35/60/29/879356029.db2.gz QDTADUXXGDYWPT-GMAHTHKFSA-N 2 0 414.638 4.051 20 0 HIADRP CC[NH+](CC)CCN(CC(C)C)C(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000466071324 879774295 /nfs/dbraw/zinc/77/42/95/879774295.db2.gz ADIBDMHAKVBUDG-CTNGQTDRSA-N 2 0 408.656 4.140 20 0 HIADRP CC1CCC([NH+]2CCN(C(=O)NC[C@H]3CCC[N@H+](C)[C@@H]3c3cccs3)CC2)CC1 ZINC000466084509 879803779 /nfs/dbraw/zinc/80/37/79/879803779.db2.gz ZUHYLHDONYXEPZ-VYIQXXGSSA-N 2 0 418.651 4.037 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000503475988 912517491 /nfs/dbraw/zinc/51/74/91/912517491.db2.gz VAAQSBZWBDGLKE-DEOSSOPVSA-N 2 0 421.585 4.115 20 0 HIADRP CC1CC[NH+](C[C@H]2CCCN(C(=O)NC[C@@H](c3cccs3)[NH+]3CCCC3)C2)CC1 ZINC000503505339 912553602 /nfs/dbraw/zinc/55/36/02/912553602.db2.gz SYZUEZLHJTVSAE-RTWAWAEBSA-N 2 0 418.651 4.039 20 0 HIADRP C[NH+](C)CCc1ccc(CNC(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)cc1 ZINC000467006283 880814646 /nfs/dbraw/zinc/81/46/46/880814646.db2.gz GXYAUOIPJCWEIH-UHFFFAOYSA-N 2 0 422.617 4.166 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](C/C=C/c2ccc(Cl)cc2)CC1 ZINC000469723442 883887238 /nfs/dbraw/zinc/88/72/38/883887238.db2.gz SUCUKFOPQPRWBB-GQCTYLIASA-N 2 0 403.998 4.057 20 0 HIADRP C[C@H]1C[C@H](N(C)C(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000469843787 884025762 /nfs/dbraw/zinc/02/57/62/884025762.db2.gz VWRSPTGYXMSIKV-NBGIEHNGSA-N 2 0 414.553 4.372 20 0 HIADRP C[C@@H]1CCN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000470517139 884906691 /nfs/dbraw/zinc/90/66/91/884906691.db2.gz FULWITTYDWXEFX-LJQANCHMSA-N 2 0 405.542 4.231 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)[C@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)C1 ZINC000470540757 884944319 /nfs/dbraw/zinc/94/43/19/884944319.db2.gz YOYKGMHILVEVIN-XLIONFOSSA-N 2 0 413.528 4.279 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N(C)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470744257 885207745 /nfs/dbraw/zinc/20/77/45/885207745.db2.gz FWPJHULLZGMDCB-RUZDIDTESA-N 2 0 422.617 4.334 20 0 HIADRP CN(C(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470747229 885211339 /nfs/dbraw/zinc/21/13/39/885211339.db2.gz ZHRIEEPZCSIAAK-JWQCQUIFSA-N 2 0 420.601 4.130 20 0 HIADRP CC(C)C[NH+]1CCC(NC(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)CC1 ZINC000504032953 912937652 /nfs/dbraw/zinc/93/76/52/912937652.db2.gz CIZHTPUJVOXNCH-UHFFFAOYSA-N 2 0 422.617 4.335 20 0 HIADRP Cc1cc(C)c(NC(=O)CCC[N@H+]2C[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)c(C)c1 ZINC000471020789 885524968 /nfs/dbraw/zinc/52/49/68/885524968.db2.gz HFJNVQCCDVFICQ-PSWAGMNNSA-N 2 0 405.586 4.394 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2C[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC000471386939 886033995 /nfs/dbraw/zinc/03/39/95/886033995.db2.gz YQVVHFSPZJYFBX-PLQXJYEYSA-N 2 0 405.586 4.123 20 0 HIADRP C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000471583145 886294881 /nfs/dbraw/zinc/29/48/81/886294881.db2.gz VBZOVDOZKWNOSI-IBGZPJMESA-N 2 0 411.590 4.228 20 0 HIADRP CCN(CCC[NH+]1CCCC1)C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000472092730 886888412 /nfs/dbraw/zinc/88/84/12/886888412.db2.gz HVWPSRCCSMNUAM-OAQYLSRUSA-N 2 0 400.611 4.078 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000472378380 887219471 /nfs/dbraw/zinc/21/94/71/887219471.db2.gz COGZBVCUOVDMIP-XMMPIXPASA-N 2 0 414.638 4.052 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1CC([NH+]2CCCCC2)C1)c1ccccc1Cl ZINC000473979077 888843470 /nfs/dbraw/zinc/84/34/70/888843470.db2.gz TXGBRDKCRYQUHM-WIXQSORDSA-N 2 0 407.002 4.039 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)N(CC)[C@@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)CC1 ZINC000474011001 888867163 /nfs/dbraw/zinc/86/71/63/888867163.db2.gz OIWUKUJUWNQTTR-NZQKXSOJSA-N 2 0 400.611 4.118 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)NC2CC([NH+]3CCCCC3)C2)cc1 ZINC000474013951 888869610 /nfs/dbraw/zinc/86/96/10/888869610.db2.gz CFECGTAPPQUGGK-UHFFFAOYSA-N 2 0 420.601 4.231 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000474815451 889667966 /nfs/dbraw/zinc/66/79/66/889667966.db2.gz YNMKRVGKAHLPMF-IRXDYDNUSA-N 2 0 416.635 4.005 20 0 HIADRP C[C@H]1C[C@H](CC[NH2+]Cc2ccc(Cl)cc2-n2cncn2)C[N@@H+]1Cc1ccccc1 ZINC000474874315 889727877 /nfs/dbraw/zinc/72/78/77/889727877.db2.gz AASYCWRUNTWPHX-ICSRJNTNSA-N 2 0 409.965 4.311 20 0 HIADRP Cc1nn(-c2ccc(Br)cc2)cc1C[N@H+]1CCCC12CC[NH+](C)CC2 ZINC000475137316 890004628 /nfs/dbraw/zinc/00/46/28/890004628.db2.gz QYCGVJZJLBWMFN-UHFFFAOYSA-N 2 0 403.368 4.003 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CC(=O)NC[C@H](c1ccccc1)[NH+](C)C ZINC000475153478 890018577 /nfs/dbraw/zinc/01/85/77/890018577.db2.gz NQNBOVPOHIYDJV-LAUBAEHRSA-N 2 0 422.598 4.188 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475282717 890180791 /nfs/dbraw/zinc/18/07/91/890180791.db2.gz GEPKEWNYGBWEMK-TZIWHRDSSA-N 2 0 413.993 4.189 20 0 HIADRP CN(c1ccccc1C[NH2+]CC1CCN(c2ccccc2)CC1)C1CC[NH+](C)CC1 ZINC000475295384 890202441 /nfs/dbraw/zinc/20/24/41/890202441.db2.gz HXGYWZLNIOXXEI-UHFFFAOYSA-N 2 0 406.618 4.223 20 0 HIADRP FC(F)(F)C1CCN(C2CC([NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@H]34)C2)CC1 ZINC000475348135 890272636 /nfs/dbraw/zinc/27/26/36/890272636.db2.gz LZSSEGRLCDTXGN-UFYRSWNISA-N 2 0 421.551 4.292 20 0 HIADRP COc1ccc(C[N@H+](CCc2ccccn2)Cc2cn(-c3cc[nH+]cc3)nc2C)cc1 ZINC000475552029 890476774 /nfs/dbraw/zinc/47/67/74/890476774.db2.gz ZWCFORAHVCBTQX-UHFFFAOYSA-N 2 0 413.525 4.224 20 0 HIADRP O=C(CC[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2)N1CCc2sccc2C1 ZINC000475736375 890676367 /nfs/dbraw/zinc/67/63/67/890676367.db2.gz HCMHHXCGESVQLZ-RUZDIDTESA-N 2 0 423.626 4.011 20 0 HIADRP Cc1ccccc1[C@@H]([C@H](C)NC(=O)NCc1ccccc1C[NH+]1CCCC1)[NH+](C)C ZINC000476908239 891860444 /nfs/dbraw/zinc/86/04/44/891860444.db2.gz UNLLZTUYHZQXIQ-GBXCKJPGSA-N 2 0 408.590 4.081 20 0 HIADRP O=C([C@@H]1CC[N@@H+](C2CCCCC2)C1)N1CCC2(CC[NH+](Cc3ccccc3)C2)CC1 ZINC000477064522 891997462 /nfs/dbraw/zinc/99/74/62/891997462.db2.gz KISZEQMFKIVCTH-HSZRJFAPSA-N 2 0 409.618 4.156 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cc(F)ccc1F ZINC000479063773 894323535 /nfs/dbraw/zinc/32/35/35/894323535.db2.gz PIVLSUMINWWNMD-XXBNENTESA-N 2 0 415.528 4.149 20 0 HIADRP CC[C@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479069481 894332813 /nfs/dbraw/zinc/33/28/13/894332813.db2.gz YOFVEENBXVUFHF-GUYCJALGSA-N 2 0 422.333 4.145 20 0 HIADRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479280450 894558433 /nfs/dbraw/zinc/55/84/33/894558433.db2.gz MDZZOBOAPLXSPZ-CYBMUJFWSA-N 2 0 422.333 4.145 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479289168 894568951 /nfs/dbraw/zinc/56/89/51/894568951.db2.gz VZGDLUFSRIISSD-QFIPXVFZSA-N 2 0 416.407 4.154 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)N2CCC(CC[NH+]3CCCC[C@@H]3C)CC2)C1 ZINC000479446425 894763281 /nfs/dbraw/zinc/76/32/81/894763281.db2.gz BHRZLBTXSZYGPY-VXKWHMMOSA-N 2 0 406.659 4.185 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc1)CCCO2 ZINC000480241884 895651722 /nfs/dbraw/zinc/65/17/22/895651722.db2.gz QQJCKUBKMOBFOG-AXHZCLLHSA-N 2 0 410.558 4.308 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccc(COCC(F)(F)F)cc1 ZINC000480363272 895769206 /nfs/dbraw/zinc/76/92/06/895769206.db2.gz LWICBIHQBVXXIM-LAUBAEHRSA-N 2 0 407.480 4.161 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000480537448 895900850 /nfs/dbraw/zinc/90/08/50/895900850.db2.gz PPLJPPAHVKMSFK-IBGZPJMESA-N 2 0 419.038 4.457 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480539263 895902373 /nfs/dbraw/zinc/90/23/73/895902373.db2.gz KEYFIOOCXABSPY-OXQOHEQNSA-N 2 0 404.599 4.180 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)N1CC[NH+](C)CC1 ZINC000480559800 895920284 /nfs/dbraw/zinc/92/02/84/895920284.db2.gz UFHGZOSWUWKFNL-CTNGQTDRSA-N 2 0 416.610 4.188 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000480601294 895963892 /nfs/dbraw/zinc/96/38/92/895963892.db2.gz MTOYVHHUUITPKV-UFPGJGBJSA-N 2 0 406.618 4.456 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480605296 895969892 /nfs/dbraw/zinc/96/98/92/895969892.db2.gz ZOWZDVKMCQFCKZ-OALUTQOASA-N 2 0 415.603 4.141 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480605298 895970233 /nfs/dbraw/zinc/97/02/33/895970233.db2.gz ZOWZDVKMCQFCKZ-RTBURBONSA-N 2 0 415.603 4.141 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000480638098 896007152 /nfs/dbraw/zinc/00/71/52/896007152.db2.gz HJGOIEWUYCCRQI-KGLIPLIRSA-N 2 0 411.434 4.401 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000480703190 896064935 /nfs/dbraw/zinc/06/49/35/896064935.db2.gz JNWMKLGKGFZCEM-XMMPIXPASA-N 2 0 405.586 4.360 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cccc(Br)c1 ZINC000480732002 896092198 /nfs/dbraw/zinc/09/21/98/896092198.db2.gz RIRJWKHBVBQJDW-FQEVSTJZSA-N 2 0 417.395 4.227 20 0 HIADRP C[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(Oc2ccccc2)cc1 ZINC000480734489 896095160 /nfs/dbraw/zinc/09/51/60/896095160.db2.gz IRDSLXDHBDDMHD-HXUWFJFHSA-N 2 0 402.542 4.477 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(OCCC(C)C)cc3)cn2)CC1 ZINC000480739357 896100482 /nfs/dbraw/zinc/10/04/82/896100482.db2.gz SFIRBEGEZUECHE-OAQYLSRUSA-N 2 0 410.606 4.499 20 0 HIADRP CC[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)[C@H]1CCOC1 ZINC000480748648 896111455 /nfs/dbraw/zinc/11/14/55/896111455.db2.gz YEIVTZIBRBUDAU-RXVVDRJESA-N 2 0 413.528 4.012 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000480760681 896121980 /nfs/dbraw/zinc/12/19/80/896121980.db2.gz BEKRYFNLZXHCHL-XMMPIXPASA-N 2 0 401.545 4.256 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](c2cccc(Cl)c2)N2CCCC2)[C@H](C)C1 ZINC000480762779 896124138 /nfs/dbraw/zinc/12/41/38/896124138.db2.gz LFVGIRLUHBDFHF-WTIAFYNJSA-N 2 0 408.030 4.204 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000480767355 896129478 /nfs/dbraw/zinc/12/94/78/896129478.db2.gz GXQQVUXQQFBOKM-SFHVURJKSA-N 2 0 400.394 4.214 20 0 HIADRP O=C(NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000480791058 896158991 /nfs/dbraw/zinc/15/89/91/896158991.db2.gz PVRGVMSRUUMPAL-LJQANCHMSA-N 2 0 403.998 4.075 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccccn2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480883100 896240389 /nfs/dbraw/zinc/24/03/89/896240389.db2.gz PMBCEJQJHXDVSS-LJQANCHMSA-N 2 0 418.541 4.125 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1cccc(NC(=O)C2CCCC2)c1 ZINC000480886091 896242294 /nfs/dbraw/zinc/24/22/94/896242294.db2.gz XHBFMQULRZQXFV-DVECYGJZSA-N 2 0 406.574 4.211 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cc(Cl)ccc1OC ZINC000480899642 896255271 /nfs/dbraw/zinc/25/52/71/896255271.db2.gz PYWRESDUQALQPL-QFIPXVFZSA-N 2 0 401.982 4.337 20 0 HIADRP C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CCOCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000481168528 896500987 /nfs/dbraw/zinc/50/09/87/896500987.db2.gz MLLPWDSVFDDQOD-LJQANCHMSA-N 2 0 400.538 4.165 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000481242021 896592315 /nfs/dbraw/zinc/59/23/15/896592315.db2.gz MNQHOQSPCZYYGO-VWLOTQADSA-N 2 0 400.570 4.297 20 0 HIADRP C[C@H]([NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000481294594 896639785 /nfs/dbraw/zinc/63/97/85/896639785.db2.gz LJNPBQAVJJYFGV-SFHVURJKSA-N 2 0 417.544 4.220 20 0 HIADRP CCc1nc(C)c([C@@H](C)[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)s1 ZINC000481308574 896654418 /nfs/dbraw/zinc/65/44/18/896654418.db2.gz NLLFRCULQGXPHK-LJQANCHMSA-N 2 0 400.636 4.263 20 0 HIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000481667134 897052011 /nfs/dbraw/zinc/05/20/11/897052011.db2.gz GOICGVQVYKGSOW-KRWDZBQOSA-N 2 0 406.492 4.383 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000481712026 897102419 /nfs/dbraw/zinc/10/24/19/897102419.db2.gz BFLOSVDZSCNGKG-SFHVURJKSA-N 2 0 418.578 4.456 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C)CC2)cc1 ZINC000481734973 897129787 /nfs/dbraw/zinc/12/97/87/897129787.db2.gz LLEQIOZYJFUORX-CUNXSJBXSA-N 3 0 421.629 4.407 20 0 HIADRP CC1(C)CC[C@@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c2ccccc21 ZINC000481931464 897316000 /nfs/dbraw/zinc/31/60/00/897316000.db2.gz JIAQJZWEXHASME-XUZZJYLKSA-N 2 0 405.586 4.286 20 0 HIADRP CC1(C)CC[C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c2ccccc21 ZINC000481931462 897316636 /nfs/dbraw/zinc/31/66/36/897316636.db2.gz JIAQJZWEXHASME-QPPBQGQZSA-N 2 0 405.586 4.286 20 0 HIADRP Clc1ccc2c(c1)[C@H]([NH2+]CCCN1CCN(c3cc[nH+]cc3)CC1)CCS2 ZINC000482114972 897566106 /nfs/dbraw/zinc/56/61/06/897566106.db2.gz OIFGFRLOIKKSNI-HXUWFJFHSA-N 2 0 402.995 4.074 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@H]2CCCOc3c(Cl)cccc32)c1 ZINC000482256426 897738746 /nfs/dbraw/zinc/73/87/46/897738746.db2.gz HDUKTANNIDPYOE-QFIPXVFZSA-N 2 0 418.965 4.301 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000482334319 897838576 /nfs/dbraw/zinc/83/85/76/897838576.db2.gz NTKSYGGJJHNYCY-FQEVSTJZSA-N 2 0 416.610 4.190 20 0 HIADRP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)CC)c2)cc1 ZINC000482348414 897859985 /nfs/dbraw/zinc/85/99/85/897859985.db2.gz QGJLKKFBPRIWDX-IBGZPJMESA-N 2 0 417.619 4.020 20 0 HIADRP C[C@H](C[NH2+][C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)CN1CC[NH+](C)CC1 ZINC000482462484 898036760 /nfs/dbraw/zinc/03/67/60/898036760.db2.gz KFVFVUVLOLYZPE-KGLIPLIRSA-N 2 0 411.434 4.258 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)CC1 ZINC000482497388 898077624 /nfs/dbraw/zinc/07/76/24/898077624.db2.gz YATMDEJXAOEIPB-IRXDYDNUSA-N 2 0 404.599 4.182 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2sc(-c3ccccc3F)nc2C)CC1 ZINC000482509422 898093299 /nfs/dbraw/zinc/09/32/99/898093299.db2.gz LZWFABOIMTZFPC-SJORKVTESA-N 2 0 404.599 4.182 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(OC(F)F)cc1 ZINC000482533650 898121285 /nfs/dbraw/zinc/12/12/85/898121285.db2.gz IGCZRGAUKRJPPV-QFIPXVFZSA-N 2 0 404.501 4.486 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(F)cc1OC(F)F ZINC000482537481 898125484 /nfs/dbraw/zinc/12/54/84/898125484.db2.gz NKKOFYDKLCSCJJ-HNNXBMFYSA-N 2 0 408.464 4.235 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000482542532 898129604 /nfs/dbraw/zinc/12/96/04/898129604.db2.gz JANYFWVISYHKEE-INIZCTEOSA-N 2 0 408.464 4.393 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCc4ccc(OC(F)(F)F)cc43)cc2)CC1 ZINC000482541803 898130260 /nfs/dbraw/zinc/13/02/60/898130260.db2.gz GOYNRVJLWRXESW-JOCHJYFZSA-N 2 0 420.475 4.319 20 0 HIADRP OCC[NH+]1CCC(C[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000482548482 898138181 /nfs/dbraw/zinc/13/81/81/898138181.db2.gz CRLHPXYTFYVMNZ-GOSISDBHSA-N 2 0 405.995 4.135 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)[C@@H](C)C1 ZINC000482551525 898141894 /nfs/dbraw/zinc/14/18/94/898141894.db2.gz CWRGKUSDQKFIRM-WIOPSUGQSA-N 3 0 401.639 4.145 20 0 HIADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000482649905 898253662 /nfs/dbraw/zinc/25/36/62/898253662.db2.gz RZZXQOKHYHSVMT-WIYYLYMNSA-N 2 0 405.542 4.289 20 0 HIADRP CCSc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000482651024 898254299 /nfs/dbraw/zinc/25/42/99/898254299.db2.gz KZGIFJLWFFHEQE-WIYYLYMNSA-N 2 0 411.615 4.347 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000483043759 898711922 /nfs/dbraw/zinc/71/19/22/898711922.db2.gz GBNLMEXSSXUZOL-ISKFKSNPSA-N 2 0 411.634 4.402 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3c2cc(Br)cc3F)[C@@H](C)C1 ZINC000483129402 898813070 /nfs/dbraw/zinc/81/30/70/898813070.db2.gz SOOOOSWLRZKPMS-GKCIPKSASA-N 2 0 413.375 4.302 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000483207053 898859390 /nfs/dbraw/zinc/85/93/90/898859390.db2.gz VDBJRAXHPIBIDJ-JKSUJKDBSA-N 2 0 402.526 4.493 20 0 HIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]C1CC[NH+](C[C@@H]3CCOC3)CC1)CCC2 ZINC000483214342 898862869 /nfs/dbraw/zinc/86/28/69/898862869.db2.gz DLOIBRGDOBYPLY-OXJNMPFZSA-N 2 0 415.578 4.417 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)C[C@H]1C ZINC000483677161 899336455 /nfs/dbraw/zinc/33/64/55/899336455.db2.gz FLBZDXWECMQEJU-CTVDGRRTSA-N 2 0 414.638 4.179 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2CCCC[C@H]2C)C[C@H]1C ZINC000483715493 899373179 /nfs/dbraw/zinc/37/31/79/899373179.db2.gz YTLFKBDHNSRLCM-VIZSFHNOSA-N 2 0 400.611 4.075 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC2CC[NH+](C3CCCC3)CC2)c2ccccc2)CC1 ZINC000483715513 899373285 /nfs/dbraw/zinc/37/32/85/899373285.db2.gz ZCALVCKUSWDUPH-DEOSSOPVSA-N 2 0 412.622 4.166 20 0 HIADRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000484278901 899848794 /nfs/dbraw/zinc/84/87/94/899848794.db2.gz PLRHGMSBEVJVSK-GOSISDBHSA-N 2 0 412.405 4.197 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000484465214 899959607 /nfs/dbraw/zinc/95/96/07/899959607.db2.gz GYUULWWTBAVACB-QGZVFWFLSA-N 2 0 422.598 4.321 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1cccc(Br)c1 ZINC000484468151 899961034 /nfs/dbraw/zinc/96/10/34/899961034.db2.gz BCMSTYCDSVBPIU-INIZCTEOSA-N 2 0 403.364 4.257 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000484472098 899964996 /nfs/dbraw/zinc/96/49/96/899964996.db2.gz GVHMEIUMJYUTLY-QGZVFWFLSA-N 2 0 422.491 4.435 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc1 ZINC000485295327 900573443 /nfs/dbraw/zinc/57/34/43/900573443.db2.gz PFYYHORMVAXLCZ-UKILVPOCSA-N 2 0 420.601 4.041 20 0 HIADRP CC(C)[NH+]1CCC(C(=O)N(CC[N@H+](C)Cc2ccccc2)Cc2ccccc2)CC1 ZINC000487438671 902210551 /nfs/dbraw/zinc/21/05/51/902210551.db2.gz IRPSJPJIFKANBZ-UHFFFAOYSA-N 2 0 407.602 4.268 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000487939914 902469199 /nfs/dbraw/zinc/46/91/99/902469199.db2.gz BZEUISFKPWPOCK-QFIPXVFZSA-N 2 0 415.622 4.135 20 0 HIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)CCCO2 ZINC000489495998 903423448 /nfs/dbraw/zinc/42/34/48/903423448.db2.gz KFTFGOCFKLRSRW-HSZRJFAPSA-N 2 0 409.574 4.105 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)NCc2ccccc2C[NH+]2CCCC2)CC1 ZINC000489871179 903641619 /nfs/dbraw/zinc/64/16/19/903641619.db2.gz JOVBJCWOKKGLRA-UHFFFAOYSA-N 2 0 420.601 4.088 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)c1 ZINC000489934889 903687224 /nfs/dbraw/zinc/68/72/24/903687224.db2.gz JVVSIAOOJNFAAN-UHFFFAOYSA-N 2 0 422.617 4.334 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 ZINC000490118475 903775186 /nfs/dbraw/zinc/77/51/86/903775186.db2.gz KJEKQARNDJYADH-HSZRJFAPSA-N 2 0 419.585 4.393 20 0 HIADRP c1ccc([C@@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c2ccccn2)cc1 ZINC000490163769 903803962 /nfs/dbraw/zinc/80/39/62/903803962.db2.gz HEZAOWDLHBTLQP-AREMUKBSSA-N 2 0 400.570 4.363 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 ZINC000490168754 903806356 /nfs/dbraw/zinc/80/63/56/903806356.db2.gz ZHVZBVXXJZLICY-UZUQRXQVSA-N 2 0 419.585 4.392 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 ZINC000490168752 903806688 /nfs/dbraw/zinc/80/66/88/903806688.db2.gz ZHVZBVXXJZLICY-HXOBKFHXSA-N 2 0 419.585 4.392 20 0 HIADRP COc1ccccc1-c1ncc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cn1 ZINC000490553631 904096461 /nfs/dbraw/zinc/09/64/61/904096461.db2.gz BPOHBYGNVAARBF-UHFFFAOYSA-N 2 0 402.542 4.428 20 0 HIADRP CCC[NH+]1CCC(C[NH2+][C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491010680 904367816 /nfs/dbraw/zinc/36/78/16/904367816.db2.gz UIOJGYOUMNWQEU-DEOSSOPVSA-N 2 0 414.615 4.200 20 0 HIADRP CCC[NH+]1CCC(C[NH2+][C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491010681 904368541 /nfs/dbraw/zinc/36/85/41/904368541.db2.gz UIOJGYOUMNWQEU-XMMPIXPASA-N 2 0 414.615 4.200 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000491058968 904402271 /nfs/dbraw/zinc/40/22/71/904402271.db2.gz JHAMBVBUOAIESN-QHCPKHFHSA-N 2 0 417.544 4.241 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccccc1)c1ccccc1Br ZINC000492253193 904823779 /nfs/dbraw/zinc/82/37/79/904823779.db2.gz OIEAONXEHGUZJF-DENIHFKCSA-N 2 0 417.391 4.365 20 0 HIADRP COc1ccc([C@H]([NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000493012144 904988251 /nfs/dbraw/zinc/98/82/51/904988251.db2.gz YHDDSNHKMZYCLM-RUZDIDTESA-N 2 0 407.602 4.325 20 0 HIADRP CCOc1ccc([C@@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2ccccc2Cl)cc1 ZINC000493054311 905004748 /nfs/dbraw/zinc/00/47/48/905004748.db2.gz HZQBLPGIERJKIK-XMMPIXPASA-N 2 0 416.009 4.444 20 0 HIADRP C[C@]1(CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)CCC[N@@H+]1Cc1ccccc1 ZINC000493382858 905099205 /nfs/dbraw/zinc/09/92/05/905099205.db2.gz IVTGBOFBKPNKOS-AREMUKBSSA-N 2 0 405.586 4.070 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3cc(Br)cs3)cc2)CC1 ZINC000493970819 905318929 /nfs/dbraw/zinc/31/89/29/905318929.db2.gz UMOIBPHVGQETEH-INIZCTEOSA-N 2 0 422.436 4.499 20 0 HIADRP C[C@H]1[C@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000494050598 905388805 /nfs/dbraw/zinc/38/88/05/905388805.db2.gz QZUBYQIBBOVXLL-XUZZJYLKSA-N 2 0 405.586 4.068 20 0 HIADRP COc1cc(-c2ccccc2)ccc1C[NH2+]Cc1ccccc1CN1CCOCC1 ZINC000512412383 921144036 /nfs/dbraw/zinc/14/40/36/921144036.db2.gz UOYRLBCZNPXYMP-UHFFFAOYSA-N 2 0 402.538 4.484 20 0 HIADRP Clc1cccc(OCCCN2CCN([C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000512451449 921169927 /nfs/dbraw/zinc/16/99/27/921169927.db2.gz ZSMUICGFUSVMLC-QHCPKHFHSA-N 2 0 413.993 4.001 20 0 HIADRP CC[NH+]1CCN(c2ccc(C(=O)Nc3cccc4c3C[N@H+](CC(C)C)C4)cc2)CC1 ZINC000494536292 905818775 /nfs/dbraw/zinc/81/87/75/905818775.db2.gz JCZUAEZRNRSODP-UHFFFAOYSA-N 2 0 406.574 4.052 20 0 HIADRP CC(C)(C)[NH+]1CCC(NC(=O)NCc2ccccc2C[NH+]2CCCCCC2)CC1 ZINC000494696718 905905328 /nfs/dbraw/zinc/90/53/28/905905328.db2.gz LHEAXVAINIOVAU-UHFFFAOYSA-N 2 0 400.611 4.125 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000494744403 905942536 /nfs/dbraw/zinc/94/25/36/905942536.db2.gz HIEQLOJKWRHBJN-VTLFHKLASA-N 2 0 415.375 4.052 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1 ZINC000495000775 906162702 /nfs/dbraw/zinc/16/27/02/906162702.db2.gz VMORDFNRQQMHHV-LQGLAIQGSA-N 2 0 412.549 4.040 20 0 HIADRP c1nnc([C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C2CCCCC2)[nH]1 ZINC000495071095 906220385 /nfs/dbraw/zinc/22/03/85/906220385.db2.gz BGJNPCXMXZNFPA-QHCPKHFHSA-N 2 0 411.594 4.087 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495092392 906233485 /nfs/dbraw/zinc/23/34/85/906233485.db2.gz LYKSIHXMCQWZFB-UQBPGWFLSA-N 2 0 412.549 4.040 20 0 HIADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1OCC(=O)N(C)C ZINC000495438305 906452319 /nfs/dbraw/zinc/45/23/19/906452319.db2.gz GWMLXJGCGSXBIB-FJIJXJHWSA-N 2 0 423.601 4.105 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]CCc4nnc(-c5ccccc5)o4)[C@@H]3C2)cc1 ZINC000512615200 921262502 /nfs/dbraw/zinc/26/25/02/921262502.db2.gz YHXFCRACXOYHMN-YTFSRNRJSA-N 2 0 402.542 4.169 20 0 HIADRP CC(C)(C)[N@@H+]1C[C@@H](C(=O)Nc2cccc(CC[NH+]3CCCC3)c2)[C@H](C(F)(F)F)C1 ZINC000496833999 906764363 /nfs/dbraw/zinc/76/43/63/906764363.db2.gz YEGMVJRVJSQUFZ-RTBURBONSA-N 2 0 411.512 4.172 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000497310730 906829454 /nfs/dbraw/zinc/82/94/54/906829454.db2.gz KOPQGKMQGYYMOZ-HNNXBMFYSA-N 2 0 402.917 4.157 20 0 HIADRP c1cn(Cc2cccc(C[NH2+][C@H]3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)c2)cn1 ZINC000512643112 921271246 /nfs/dbraw/zinc/27/12/46/921271246.db2.gz VRZGCOQPMLOVNB-NXCFDTQHSA-N 2 0 400.570 4.322 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@H]21)C1CCCCC1 ZINC000497401557 906881887 /nfs/dbraw/zinc/88/18/87/906881887.db2.gz PEHXYEKUUXYYBU-ISKFKSNPSA-N 2 0 412.622 4.077 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]CC4CCN(c5cc[nH+]cc5)CC4)[C@H]3C2)cc1 ZINC000512654376 921275807 /nfs/dbraw/zinc/27/58/07/921275807.db2.gz LRNKLOJPHIJBPQ-AYRHNUGRSA-N 3 0 404.602 4.188 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]([NH2+][C@H]4CCOC5(CCSCC5)C4)[C@H]3C2)cc1 ZINC000512653972 921275823 /nfs/dbraw/zinc/27/58/23/921275823.db2.gz IHQZPTBLGMGLHP-MLCQCVOFSA-N 2 0 400.632 4.322 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]CC4CCN(c5cc[nH+]cc5)CC4)[C@H]3C2)cc1 ZINC000512654378 921275959 /nfs/dbraw/zinc/27/59/59/921275959.db2.gz LRNKLOJPHIJBPQ-RNXOBYDBSA-N 3 0 404.602 4.188 20 0 HIADRP O=C(CCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)N1Cc2ccccc2C1 ZINC000512659662 921278505 /nfs/dbraw/zinc/27/85/05/921278505.db2.gz JCCZEDNEZFJQCL-KKUQBAQOSA-N 2 0 417.597 4.199 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H](C)[C@H](c2ccccc2)[NH+](C)C)CC1 ZINC000497634215 907117623 /nfs/dbraw/zinc/11/76/23/907117623.db2.gz QKBLMCRWTPAVAR-DCLXLUIPSA-N 2 0 408.590 4.203 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)[NH+](C)C)CC1 ZINC000497634217 907118491 /nfs/dbraw/zinc/11/84/91/907118491.db2.gz QKBLMCRWTPAVAR-ROKPMTFOSA-N 2 0 408.590 4.203 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cnn(-c2ccc(Br)cc2)c1 ZINC000512828955 921333434 /nfs/dbraw/zinc/33/34/34/921333434.db2.gz RAAKZQQNDYODQG-QGZVFWFLSA-N 2 0 405.384 4.379 20 0 HIADRP C[C@H](NC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000498124356 907637443 /nfs/dbraw/zinc/63/74/43/907637443.db2.gz HNBUMFPDMCCJMT-MDNUFGMLSA-N 2 0 424.589 4.016 20 0 HIADRP Cc1ccccc1[C@H]([C@H](C)NC(=O)NC1CC[NH+](C2CCCCC2)CC1)[NH+](C)C ZINC000498613840 908062366 /nfs/dbraw/zinc/06/23/66/908062366.db2.gz GWVITIOHRPIJSJ-CVDCTZTESA-N 2 0 400.611 4.083 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)CC[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000498909915 908319946 /nfs/dbraw/zinc/31/99/46/908319946.db2.gz KHNPEBFMEWMFEH-GOSISDBHSA-N 2 0 407.986 4.121 20 0 HIADRP O=C(c1ccccc1)N1CCC([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499146404 908503006 /nfs/dbraw/zinc/50/30/06/908503006.db2.gz MBHYRZURPJVRGD-MPIKPJSNSA-N 2 0 403.570 4.076 20 0 HIADRP C[C@@H](c1ccncc1)N1CCC([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499176990 908530327 /nfs/dbraw/zinc/53/03/27/908530327.db2.gz NTYQMBOTTLMKCN-JTMVAAEOSA-N 2 0 404.602 4.392 20 0 HIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]Cc2ccc(OCC[NH+]4CCCC4)cc2)C3)cc1 ZINC000499207247 908561434 /nfs/dbraw/zinc/56/14/34/908561434.db2.gz COFCUSHJKWQPHB-OOSCYNTBSA-N 3 0 419.613 4.446 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2cccc(OCc3ccc(F)cc3)c2)CC1 ZINC000499686710 908877172 /nfs/dbraw/zinc/87/71/72/908877172.db2.gz VAAJVFNOOSKOBI-JWQCQUIFSA-N 2 0 412.549 4.262 20 0 HIADRP Brc1ccc(N2CC[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)cc1 ZINC000513053576 921510582 /nfs/dbraw/zinc/51/05/82/921510582.db2.gz WPCLZMSBMVDKIK-IBGZPJMESA-N 2 0 406.412 4.415 20 0 HIADRP Brc1ccc(N2CC[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)cc1 ZINC000513053577 921511003 /nfs/dbraw/zinc/51/10/03/921511003.db2.gz WPCLZMSBMVDKIK-LJQANCHMSA-N 2 0 406.412 4.415 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+]C1CCN(Cc2c(F)cccc2Cl)CC1 ZINC000513060663 921517209 /nfs/dbraw/zinc/51/72/09/921517209.db2.gz YWGIMSLAUMTEML-UHFFFAOYSA-N 2 0 419.972 4.174 20 0 HIADRP C[C@H]1C[C@H](CCNC(=O)N2CCC(CCC[NH+](C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000500893890 910165506 /nfs/dbraw/zinc/16/55/06/910165506.db2.gz MUHLNAZAPQBIDJ-URXFXBBRSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@H](c1cc2ccccc2o1)N(C)C(=O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501021564 910239031 /nfs/dbraw/zinc/23/90/31/910239031.db2.gz GLFXMDKHHOSWNE-LJQANCHMSA-N 2 0 420.557 4.196 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000501054300 910265181 /nfs/dbraw/zinc/26/51/81/910265181.db2.gz XUTHZHLKZCLQTN-UGKGYDQZSA-N 2 0 421.029 4.431 20 0 HIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCCN1CC[NH+](C(C)C)CC1 ZINC000501060511 910271159 /nfs/dbraw/zinc/27/11/59/910271159.db2.gz SILKNNHWEUUJEL-LJQANCHMSA-N 2 0 400.636 4.494 20 0 HIADRP C[C@@H](NC(=O)[C@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000501090576 910289087 /nfs/dbraw/zinc/28/90/87/910289087.db2.gz SVLVGZUPAHXYMV-MSOLQXFVSA-N 2 0 414.981 4.149 20 0 HIADRP C[C@H](NC(=O)[C@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000501090578 910289696 /nfs/dbraw/zinc/28/96/96/910289696.db2.gz SVLVGZUPAHXYMV-ROUUACIJSA-N 2 0 414.981 4.149 20 0 HIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000501446363 910572753 /nfs/dbraw/zinc/57/27/53/910572753.db2.gz GQEVIJSNCRUFMA-GHRIWEEISA-N 2 0 419.491 4.190 20 0 HIADRP COc1ccc(-c2nc(C[NH+]3CCC(CCC[NH+](C)C)CC3)cs2)c(OC)c1 ZINC000501773183 910828024 /nfs/dbraw/zinc/82/80/24/910828024.db2.gz GQBKFILONMSAAK-UHFFFAOYSA-N 2 0 403.592 4.381 20 0 HIADRP C[NH+](C)CCCC1CC[NH+](CC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)CC1 ZINC000501774956 910829058 /nfs/dbraw/zinc/82/90/58/910829058.db2.gz LXRKPVFXPWOYHK-AREMUKBSSA-N 2 0 419.613 4.215 20 0 HIADRP CC(C)(C)[NH+]1CCC([NH2+]CCSCCOc2cccc(Br)c2)CC1 ZINC000513224691 921639264 /nfs/dbraw/zinc/63/92/64/921639264.db2.gz VGZAPUKRORHDPZ-UHFFFAOYSA-N 2 0 415.441 4.414 20 0 HIADRP C[C@H]1C[N@H+](CCOc2ccc(CC[NH2+][C@H]3CCCC34CCOCC4)cc2)C[C@H]1C ZINC000502395394 911380125 /nfs/dbraw/zinc/38/01/25/911380125.db2.gz VJRQFQGHTYAABX-IMSXRSKXSA-N 2 0 400.607 4.135 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000502878344 911879933 /nfs/dbraw/zinc/87/99/33/911879933.db2.gz VKAWRPYOEOZAMK-OAQYLSRUSA-N 2 0 400.611 4.126 20 0 HIADRP CN(C(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000502936211 911921259 /nfs/dbraw/zinc/92/12/59/911921259.db2.gz RYRLXIMWORHEJZ-RUZDIDTESA-N 2 0 420.601 4.130 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NCc1ccccc1C[NH+]1CCCC1)c1ccccc1 ZINC000502951089 911935858 /nfs/dbraw/zinc/93/58/58/911935858.db2.gz RPVHCJZERUNSOT-HXUWFJFHSA-N 2 0 408.590 4.211 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1)c1ccccc1 ZINC000503151201 912116779 /nfs/dbraw/zinc/11/67/79/912116779.db2.gz JUXYCNQZSGDCRH-UYAOXDASSA-N 2 0 414.619 4.314 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000506469343 915067011 /nfs/dbraw/zinc/06/70/11/915067011.db2.gz HTWUCALDEPLBKC-QZTJIDSGSA-N 2 0 422.411 4.364 20 0 HIADRP CN(c1ccccc1C[N@@H+](Cc1cccs1)C[C@@H]1CCCO1)C1CC[NH+](C)CC1 ZINC000506718241 915396474 /nfs/dbraw/zinc/39/64/74/915396474.db2.gz HYFGMLQHPSPCPY-QFIPXVFZSA-N 2 0 413.631 4.460 20 0 HIADRP CN(c1ccccc1C[NH+]1CCC(C(=O)Nc2ccccc2)CC1)C1CC[NH+](C)CC1 ZINC000506727523 915409073 /nfs/dbraw/zinc/40/90/73/915409073.db2.gz SGKNELINRIQEDQ-UHFFFAOYSA-N 2 0 420.601 4.068 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)C1 ZINC000506918308 915718048 /nfs/dbraw/zinc/71/80/48/915718048.db2.gz REOJHPPBJGKDPV-VXKWHMMOSA-N 2 0 412.622 4.078 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1)c1ccsc1 ZINC000506928242 915731202 /nfs/dbraw/zinc/73/12/02/915731202.db2.gz AMEKTLWSZOMZET-TUNNFDKTSA-N 2 0 420.667 4.427 20 0 HIADRP C[NH+](C/C=C\C[N@@H+](C)C[C@H]1OCCc2ccccc21)C[C@@H]1OCCc2ccccc21 ZINC000507263150 916025602 /nfs/dbraw/zinc/02/56/02/916025602.db2.gz YSECPBDTHDZMHN-OGWSBALZSA-N 2 0 406.570 4.034 20 0 HIADRP Cc1cc(C)c(NC(=O)CN(C)Cc2ccccc2N(C)C2CC[NH+](C)CC2)c(C)c1 ZINC000507461176 916229175 /nfs/dbraw/zinc/22/91/75/916229175.db2.gz SGGBGDLWYMAOLZ-UHFFFAOYSA-N 2 0 422.617 4.213 20 0 HIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)c1cccc(N2CCCC2=O)c1 ZINC000507469644 916237233 /nfs/dbraw/zinc/23/72/33/916237233.db2.gz KXRVQWOZHIJGBU-JFTIDPPCSA-N 2 0 403.570 4.375 20 0 HIADRP Cn1cc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)c(-c2ccccc2Cl)n1 ZINC000507694637 916469903 /nfs/dbraw/zinc/46/99/03/916469903.db2.gz LZPTVNIRWXELGF-UHFFFAOYSA-N 2 0 416.997 4.065 20 0 HIADRP C[C@H](c1ccc(F)c(Cl)c1)[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000507914136 916792187 /nfs/dbraw/zinc/79/21/87/916792187.db2.gz PDOXIAYLSQOIKH-QGZVFWFLSA-N 2 0 409.977 4.244 20 0 HIADRP Cc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(OC[C@@H]2CCOC2)c1 ZINC000508691539 917455140 /nfs/dbraw/zinc/45/51/40/917455140.db2.gz NKODDSQVNLZTFF-GZGNHOFSSA-N 2 0 408.586 4.411 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508697672 917459135 /nfs/dbraw/zinc/45/91/35/917459135.db2.gz MKACEMKOSBVHPQ-FCBCXNLDSA-N 3 0 421.629 4.296 20 0 HIADRP COc1ccc([C@H](CN[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)cc1 ZINC000508714411 917475440 /nfs/dbraw/zinc/47/54/40/917475440.db2.gz HBGQDZNIZCBGCK-DSBYRVASSA-N 2 0 407.602 4.332 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)N[C@H](C)[C@@H](c1ccccc1)[NH+](C)C ZINC000508852809 917606432 /nfs/dbraw/zinc/60/64/32/917606432.db2.gz NVBLJSHWEAQMCY-PFATUAPWSA-N 2 0 422.617 4.231 20 0 HIADRP CCC[N@H+](C)[C@@H](CNC(=O)N(C)[C@@H](C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000509047918 917798563 /nfs/dbraw/zinc/79/85/63/917798563.db2.gz CXJBEPAGQYMNIB-UWJYYQICSA-N 2 0 409.018 4.095 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+]Cc2ccc(-c3ccccc3Br)cc2)CC1 ZINC000509525635 918173916 /nfs/dbraw/zinc/17/39/16/918173916.db2.gz ORTJOEJEDPFLIK-UHFFFAOYSA-N 2 0 416.407 4.233 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2ccc(Sc3ccccn3)o2)CC1 ZINC000509951923 918546646 /nfs/dbraw/zinc/54/66/46/918546646.db2.gz ATJZBYIPVJKKRX-UHFFFAOYSA-N 2 0 422.598 4.253 20 0 HIADRP C[C@H](NC(=O)NCc1ccccc1C[NH+]1CCCCC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000510512648 918959247 /nfs/dbraw/zinc/95/92/47/918959247.db2.gz PPUWRXVKYRDWJV-RBBKRZOGSA-N 2 0 412.622 4.125 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccsc1 ZINC000510535606 918980642 /nfs/dbraw/zinc/98/06/42/918980642.db2.gz FDBAJZRRXPMROX-LVCYWYKZSA-N 2 0 406.640 4.083 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCCC12CC[NH+](C)CC2)[NH2+][C@H](C)c1ccccc1 ZINC000510934710 919456233 /nfs/dbraw/zinc/45/62/33/919456233.db2.gz QYXJCUPPVVXOKY-IFMALSPDSA-N 2 0 400.611 4.022 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000511265004 919863242 /nfs/dbraw/zinc/86/32/42/919863242.db2.gz JGCLCGBEKFZPDO-IRFCIJBXSA-N 2 0 400.611 4.068 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@@H](C)[C@H]2CCC[NH+](C3CCC3)C2)CC1)CC(C)C ZINC000511266761 919864496 /nfs/dbraw/zinc/86/44/96/919864496.db2.gz PWYCQWJVZPWTTG-GMAHTHKFSA-N 2 0 420.686 4.429 20 0 HIADRP C[C@H](NC(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511416707 920028078 /nfs/dbraw/zinc/02/80/78/920028078.db2.gz FVKMNJYIXNIMHF-JAXLGGSGSA-N 2 0 412.622 4.164 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)cc1)C1CC1 ZINC000511834742 920541776 /nfs/dbraw/zinc/54/17/76/920541776.db2.gz LHQCTHHOQAQLSP-UHFFFAOYSA-N 2 0 409.549 4.204 20 0 HIADRP C[C@H](C[NH2+][C@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)C[NH+]1CCCC1 ZINC000512099219 920859140 /nfs/dbraw/zinc/85/91/40/920859140.db2.gz KZAZFWUUQUMXLE-ZIAGYGMSSA-N 2 0 405.892 4.397 20 0 HIADRP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3c[nH]nc3-c3cccc(Cl)c3)CC2)C[C@H](C)O1 ZINC000512178294 920914718 /nfs/dbraw/zinc/91/47/18/920914718.db2.gz IUQWNDSNQDBYRA-CALCHBBNSA-N 2 0 402.970 4.051 20 0 HIADRP C[C@H]1C[NH+](CC2CC[NH+](Cc3c[nH]nc3-c3cccc(Cl)c3)CC2)C[C@H](C)O1 ZINC000512178296 920915929 /nfs/dbraw/zinc/91/59/29/920915929.db2.gz IUQWNDSNQDBYRA-IRXDYDNUSA-N 2 0 402.970 4.051 20 0 HIADRP c1ccc(C[NH+]2CC[C@@]3(CC[N@@H+](CCCc4nc(-c5ccccc5)no4)C3)C2)cc1 ZINC000512270993 921027599 /nfs/dbraw/zinc/02/75/99/921027599.db2.gz REWNBPUMYXJDOI-RUZDIDTESA-N 2 0 402.542 4.267 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512318878 921069025 /nfs/dbraw/zinc/06/90/25/921069025.db2.gz UHFIJCIBLIXRMX-QWFCFKBJSA-N 2 0 406.014 4.320 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512321197 921071823 /nfs/dbraw/zinc/07/18/23/921071823.db2.gz DDHBBBYMJFPUMO-YESZJQIVSA-N 2 0 407.986 4.308 20 0 HIADRP COc1ccc(-c2n[nH]cc2C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513544986 921883471 /nfs/dbraw/zinc/88/34/71/921883471.db2.gz NNYZFZZXMQQLCO-PZJWPPBQSA-N 2 0 404.558 4.476 20 0 HIADRP COc1ccc(-c2n[nH]cc2C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513544984 921883702 /nfs/dbraw/zinc/88/37/02/921883702.db2.gz NNYZFZZXMQQLCO-CTNGQTDRSA-N 2 0 404.558 4.476 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N[C@H]2CC[N@H+](C3CC3)[C@@H]2c2cccc(OC)c2)cc1 ZINC000513652894 921974080 /nfs/dbraw/zinc/97/40/80/921974080.db2.gz BVYYLMRKJYKWQM-LOSJGSFVSA-N 2 0 421.585 4.245 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N[C@@H]2CC[N@H+](C3CC3)[C@@H]2c2cccc(OC)c2)cc1 ZINC000513652893 921974195 /nfs/dbraw/zinc/97/41/95/921974195.db2.gz BVYYLMRKJYKWQM-JWQCQUIFSA-N 2 0 421.585 4.245 20 0 HIADRP c1cnn(-c2ncccc2C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000513668114 921991289 /nfs/dbraw/zinc/99/12/89/921991289.db2.gz VXITWJVKGPYAIM-KMDXXIMOSA-N 2 0 401.558 4.048 20 0 HIADRP c1cnn(-c2ncccc2C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000513668115 921992048 /nfs/dbraw/zinc/99/20/48/921992048.db2.gz VXITWJVKGPYAIM-RBZQAINGSA-N 2 0 401.558 4.048 20 0 HIADRP c1cnn(-c2ncccc2C[NH2+][C@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000513668116 921992302 /nfs/dbraw/zinc/99/23/02/921992302.db2.gz VXITWJVKGPYAIM-VXNXHJTFSA-N 2 0 401.558 4.048 20 0 HIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000513678181 922000148 /nfs/dbraw/zinc/00/01/48/922000148.db2.gz JENCAOGXQLXEHB-VWLOTQADSA-N 2 0 402.542 4.275 20 0 HIADRP Cc1ccc(NC(=O)COc2ccc(CC[NH2+][C@@H]3CC[N@@H+](C)[C@H]4CCC[C@H]43)cc2)cc1 ZINC000513703489 922021702 /nfs/dbraw/zinc/02/17/02/922021702.db2.gz WKCQJVGEAZAZQP-GVAUOCQISA-N 2 0 421.585 4.017 20 0 HIADRP O=C(c1ccccc1)N1CC[C@H](C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000514082097 922406685 /nfs/dbraw/zinc/40/66/85/922406685.db2.gz FPWWWKSLONUVEW-DMTNHVFBSA-N 2 0 417.597 4.135 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000514107574 922437431 /nfs/dbraw/zinc/43/74/31/922437431.db2.gz NJRBZYFOTWZDJU-WOJBJXKFSA-N 2 0 420.667 4.017 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NC[C@@H](c2ccccc2Cl)[NH+]2CCCC2)C1 ZINC000514458874 922634929 /nfs/dbraw/zinc/63/49/29/922634929.db2.gz DUXHVZQWKTWLNA-KNQAVFIVSA-N 2 0 421.029 4.288 20 0 HIADRP C[C@H](CC(=O)NCCc1ccccc1)[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000515410010 923086515 /nfs/dbraw/zinc/08/65/15/923086515.db2.gz NJHPPTHENSTJEK-RCZVLFRGSA-N 2 0 407.602 4.016 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)C1 ZINC000515819968 923372816 /nfs/dbraw/zinc/37/28/16/923372816.db2.gz YUVBSAZYHLCYJZ-BGYRXZFFSA-N 2 0 414.638 4.227 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)N1CCC([N@@H+]2CCc3ccccc3C2)CC1)c1ccccc1 ZINC000517507342 924236453 /nfs/dbraw/zinc/23/64/53/924236453.db2.gz QZNQBOXOKPTXOS-VWLOTQADSA-N 2 0 405.586 4.119 20 0 HIADRP O=C(CCC[NH+]1CCN(c2ccccc2)CC1)Nc1cccc(C[NH+]2CCCCC2)c1 ZINC000517635839 926743703 /nfs/dbraw/zinc/74/37/03/926743703.db2.gz GZJSABAPALIMQT-UHFFFAOYSA-N 2 0 420.601 4.213 20 0 HIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc(OC)cc2)C1 ZINC000518759720 927479796 /nfs/dbraw/zinc/47/97/96/927479796.db2.gz DBZZTTPVHUSSSS-HXUWFJFHSA-N 2 0 404.558 4.369 20 0 HIADRP C[C@@H](C[NH2+]Cc1ccc(OCc2c(F)cccc2Cl)cc1)CN1CC[NH+](C)CC1 ZINC000518777538 927488019 /nfs/dbraw/zinc/48/80/19/927488019.db2.gz JBPIPZVYUVAZDH-SFHVURJKSA-N 2 0 419.972 4.031 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)N2CCC[N@@H+](C(C)(C)C)CC2)c2cccs2)CC1 ZINC000519924264 928156026 /nfs/dbraw/zinc/15/60/26/928156026.db2.gz AJHZFMVVGFIVOY-IBGZPJMESA-N 2 0 406.640 4.037 20 0 HIADRP C[NH+](C)CCOc1ccccc1C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000520365185 928522790 /nfs/dbraw/zinc/52/27/90/928522790.db2.gz ZKHQOFHYDVWBFH-UHFFFAOYSA-N 2 0 423.601 4.322 20 0 HIADRP O=C(NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)[C@H]1CCCC[NH+]1Cc1ccccc1 ZINC000524968859 929933310 /nfs/dbraw/zinc/93/33/10/929933310.db2.gz VPNVPKLVOOUSAB-JTHBVZDNSA-N 2 0 411.615 4.131 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000525373103 930203368 /nfs/dbraw/zinc/20/33/68/930203368.db2.gz SSKNCQYXAAEDNQ-HSZRJFAPSA-N 2 0 408.590 4.157 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000525383898 930210600 /nfs/dbraw/zinc/21/06/00/930210600.db2.gz FXDJRSQXHIGHSN-RCZVLFRGSA-N 2 0 405.586 4.022 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NCc1cccc(C[NH+]2CCCC2)c1 ZINC000525400266 930219707 /nfs/dbraw/zinc/21/97/07/930219707.db2.gz KDDDZRIMKLCDMT-QFIPXVFZSA-N 2 0 420.601 4.088 20 0 HIADRP C[NH+](C)CC1CCN(c2ccccc2NC(=O)CC[N@H+](C)C2CCCCC2)CC1 ZINC000527475350 930664040 /nfs/dbraw/zinc/66/40/40/930664040.db2.gz FSKHZQOBLOZAAD-UHFFFAOYSA-N 2 0 400.611 4.058 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC000530727992 930809817 /nfs/dbraw/zinc/80/98/17/930809817.db2.gz MGIHOCDGUQUJHQ-UHFFFAOYSA-N 2 0 420.601 4.299 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)[C@H]2CCCC[NH+]2Cc2ccccc2)[C@H]1c1cccs1 ZINC000530820766 930831873 /nfs/dbraw/zinc/83/18/73/930831873.db2.gz UNLUDJNQOWQQJG-XPNTWCBSSA-N 2 0 411.615 4.302 20 0 HIADRP Cc1ccc(-c2nc(C[N@@H+](C)CCC3CC[NH+](C4CCN(C)CC4)CC3)co2)cc1 ZINC000530952882 930866964 /nfs/dbraw/zinc/86/69/64/930866964.db2.gz PXVLXDQBHZVTES-UHFFFAOYSA-N 2 0 410.606 4.278 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000530969220 930871712 /nfs/dbraw/zinc/87/17/12/930871712.db2.gz NGYHUPWOFGKWFE-ZJSXRUAMSA-N 2 0 420.601 4.118 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000530969219 930871868 /nfs/dbraw/zinc/87/18/68/930871868.db2.gz NGYHUPWOFGKWFE-XUZZJYLKSA-N 2 0 420.601 4.118 20 0 HIADRP c1nc(-c2ccccn2)sc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531001573 930880719 /nfs/dbraw/zinc/88/07/19/930880719.db2.gz OGQRYCCBXYHDHV-UHFFFAOYSA-N 2 0 422.598 4.366 20 0 HIADRP COc1cc(C[NH+]2CCC(CC[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)ccc1OC(F)F ZINC000531416803 931048418 /nfs/dbraw/zinc/04/84/18/931048418.db2.gz GVPOOXUFCUPZOS-IRXDYDNUSA-N 2 0 412.521 4.008 20 0 HIADRP CN(c1ccccc1C[NH2+]CCc1nc(-c2ccccn2)cs1)C1CC[NH+](C)CC1 ZINC000531594779 931113576 /nfs/dbraw/zinc/11/35/76/931113576.db2.gz AKQGHGGTNVAZBF-UHFFFAOYSA-N 2 0 421.614 4.068 20 0 HIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000531595352 931114412 /nfs/dbraw/zinc/11/44/12/931114412.db2.gz KRZBDDOFMVTLTD-RCZVLFRGSA-N 3 0 420.645 4.360 20 0 HIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000531687511 931153296 /nfs/dbraw/zinc/15/32/96/931153296.db2.gz DDJKDYKYRGKUSF-HXUWFJFHSA-N 2 0 416.569 4.360 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000531691542 931156218 /nfs/dbraw/zinc/15/62/18/931156218.db2.gz DXFMSYZQJSLMIB-IAGOWNOFSA-N 2 0 410.400 4.268 20 0 HIADRP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000531723814 931174158 /nfs/dbraw/zinc/17/41/58/931174158.db2.gz HXYCUSMOONIOBC-XMSQKQJNSA-N 2 0 406.014 4.435 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(Br)cc1 ZINC000531738803 931179220 /nfs/dbraw/zinc/17/92/20/931179220.db2.gz XAJMOJUIYUKKIC-INIZCTEOSA-N 2 0 403.364 4.257 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2sccc2Br)CC1 ZINC000531937604 931253908 /nfs/dbraw/zinc/25/39/08/931253908.db2.gz DMHLTUSPZNADBH-MRXNPFEDSA-N 2 0 422.436 4.499 20 0 HIADRP CCOc1ccc([C@@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1OCC ZINC000531965221 931268160 /nfs/dbraw/zinc/26/81/60/931268160.db2.gz YQAUSEAASKQFDS-OFNKIYASSA-N 2 0 411.590 4.123 20 0 HIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 ZINC000531980519 931274706 /nfs/dbraw/zinc/27/47/06/931274706.db2.gz KGZWTBFPJGBMLT-OAHLLOKOSA-N 2 0 401.473 4.014 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000532106821 931314385 /nfs/dbraw/zinc/31/43/85/931314385.db2.gz HWAXJFYOBLTSRC-FGZHOGPDSA-N 3 0 400.655 4.065 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccc(OC(F)(F)F)cc1)C1CC[NH+](C)CC1 ZINC000532107807 931315417 /nfs/dbraw/zinc/31/54/17/931315417.db2.gz HUNGSKMVHVMQMP-UHFFFAOYSA-N 2 0 407.480 4.405 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(Br)cc1 ZINC000532215708 931356875 /nfs/dbraw/zinc/35/68/75/931356875.db2.gz ODSLONNVOYQSSU-INIZCTEOSA-N 2 0 403.364 4.257 20 0 HIADRP O[C@H]1CCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000532269860 931377412 /nfs/dbraw/zinc/37/74/12/931377412.db2.gz FLIRNUHOSQAHNC-GOTSBHOMSA-N 2 0 402.485 4.225 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000532459320 931444725 /nfs/dbraw/zinc/44/47/25/931444725.db2.gz OVMDDAYSPSLPIJ-FGTMMUONSA-N 2 0 410.002 4.413 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(NC(=O)c2ccco2)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000532471795 931450569 /nfs/dbraw/zinc/45/05/69/931450569.db2.gz CLSMCPWPXGRKCR-GOSISDBHSA-N 2 0 407.514 4.323 20 0 HIADRP O=C(CC[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)Nc1ccccc1Br ZINC000532539801 931516267 /nfs/dbraw/zinc/51/62/67/931516267.db2.gz XWZZFECTQDXQKS-SFHVURJKSA-N 2 0 422.411 4.366 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000532794480 931632991 /nfs/dbraw/zinc/63/29/91/931632991.db2.gz OMYCBHDXBTWSDF-FYYLOGMGSA-N 2 0 420.601 4.023 20 0 HIADRP O=C(C[NH2+]C(c1ccccc1)c1ccccc1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000533020336 931739498 /nfs/dbraw/zinc/73/94/98/931739498.db2.gz LTLDEWGBWOQOGO-UHFFFAOYSA-N 2 0 413.565 4.278 20 0 HIADRP C[N@H+](CCc1ccc2c(c1)CCO2)[C@H]1CCC[NH+](CCc2ccc3c(c2)CCO3)CC1 ZINC000533147357 931785576 /nfs/dbraw/zinc/78/55/76/931785576.db2.gz MZPYRDDSGKYHDZ-VWLOTQADSA-N 2 0 420.597 4.128 20 0 HIADRP CC(CN1CC[NH+](CC2CCCCC2)CC1)CN1CC[NH+](CC2CCCCC2)CC1 ZINC000533256300 931820953 /nfs/dbraw/zinc/82/09/53/931820953.db2.gz LBJJSIORVJAPIB-UHFFFAOYSA-N 2 0 418.714 4.018 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](CC(=O)N[C@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000533271723 931824536 /nfs/dbraw/zinc/82/45/36/931824536.db2.gz QECFBKLEILQOFF-OAHLLOKOSA-N 2 0 400.394 4.223 20 0 HIADRP C[C@H]([NH2+][C@@H](c1ccc(F)cc1)C1CCC1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000533377047 931853156 /nfs/dbraw/zinc/85/31/56/931853156.db2.gz XGVLAYWILWLBHL-UQBPGWFLSA-N 2 0 423.576 4.426 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(CC(=O)Nc2ccc(OCc3ccccc3)cc2)CC1 ZINC000533408203 931860474 /nfs/dbraw/zinc/86/04/74/931860474.db2.gz SJBTUTLYBCUQIV-UHFFFAOYSA-N 2 0 409.574 4.256 20 0 HIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cc(Cl)ccc2OC[C@@H]2CCCO2)cc1F ZINC000534233223 932353252 /nfs/dbraw/zinc/35/32/52/932353252.db2.gz CEVVAXQJTWETBB-FQEVSTJZSA-N 2 0 406.929 4.388 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)NC[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000534243187 932361554 /nfs/dbraw/zinc/36/15/54/932361554.db2.gz VVCNJHKMYDZIGZ-UWJYYQICSA-N 2 0 418.944 4.355 20 0 HIADRP COc1ccc(NC(=O)[C@H](C)[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000534965322 932865007 /nfs/dbraw/zinc/86/50/07/932865007.db2.gz RMPFELUIKLKQDJ-FQEVSTJZSA-N 2 0 407.558 4.010 20 0 HIADRP COc1nc2ccccc2cc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000535721221 933367162 /nfs/dbraw/zinc/36/71/62/933367162.db2.gz GVXKFOKTKUXWMT-UHFFFAOYSA-N 2 0 419.569 4.404 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C[C@@H]3CCOC3)c3ccccc3)cc2)CC1 ZINC000535838735 933424756 /nfs/dbraw/zinc/42/47/56/933424756.db2.gz DXWWZIXWECIAIB-AHWVRZQESA-N 2 0 407.602 4.082 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(Br)c1 ZINC000537293727 933700678 /nfs/dbraw/zinc/70/06/78/933700678.db2.gz CNFZSAOXCANBDZ-OAHLLOKOSA-N 2 0 404.352 4.420 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)CC1 ZINC000537659099 938348308 /nfs/dbraw/zinc/34/83/08/938348308.db2.gz UBXOXIHFBLVNLR-UHFFFAOYSA-N 2 0 419.013 4.465 20 0 HIADRP CCOc1ccccc1NC(=O)[C@@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537840732 938387300 /nfs/dbraw/zinc/38/73/00/938387300.db2.gz FQIRCTIGZUXEGA-LJQANCHMSA-N 2 0 410.562 4.046 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000537991554 938453021 /nfs/dbraw/zinc/45/30/21/938453021.db2.gz SYLRLTKXPYLDQC-FQEVSTJZSA-N 2 0 409.574 4.104 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1 ZINC000537992163 938454216 /nfs/dbraw/zinc/45/42/16/938454216.db2.gz YUXFITAMYWZLEG-BWKNWUBXSA-N 2 0 405.586 4.313 20 0 HIADRP CC1(C)CC([NH2+]C2CCN(Cc3ccccc3Br)CC2)CC(C)(C)[NH2+]1 ZINC000538058974 938489675 /nfs/dbraw/zinc/48/96/75/938489675.db2.gz JPAMHRKKZDVARC-UHFFFAOYSA-N 2 0 408.428 4.312 20 0 HIADRP CCN(CC)C(=O)c1ccc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000538274974 938581070 /nfs/dbraw/zinc/58/10/70/938581070.db2.gz PDGVOXRQFQZALQ-QHCPKHFHSA-N 2 0 421.585 4.246 20 0 HIADRP COc1ccc2cc(C[N@H+](C)CCC3CC[NH+](C4CCN(C)CC4)CC3)ccc2c1 ZINC000538723344 938691859 /nfs/dbraw/zinc/69/18/59/938691859.db2.gz XFPOKZXPCDMTPI-UHFFFAOYSA-N 2 0 409.618 4.477 20 0 HIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C2CC[NH+]([C@H]4CCC[C@H]4O)CC2)CCC3)cc1 ZINC000539059599 938787162 /nfs/dbraw/zinc/78/71/62/938787162.db2.gz KIKSCJHJJSDHLO-BAGYTPMASA-N 2 0 411.615 4.463 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000539061129 938787820 /nfs/dbraw/zinc/78/78/20/938787820.db2.gz LKNRPEHEIXKGRU-TZRRMPRUSA-N 2 0 400.513 4.216 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000539061126 938787965 /nfs/dbraw/zinc/78/79/65/938787965.db2.gz LKNRPEHEIXKGRU-RBZQAINGSA-N 2 0 400.513 4.216 20 0 HIADRP CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000539072323 938793963 /nfs/dbraw/zinc/79/39/63/938793963.db2.gz PMUUNNGZOISQQW-HSALFYBXSA-N 2 0 404.599 4.100 20 0 HIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CCN(C(=O)NC3CCCCC3)CC2)CC1 ZINC000539078794 938796857 /nfs/dbraw/zinc/79/68/57/938796857.db2.gz CAJWTGASNMNVIY-CVDCTZTESA-N 2 0 404.643 4.126 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)NC[C@@H](c2cccs2)[NH+](C)C)CC1)CC(C)C ZINC000539178884 938816486 /nfs/dbraw/zinc/81/64/86/938816486.db2.gz RNBIFGHKCTWTLQ-FQEVSTJZSA-N 2 0 408.656 4.140 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(CN2CCO[C@@H](C)C2)c1)c1nc2ccc(Cl)cc2n1C ZINC000539203812 938818806 /nfs/dbraw/zinc/81/88/06/938818806.db2.gz ZFRZOIWDMUOKEL-DLBZAZTESA-N 2 0 412.965 4.298 20 0 HIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]CC(C)C[NH2+][C@H](C)c2cccc(NC(C)=O)c2)c1 ZINC000539231587 938822744 /nfs/dbraw/zinc/82/27/44/938822744.db2.gz ZDQSRUFBVAXFMF-QZTJIDSGSA-N 2 0 410.562 4.241 20 0 HIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ncc(Br)s1 ZINC000539297091 938835876 /nfs/dbraw/zinc/83/58/76/938835876.db2.gz FQNOWSRXTGWMAP-HNNXBMFYSA-N 2 0 424.408 4.274 20 0 HIADRP C[C@@H]1C[NH+](CCOc2ccc(CC[NH2+]C3CC[NH+](C(C)(C)C)CC3)cc2)C[C@H]1C ZINC000539298508 938836191 /nfs/dbraw/zinc/83/61/91/938836191.db2.gz QZQLAZSJKMFAAW-NHCUHLMSSA-N 3 0 401.639 4.048 20 0 HIADRP CC1CCN(c2ccc(C[NH2+][C@@H]3CC4(CC[NH+](C)CC4)Oc4ccccc43)cn2)CC1 ZINC000539361555 938848785 /nfs/dbraw/zinc/84/87/85/938848785.db2.gz CAJAIJTUUKECCU-HSZRJFAPSA-N 2 0 420.601 4.396 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000539498306 938868875 /nfs/dbraw/zinc/86/88/75/938868875.db2.gz FCHXERUFZHZCJD-MRXNPFEDSA-N 2 0 408.384 4.264 20 0 HIADRP CC(C)[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc2ccccc2o1 ZINC000539546605 938877714 /nfs/dbraw/zinc/87/77/14/938877714.db2.gz HZUPZFCXVJCHTP-QHCPKHFHSA-N 2 0 407.562 4.112 20 0 HIADRP CC[NH+]1CCN(c2ccc(N[C@H](C)c3ccc(OCC[NH+](C)C)cc3)c(C)c2)CC1 ZINC000539610091 938887539 /nfs/dbraw/zinc/88/75/39/938887539.db2.gz PJWVEFIXVWKBET-OAQYLSRUSA-N 2 0 410.606 4.250 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccc(F)cn1 ZINC000539969273 938982393 /nfs/dbraw/zinc/98/23/93/938982393.db2.gz RIELUUKISPASIB-KRWDZBQOSA-N 2 0 424.486 4.493 20 0 HIADRP C[C@H](C(=O)Nc1ccccc1Cl)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540043573 939047013 /nfs/dbraw/zinc/04/70/13/939047013.db2.gz DBXSVMGTQZRHNU-QGZVFWFLSA-N 2 0 400.954 4.301 20 0 HIADRP Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540043722 939047111 /nfs/dbraw/zinc/04/71/11/939047111.db2.gz HBKBZSAEKJVZRL-NHCUHLMSSA-N 2 0 408.590 4.194 20 0 HIADRP CCN(CC)C(=O)[C@@H](c1ccccc1)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540045189 939047818 /nfs/dbraw/zinc/04/78/18/939047818.db2.gz IMAQCFOGUBTZIQ-XMMPIXPASA-N 2 0 408.590 4.230 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H](c3cccs3)C3CCCC3)c2)C1 ZINC000540087367 939065132 /nfs/dbraw/zinc/06/51/32/939065132.db2.gz ZSDKIJMNFKLQCW-GGAORHGYSA-N 2 0 411.615 4.467 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccccc1C(F)(F)F ZINC000540170998 939101514 /nfs/dbraw/zinc/10/15/14/939101514.db2.gz LJLPHPMAFTTXSM-KRWDZBQOSA-N 2 0 419.491 4.382 20 0 HIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)c2ccsc2S1 ZINC000540171084 939101879 /nfs/dbraw/zinc/10/18/79/939101879.db2.gz NETGPXITJNDURZ-JXFKEZNVSA-N 2 0 415.628 4.289 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1cc(C)ccc1OC ZINC000540171355 939102927 /nfs/dbraw/zinc/10/29/27/939102927.db2.gz UEKWQSDEMWHGIZ-HSZRJFAPSA-N 2 0 409.574 4.070 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ncc(Br)s1 ZINC000540192969 939118477 /nfs/dbraw/zinc/11/84/77/939118477.db2.gz WKOZNUKDUKYAEM-MRXNPFEDSA-N 2 0 423.424 4.159 20 0 HIADRP CC[N@H+](CCC1CC[NH+]([C@H](C)C(=O)N[C@H]2CCOc3ccccc32)CC1)CC(C)C ZINC000540197864 939122241 /nfs/dbraw/zinc/12/22/41/939122241.db2.gz SSWOMATZIGZZOH-OFNKIYASSA-N 2 0 415.622 4.095 20 0 HIADRP Brc1ccccc1CN1CCC([NH2+]C2CC[NH+](C3CCC3)CC2)CC1 ZINC000540302949 939187858 /nfs/dbraw/zinc/18/78/58/939187858.db2.gz UXFHRPSNAHYRSU-UHFFFAOYSA-N 2 0 406.412 4.020 20 0 HIADRP CC(C)Oc1cccc([C@@H](C)[NH2+]CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000540325349 939195353 /nfs/dbraw/zinc/19/53/53/939195353.db2.gz GIWFJINRCCVEAX-HXUWFJFHSA-N 2 0 409.574 4.037 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]C[C@H](c1ccccc1)C(C)(C)CO)c1ccccc1O2 ZINC000540494300 939274604 /nfs/dbraw/zinc/27/46/04/939274604.db2.gz VMTIPZJWTDICBZ-DHIUTWEWSA-N 2 0 408.586 4.367 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 ZINC000541534435 939546819 /nfs/dbraw/zinc/54/68/19/939546819.db2.gz PXGOGWDTJCNLLC-GOSISDBHSA-N 2 0 418.476 4.144 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000541548822 939551794 /nfs/dbraw/zinc/55/17/94/939551794.db2.gz IEQPLUMKDCEZQT-WOJBJXKFSA-N 2 0 410.558 4.464 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc(Cl)cc1F ZINC000541913460 939652190 /nfs/dbraw/zinc/65/21/90/939652190.db2.gz LJWDXLZDAIVEIV-NRFANRHFSA-N 2 0 405.945 4.257 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc(Cl)cc1F ZINC000541913461 939652367 /nfs/dbraw/zinc/65/23/67/939652367.db2.gz LJWDXLZDAIVEIV-OAQYLSRUSA-N 2 0 405.945 4.257 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)CC1 ZINC000542085861 939705708 /nfs/dbraw/zinc/70/57/08/939705708.db2.gz SHJSPZVWOAMGHJ-IRLDBZIGSA-N 2 0 406.659 4.183 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000542306990 939792902 /nfs/dbraw/zinc/79/29/02/939792902.db2.gz LQAOGQMVRWHJIV-VGOFRKELSA-N 2 0 413.928 4.151 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](c2ccccc2)c2ccc(F)cn2)[C@H](c2ccccc2)C1 ZINC000542480802 939830895 /nfs/dbraw/zinc/83/08/95/939830895.db2.gz QLHGTXKTQKDSFW-IZZNHLLZSA-N 2 0 418.560 4.279 20 0 HIADRP COc1ccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccc(F)cc2)cc1 ZINC000542848310 939862829 /nfs/dbraw/zinc/86/28/29/939862829.db2.gz XNVNSLYCOXKRLE-AZGAKELHSA-N 2 0 420.528 4.280 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000543324190 940031304 /nfs/dbraw/zinc/03/13/04/940031304.db2.gz NVNXOTAHUXKVCM-AOYPEHQESA-N 2 0 417.597 4.408 20 0 HIADRP NC(=O)[C@@H](Cc1ccccc1)[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000543651793 940150682 /nfs/dbraw/zinc/15/06/82/940150682.db2.gz HYHQVMOZIPRJTN-AREMUKBSSA-N 2 0 413.565 4.136 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCC(CCCn3ccnc3)CC2)cc1 ZINC000543964882 940273797 /nfs/dbraw/zinc/27/37/97/940273797.db2.gz PMOAOMRYCBUKMR-UHFFFAOYSA-N 2 0 411.594 4.127 20 0 HIADRP CC1(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)CC[NH+](Cc2ccccc2)CC1 ZINC000544373281 940405018 /nfs/dbraw/zinc/40/50/18/940405018.db2.gz YDPLCWTUNRTWBR-QFIPXVFZSA-N 2 0 409.574 4.225 20 0 HIADRP CC1CC[NH+](C2CCC([NH2+]C3CCN(CCc4ccc(F)cc4)CC3)CC2)CC1 ZINC000563993723 945339777 /nfs/dbraw/zinc/33/97/77/945339777.db2.gz CGAVXIRNCWUGJJ-UHFFFAOYSA-N 3 0 401.614 4.465 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)N[C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[NH+]3C)CC[N@@H+]1C ZINC000548970941 941136023 /nfs/dbraw/zinc/13/60/23/941136023.db2.gz KIWNMOQHKPYGQE-RIGAPWLVSA-N 2 0 419.013 4.036 20 0 HIADRP Cc1ccc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c(-c2ccnn2C)c1 ZINC000548981348 941138508 /nfs/dbraw/zinc/13/85/08/941138508.db2.gz VOQSTPAGZUJZRE-UHFFFAOYSA-N 2 0 404.558 4.160 20 0 HIADRP Cc1cc2ncn(C[C@@H](O)C[NH2+]Cc3ccc(C[N@H+]4CCC[C@@H](C)C4)cc3)c2cc1C ZINC000549192101 941170017 /nfs/dbraw/zinc/17/00/17/941170017.db2.gz SJGYWFIOLRQOHI-DVECYGJZSA-N 2 0 420.601 4.036 20 0 HIADRP Clc1ccc2ncc(C[NH2+]C[C@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)n2c1 ZINC000549867788 941221289 /nfs/dbraw/zinc/22/12/89/941221289.db2.gz GSVSSIQENPBBFG-FQEVSTJZSA-N 2 0 424.976 4.006 20 0 HIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccccc2N2CCO[C@H](C)C2)CC1 ZINC000550750885 941363241 /nfs/dbraw/zinc/36/32/41/941363241.db2.gz QTCATWWSKVAYSL-JOCHJYFZSA-N 2 0 407.602 4.433 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CCCc3ccc(O)cc32)c1)C1CCOCC1 ZINC000550886293 941379226 /nfs/dbraw/zinc/37/92/26/941379226.db2.gz NSEHFLVJEMXXAY-RUZDIDTESA-N 2 0 410.558 4.049 20 0 HIADRP CC(=O)N1CCC[C@@H](C[NH2+][C@@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)C1 ZINC000550901427 941380780 /nfs/dbraw/zinc/38/07/80/941380780.db2.gz HRSDRYLPGYZIHT-URXFXBBRSA-N 2 0 403.586 4.227 20 0 HIADRP C[NH+]1CCC(Oc2ccc(CNC(=O)c3ccc(C[NH+]4CCCCC4)cc3)cc2)CC1 ZINC000551679204 941525343 /nfs/dbraw/zinc/52/53/43/941525343.db2.gz NOTFDAKJQJJZAU-UHFFFAOYSA-N 2 0 421.585 4.076 20 0 HIADRP COC1CCN(C(C)(C)C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000552043511 941572615 /nfs/dbraw/zinc/57/26/15/941572615.db2.gz PZAMOGKJTXLABX-PZUNEJSGSA-N 2 0 413.650 4.156 20 0 HIADRP COc1cc(OC)c(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c(OC)c1 ZINC000552060222 941576406 /nfs/dbraw/zinc/57/64/06/941576406.db2.gz KOOJHWUPALBAKN-UHFFFAOYSA-N 2 0 410.558 4.201 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]C4CCN(Cc5ccccn5)CC4)[C@@H]3C2)cc1 ZINC000552255745 941615323 /nfs/dbraw/zinc/61/53/23/941615323.db2.gz STZSYRJJWZJCBC-HUROMRQRSA-N 2 0 418.629 4.326 20 0 HIADRP CCOc1ccc([C@H](C)NC(=O)CCC[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000552582783 941713272 /nfs/dbraw/zinc/71/32/72/941713272.db2.gz WXDLOCNHLBCZDI-IBGZPJMESA-N 2 0 401.595 4.039 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H]2CCC[NH+](C)[C@@H]2c2ccccc2)cc1)C1CC1 ZINC000552650698 941730310 /nfs/dbraw/zinc/73/03/10/941730310.db2.gz KHFPYCNFVGMHFQ-ILBGXUMGSA-N 2 0 405.586 4.484 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000552904724 941800579 /nfs/dbraw/zinc/80/05/79/941800579.db2.gz UOJCTZYBLKHJCA-UTKZUKDTSA-N 2 0 410.949 4.433 20 0 HIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]Cc3ccnc(OCC[NH+](C)C)c3)cs2)cs1 ZINC000552923778 941803854 /nfs/dbraw/zinc/80/38/54/941803854.db2.gz WGPLBRPXUXEINN-CQSZACIVSA-N 2 0 402.589 4.366 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000554738023 942215858 /nfs/dbraw/zinc/21/58/58/942215858.db2.gz IXPWYMIGPGEDEM-JOCHJYFZSA-N 2 0 410.606 4.070 20 0 HIADRP COCCOCc1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)cc1 ZINC000554852865 942290385 /nfs/dbraw/zinc/29/03/85/942290385.db2.gz DYYXHGHPEDRERS-SANMLTNESA-N 2 0 408.586 4.338 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000554988915 942344957 /nfs/dbraw/zinc/34/49/57/942344957.db2.gz RWYUFXIFRSGGTF-QFIPXVFZSA-N 2 0 408.590 4.215 20 0 HIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](CC(c3ccc(F)cc3)c3ccc(F)cc3)C2)CC1 ZINC000555335672 942481533 /nfs/dbraw/zinc/48/15/33/942481533.db2.gz UJFCYOAFTIPZAX-DEOSSOPVSA-N 2 0 413.556 4.197 20 0 HIADRP C[C@@H]1CN(c2ccccc2C[NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)CCO1 ZINC000555908770 942770937 /nfs/dbraw/zinc/77/09/37/942770937.db2.gz OSDPKTSVJSNSBX-FCHUYYIVSA-N 2 0 407.602 4.433 20 0 HIADRP COc1ccc(CC[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(Cl)c1OC ZINC000556218464 942820255 /nfs/dbraw/zinc/82/02/55/942820255.db2.gz UREWEOFLERCIAJ-YLJYHZDGSA-N 2 0 402.966 4.400 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2cnc(OC)c(Cl)c2)CC1 ZINC000556582649 942906206 /nfs/dbraw/zinc/90/62/06/942906206.db2.gz CDAVZKPUMBMOSM-HZPDHXFCSA-N 2 0 420.960 4.436 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)nnn1-c1cccc(Br)c1 ZINC000557330032 943072963 /nfs/dbraw/zinc/07/29/63/943072963.db2.gz MJZHNTDNFTWESZ-MRXNPFEDSA-N 2 0 420.399 4.255 20 0 HIADRP CCOc1ccccc1[C@H](CC)[NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000557494525 943168143 /nfs/dbraw/zinc/16/81/43/943168143.db2.gz LDSHXJCPJUUJLH-DEOSSOPVSA-N 2 0 423.601 4.215 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@@H](C[NH+](C)C)c1ccc(Cl)cc1 ZINC000558886457 943720015 /nfs/dbraw/zinc/72/00/15/943720015.db2.gz GBPMCUDUIHSPSL-QFIPXVFZSA-N 2 0 416.997 4.282 20 0 HIADRP C[C@H](c1ccc(F)cc1)N1CC[C@@H]([NH+]2CCC(CCC[NH+]3CCCC3)CC2)C1=O ZINC000559145594 943853269 /nfs/dbraw/zinc/85/32/69/943853269.db2.gz MVHOYFOEMIFVEY-AUSIDOKSSA-N 2 0 401.570 4.076 20 0 HIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c(OC)c1 ZINC000559892169 944077334 /nfs/dbraw/zinc/07/73/34/944077334.db2.gz WOLOIPYKMNQNRP-RBBKRZOGSA-N 2 0 424.585 4.283 20 0 HIADRP Oc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CCC2 ZINC000559892586 944077705 /nfs/dbraw/zinc/07/77/05/944077705.db2.gz YFOODILEYSPRQK-DHLKQENFSA-N 2 0 406.570 4.288 20 0 HIADRP Oc1ccc2c(c1)[C@H]([NH2+]C[C@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CCC2 ZINC000559892600 944077951 /nfs/dbraw/zinc/07/79/51/944077951.db2.gz YFOODILEYSPRQK-WIOPSUGQSA-N 2 0 406.570 4.288 20 0 HIADRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000560266725 944212091 /nfs/dbraw/zinc/21/20/91/944212091.db2.gz PUKYZIUFDYUZAN-JWQCQUIFSA-N 2 0 422.569 4.431 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)Cc1cc(O)c(OC)cc1Br ZINC000561973668 944881926 /nfs/dbraw/zinc/88/19/26/944881926.db2.gz BDWCPNKIMVBSSO-UHFFFAOYSA-N 2 0 407.352 4.247 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@@H]3CCN(C)[C@@H](c4ccccc4)C3)CC2)c1 ZINC000564474780 945606185 /nfs/dbraw/zinc/60/61/85/945606185.db2.gz SQYYMEVDFOPKPV-XNMGPUDCSA-N 2 0 420.645 4.322 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@H](C[NH+](C)C)c1ccc(Cl)cc1 ZINC000567068919 946232004 /nfs/dbraw/zinc/23/20/04/946232004.db2.gz CFBBFOCSZIATOE-QGZVFWFLSA-N 2 0 413.949 4.223 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)CC1 ZINC000570949336 947396585 /nfs/dbraw/zinc/39/65/85/947396585.db2.gz DSJMHDYSTDZAEL-REWPJTCUSA-N 2 0 423.576 4.093 20 0 HIADRP O[C@H](C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)COc1cccc2ccccc21 ZINC000571152433 947530235 /nfs/dbraw/zinc/53/02/35/947530235.db2.gz LGOURMJZEGTEEV-XMMPIXPASA-N 2 0 404.554 4.355 20 0 HIADRP Cc1ccc(C[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)c(-c2cnn(C)c2)c1 ZINC000572609405 947956665 /nfs/dbraw/zinc/95/66/65/947956665.db2.gz OJCOWNMXDDEOGJ-SFTDATJTSA-N 2 0 418.585 4.295 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(=O)N(C)Cc1cccc(F)c1 ZINC000572867384 948025525 /nfs/dbraw/zinc/02/55/25/948025525.db2.gz OOLICMNIDHWZBQ-VQTJNVASSA-N 2 0 411.565 4.194 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000573268637 948129817 /nfs/dbraw/zinc/12/98/17/948129817.db2.gz GEFKTJGGBCVIJA-CQSZACIVSA-N 2 0 422.333 4.146 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+](C)[C@@H]2CCCc3ccccc32)CC1 ZINC000573783507 948298633 /nfs/dbraw/zinc/29/86/33/948298633.db2.gz SNPIKDRKYCXLAV-RUZDIDTESA-N 2 0 405.586 4.085 20 0 HIADRP C[C@@H]1C[C@H]1[N@@H+]1CCN(C(=O)c2cccc(C[NH+](C)Cc3ccccc3)c2)C[C@@H](C)C1 ZINC000575773614 948702467 /nfs/dbraw/zinc/70/24/67/948702467.db2.gz ZWHBHWQTGZMQLO-BPYKYCOYSA-N 2 0 405.586 4.121 20 0 HIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCCn3cnc(C[NH2+]C4CCC4)c3C2)nc1 ZINC001164842478 720740554 /nfs/dbraw/zinc/74/05/54/720740554.db2.gz FJAKIQAUCZWBCW-HSZRJFAPSA-N 2 0 422.621 4.268 20 0 HIADRP COc1ccc2c(cc[nH+]c2N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)c1 ZINC001165023336 721805878 /nfs/dbraw/zinc/80/58/78/721805878.db2.gz JNWHBTPEMDRGQT-IEXUWNMDSA-N 2 0 402.542 4.375 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3CC[C@H](OCC4CC4)[C@H]3Cc3ccccc3)c2)CC1 ZINC001165006234 722271940 /nfs/dbraw/zinc/27/19/40/722271940.db2.gz MFZATZKQXZVMNO-RPBOFIJWSA-N 2 0 421.585 4.171 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)NCc1cccc(C[NH+]2CCCC2)c1 ZINC000028390476 847414803 /nfs/dbraw/zinc/41/48/03/847414803.db2.gz MAYQGXNFDDFKGB-UHFFFAOYSA-N 2 0 420.601 4.268 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)C(=O)Nc1cccc(Br)c1 ZINC000028899004 847474388 /nfs/dbraw/zinc/47/43/88/847474388.db2.gz OGMLEJIUMODBEB-MRXNPFEDSA-N 2 0 418.379 4.408 20 0 HIADRP CN1CC[C@H](C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000436480895 861820089 /nfs/dbraw/zinc/82/00/89/861820089.db2.gz JJHSROGILXPSDI-VGSWGCGISA-N 2 0 402.945 4.126 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000047950869 849143740 /nfs/dbraw/zinc/14/37/40/849143740.db2.gz OVGANPUXWCQQDF-NRFANRHFSA-N 2 0 414.619 4.225 20 0 HIADRP CC(C)(C)n1cc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)cn1 ZINC000048711898 849257632 /nfs/dbraw/zinc/25/76/32/849257632.db2.gz BCSRBUOZYRNCGR-UHFFFAOYSA-N 2 0 417.601 4.250 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cc(Cl)c3c(c2)OCCO3)C[C@@H](C)O1 ZINC000048816705 849270213 /nfs/dbraw/zinc/27/02/13/849270213.db2.gz CFLUMCQGISLKMW-IAGOWNOFSA-N 2 0 416.949 4.010 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2ccccc2C[NH+]2CCC[C@H](C)C2)CC1 ZINC000056845881 850500186 /nfs/dbraw/zinc/50/01/86/850500186.db2.gz RJLGLRMLZLPSIP-NRFANRHFSA-N 2 0 414.638 4.180 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)N1CCC([NH+]2CCCCC2)CC1 ZINC000060566694 851149554 /nfs/dbraw/zinc/14/95/54/851149554.db2.gz KDGZCKUZQDNHGI-UHFFFAOYSA-N 2 0 412.622 4.223 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(OC(F)(F)F)cc3)cc2)CC1 ZINC000061070046 851287170 /nfs/dbraw/zinc/28/71/70/851287170.db2.gz HXBYMQBQPFDEHV-UHFFFAOYSA-N 2 0 407.480 4.013 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccccc3OC(F)(F)F)cc2)CC1 ZINC000061070031 851287196 /nfs/dbraw/zinc/28/71/96/851287196.db2.gz KXTWTQSCMJJOJK-UHFFFAOYSA-N 2 0 407.480 4.013 20 0 HIADRP O[C@@H](CO[C@@H]1CCCc2ccccc21)C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000061735360 851433722 /nfs/dbraw/zinc/43/37/22/851433722.db2.gz OCTLTTRMIOSIIQ-ILBGXUMGSA-N 2 0 400.607 4.030 20 0 HIADRP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1Br ZINC000062426798 851550510 /nfs/dbraw/zinc/55/05/10/851550510.db2.gz WWFDNMPYQDIVGA-LJQANCHMSA-N 2 0 403.364 4.460 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)NC2CC[NH+](CC3CCCCC3)CC2)C1 ZINC000062528414 851570414 /nfs/dbraw/zinc/57/04/14/851570414.db2.gz YVPWATRZTHPLCK-OYRHEFFESA-N 2 0 406.659 4.088 20 0 HIADRP Brc1cc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc2c1OCO2 ZINC000063551842 851713234 /nfs/dbraw/zinc/71/32/34/851713234.db2.gz YJIINGDNDVQKTM-UHFFFAOYSA-N 2 0 417.347 4.180 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)c2cccc(C[NH+]3CCCC3)c2)c2ccccc2)CC1 ZINC000064027356 851817343 /nfs/dbraw/zinc/81/73/43/851817343.db2.gz OBJIQSYZNKAIAY-VWLOTQADSA-N 2 0 405.586 4.485 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000065868486 852292703 /nfs/dbraw/zinc/29/27/03/852292703.db2.gz XMDJLOAQWWPJFN-UHFFFAOYSA-N 2 0 409.574 4.258 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cc3c(c(Br)c2)OCO3)c1 ZINC000065976673 852337501 /nfs/dbraw/zinc/33/75/01/852337501.db2.gz AIIZFGWUOQONDW-UHFFFAOYSA-N 2 0 405.336 4.308 20 0 HIADRP CC[NH+]1CCN(c2ccc(C(=O)Nc3cccc(C[NH+]4CCCCC4)c3)cc2)CC1 ZINC000079308767 852541986 /nfs/dbraw/zinc/54/19/86/852541986.db2.gz WKWWWDLYEBVKAW-UHFFFAOYSA-N 2 0 406.574 4.067 20 0 HIADRP CCN(Cc1cccc(F)c1)C(=O)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000110914770 853167151 /nfs/dbraw/zinc/16/71/51/853167151.db2.gz LKAPCYDIEMMLSZ-UHFFFAOYSA-N 2 0 411.565 4.018 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N(CC[NH+](C)C)Cc2ccc(F)c(F)c2)cc1 ZINC000116072816 853281532 /nfs/dbraw/zinc/28/15/32/853281532.db2.gz YIWVVEBNRLISKD-UHFFFAOYSA-N 2 0 403.517 4.011 20 0 HIADRP O=C(NCC1CC[NH+](Cc2ccccc2)CC1)N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000195664392 853745250 /nfs/dbraw/zinc/74/52/50/853745250.db2.gz ZMXWJCVOTWITJC-VWLOTQADSA-N 2 0 420.601 4.035 20 0 HIADRP COc1c(Br)cc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1Br ZINC000227327141 853885086 /nfs/dbraw/zinc/88/50/86/853885086.db2.gz OVBZCTYFUFHYFR-UHFFFAOYSA-N 2 0 420.189 4.042 20 0 HIADRP Cc1cc(C)c(NC(=O)[C@H](C)N2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c(Cl)c1 ZINC000229279384 853891865 /nfs/dbraw/zinc/89/18/65/853891865.db2.gz AXHHBXZKPLADSM-FHWLQOOXSA-N 2 0 422.013 4.105 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cnn(-c3ccccc3)c2)CC1 ZINC000236853393 853928655 /nfs/dbraw/zinc/92/86/55/853928655.db2.gz XWGTYEVZSVHPSH-IBGZPJMESA-N 2 0 407.537 4.004 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(-n3cccn3)cc2)CC1 ZINC000236851327 853929106 /nfs/dbraw/zinc/92/91/06/853929106.db2.gz ROYFVCDSMXYFIX-LJQANCHMSA-N 2 0 407.537 4.004 20 0 HIADRP CCCOc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)ccc1OC ZINC000236925573 853938083 /nfs/dbraw/zinc/93/80/83/853938083.db2.gz JHIXOEQWWLSWFM-WOJBJXKFSA-N 2 0 412.574 4.383 20 0 HIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+]Cc1csc(-c2cccc(Br)c2)n1 ZINC000237047040 853956874 /nfs/dbraw/zinc/95/68/74/853956874.db2.gz FPZWXBWOAAVVLE-KRWDZBQOSA-N 2 0 412.397 4.019 20 0 HIADRP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)C2)ccc1OCCOc1ccccc1Cl ZINC000237277662 853996495 /nfs/dbraw/zinc/99/64/95/853996495.db2.gz UXZSOKBBVLPXMT-LJQANCHMSA-N 2 0 418.965 4.238 20 0 HIADRP COc1cccc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1OC(C)C ZINC000237388454 854020510 /nfs/dbraw/zinc/02/05/10/854020510.db2.gz UYBKALQPVJQDOL-BGYRXZFFSA-N 2 0 412.574 4.381 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000237561764 854055553 /nfs/dbraw/zinc/05/55/53/854055553.db2.gz UXDAKUDFUPLJKI-HNNXBMFYSA-N 2 0 404.352 4.018 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(Br)cc2)C[C@H](C)O1 ZINC000237621266 854063567 /nfs/dbraw/zinc/06/35/67/854063567.db2.gz ITJUMPWYGFVFMG-CALCHBBNSA-N 2 0 403.364 4.348 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(F)c(Br)c2)C[C@H](C)O1 ZINC000237622020 854063600 /nfs/dbraw/zinc/06/36/00/854063600.db2.gz MFWOKCQZTOGXCT-IYBDPMFKSA-N 2 0 421.354 4.487 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccccc2Br)C[C@H](C)O1 ZINC000237623529 854063887 /nfs/dbraw/zinc/06/38/87/854063887.db2.gz MPBYHFFLVULCGK-CALCHBBNSA-N 2 0 403.364 4.348 20 0 HIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2nc(-c3cccc(Br)c3)c[nH]2)C1 ZINC000237669254 854072118 /nfs/dbraw/zinc/07/21/18/854072118.db2.gz RHSVGWHHAZPWIH-INIZCTEOSA-N 2 0 405.384 4.441 20 0 HIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]CCCC[N@@H+]1CCC[C@H]1CO ZINC000237708856 854080112 /nfs/dbraw/zinc/08/01/12/854080112.db2.gz OYUQGJFCGOCBOB-DEOSSOPVSA-N 2 0 418.585 4.174 20 0 HIADRP C[C@H](NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2CCCC2)CC1)c1ccc(Cl)cc1Cl ZINC000303054376 854740137 /nfs/dbraw/zinc/74/01/37/854740137.db2.gz JZKDGQSLSXUGIQ-HOTGVXAUSA-N 2 0 412.405 4.367 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1)c1ccccc1 ZINC000303178928 854803776 /nfs/dbraw/zinc/80/37/76/854803776.db2.gz COVQNFFGMGNGBX-QHCPKHFHSA-N 2 0 411.615 4.300 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)c1ccccc1 ZINC000303249593 854835244 /nfs/dbraw/zinc/83/52/44/854835244.db2.gz MSKHEYPZRQLHTH-DENIHFKCSA-N 2 0 411.565 4.283 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)c2cccs2)CC1 ZINC000303276781 854847954 /nfs/dbraw/zinc/84/79/54/854847954.db2.gz IYMZMMWHZFNCIU-RTWAWAEBSA-N 2 0 418.651 4.181 20 0 HIADRP CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]([NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC000309674717 855363085 /nfs/dbraw/zinc/36/30/85/855363085.db2.gz VUBHEALTJFETLG-YZUZCNPQSA-N 2 0 401.595 4.324 20 0 HIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381878473 855432438 /nfs/dbraw/zinc/43/24/38/855432438.db2.gz NVHSSGIKOSMSSM-UAYLSCSNSA-N 2 0 413.606 4.417 20 0 HIADRP CC(C)(C)OC(=O)N1CCC([NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000381894833 855432718 /nfs/dbraw/zinc/43/27/18/855432718.db2.gz FTIBEFFBAAGRRV-NRFANRHFSA-N 2 0 401.595 4.278 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000410331652 855933155 /nfs/dbraw/zinc/93/31/55/855933155.db2.gz CAMWSRCAGATDGL-UHFFFAOYSA-N 2 0 422.617 4.301 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NC[C@@H](c3ccco3)[NH+]3CCCC3)cc2)CC1 ZINC000410340654 855938416 /nfs/dbraw/zinc/93/84/16/855938416.db2.gz ZLXCFURFSBZLGU-QHCPKHFHSA-N 2 0 424.589 4.148 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N(CC[NH+](C)C)Cc2ccccc2)cc1 ZINC000410345515 855940649 /nfs/dbraw/zinc/94/06/49/855940649.db2.gz QDDPXYBWBITPPK-QFIPXVFZSA-N 2 0 422.617 4.334 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@H](c1cccs1)[NH+](C)C ZINC000410365713 855953674 /nfs/dbraw/zinc/95/36/74/855953674.db2.gz KIOLKYWQGJCSLO-GHTZIAJQSA-N 2 0 414.619 4.225 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@H](c2ccccc2)[NH+](C)C)C1 ZINC000410367109 855955203 /nfs/dbraw/zinc/95/52/03/855955203.db2.gz JJCSDSPKMQOZEP-HYBUGGRVSA-N 2 0 408.590 4.021 20 0 HIADRP Cc1ccc(-c2nnc([C@H](C)[NH+]3CCC(CC[N@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)o2)cc1 ZINC000426788218 856477576 /nfs/dbraw/zinc/47/75/76/856477576.db2.gz LFAJYWHQJDTVFY-ZCNNSNEGSA-N 2 0 412.578 4.317 20 0 HIADRP CC(C)O[C@@H](C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1)c1ccccc1 ZINC000428198162 857108134 /nfs/dbraw/zinc/10/81/34/857108134.db2.gz BRMSWLVXYIJATC-VWLOTQADSA-N 2 0 401.639 4.281 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000428645622 857288113 /nfs/dbraw/zinc/28/81/13/857288113.db2.gz ZNKBAYAWPLPLTA-RCZVLFRGSA-N 2 0 419.613 4.316 20 0 HIADRP c1cc(C[NH+]2CCOC[C@H](C3CCC3)C2)cc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)c1 ZINC000428998719 857449891 /nfs/dbraw/zinc/44/98/91/857449891.db2.gz DGNLJEUBCHXZPW-WMPKNSHKSA-N 2 0 412.618 4.184 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429422410 857657265 /nfs/dbraw/zinc/65/72/65/857657265.db2.gz XCMKEXLVKMGSPT-AOYPEHQESA-N 2 0 404.529 4.466 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429422414 857657546 /nfs/dbraw/zinc/65/75/46/857657546.db2.gz XCMKEXLVKMGSPT-RSXGOPAZSA-N 2 0 404.529 4.466 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](Cc3ccccc3F)c3ccccc3)cn2)CC1 ZINC000429515164 857710998 /nfs/dbraw/zinc/71/09/98/857710998.db2.gz AZEOPLRWPWZCFQ-RUZDIDTESA-N 2 0 418.560 4.436 20 0 HIADRP CC[NH+](CC)CCO[C@H]1CCN([C@@H](c2nc(-c3ccccc3)no2)c2ccccc2)C1 ZINC000430000683 857990378 /nfs/dbraw/zinc/99/03/78/857990378.db2.gz PKGSUSRHGKYDCV-XZOQPEGZSA-N 2 0 420.557 4.259 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)C2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000430620732 858238596 /nfs/dbraw/zinc/23/85/96/858238596.db2.gz BQAXPVZAGMTFGU-BWKNWUBXSA-N 2 0 405.586 4.068 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000430642077 858244489 /nfs/dbraw/zinc/24/44/89/858244489.db2.gz UPZXOBRNGVKJCA-QUCCMNQESA-N 2 0 405.542 4.277 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3coc(-c4cccs4)n3)CC2)CC1 ZINC000430913372 858367808 /nfs/dbraw/zinc/36/78/08/858367808.db2.gz UQQCLMOQRKFUTA-UHFFFAOYSA-N 3 0 402.608 4.031 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CCOc3ccc4ccccc4c3)CC2)CC1 ZINC000430913609 858367942 /nfs/dbraw/zinc/36/79/42/858367942.db2.gz WPLKPWWPMLBPAT-UHFFFAOYSA-N 2 0 409.618 4.347 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCC4)c1 ZINC000431352020 858575834 /nfs/dbraw/zinc/57/58/34/858575834.db2.gz RPKJIASOJGSQJF-RUZDIDTESA-N 2 0 424.585 4.136 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)N2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000431687239 858740032 /nfs/dbraw/zinc/74/00/32/858740032.db2.gz WOAXQCJQJUCXAX-UHFFFAOYSA-N 2 0 406.574 4.268 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000431695029 858743039 /nfs/dbraw/zinc/74/30/39/858743039.db2.gz VXWCOSYSNKHUBE-YMPZKCBVSA-N 2 0 424.589 4.159 20 0 HIADRP C[C@@H]1C[N@H+](CCC[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CCCO1 ZINC000432361133 859121240 /nfs/dbraw/zinc/12/12/40/859121240.db2.gz YAOOTQGVRIMGAU-HXUWFJFHSA-N 2 0 422.548 4.269 20 0 HIADRP C[C@H]1C[N@H+](CCC[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)CCCO1 ZINC000432364514 859122258 /nfs/dbraw/zinc/12/22/58/859122258.db2.gz JXMNVBJTIUSJOA-NRFANRHFSA-N 2 0 404.558 4.130 20 0 HIADRP COC[C@@H]1CCCC[NH+](Cc2cc(C[N@H+]3CCCC[C@@H](COC)C3)cc(OC)c2)C1 ZINC000432784017 859358318 /nfs/dbraw/zinc/35/83/18/859358318.db2.gz DUQAEYIIFTZCJP-FGZHOGPDSA-N 2 0 418.622 4.192 20 0 HIADRP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433077570 859512263 /nfs/dbraw/zinc/51/22/63/859512263.db2.gz ORJHTAUXDCGILV-XUZZJYLKSA-N 2 0 405.586 4.035 20 0 HIADRP COc1cc(C[NH+]2CCC[C@@](C)(OC)CC2)cc(C[N@@H+]2CCC[C@@](C)(OC)CC2)c1 ZINC000433201030 859564455 /nfs/dbraw/zinc/56/44/55/859564455.db2.gz KIGNACVVSPIUTC-JWQCQUIFSA-N 2 0 418.622 4.477 20 0 HIADRP COc1cc(C[NH+](C)Cc2cnccc2C)cc(C[N@H+](C)Cc2cnccc2C)c1 ZINC000433203045 859564750 /nfs/dbraw/zinc/56/47/50/859564750.db2.gz VZSAALMYKNEIFG-UHFFFAOYSA-N 2 0 404.558 4.366 20 0 HIADRP C[C@@H]1CN(c2cc[nH+]c3ccc(Oc4ccccc4)cc32)CC[C@H]1[NH+]1CCN(C)CC1 ZINC000433756411 859877847 /nfs/dbraw/zinc/87/78/47/859877847.db2.gz CCMXRAHVXDMMAW-CJFMBICVSA-N 2 0 416.569 4.489 20 0 HIADRP C[C@@H]([NH2+]CCCN1CC[N@H+](C)C[C@@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000467738099 881540931 /nfs/dbraw/zinc/54/09/31/881540931.db2.gz RFFQOPMAJFYUMV-NVXWUHKLSA-N 2 0 412.525 4.191 20 0 HIADRP COc1cc(Cl)c(C)cc1NC(=O)CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000434747561 860479935 /nfs/dbraw/zinc/47/99/35/860479935.db2.gz RDMYVVFVFGSGRS-UHFFFAOYSA-N 2 0 416.953 4.008 20 0 HIADRP CN(c1ccccc1)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cn1 ZINC000435783648 861058130 /nfs/dbraw/zinc/05/81/30/861058130.db2.gz WZYZIRRGBXEKGQ-RUZDIDTESA-N 2 0 416.569 4.096 20 0 HIADRP CCSc1ccc(Cl)cc1NC(=O)N(CC[NH+](C)C)C[C@H]1CCC[N@@H+]1CC ZINC000438044072 863405459 /nfs/dbraw/zinc/40/54/59/863405459.db2.gz YAENFYKPUZJGPE-QGZVFWFLSA-N 2 0 413.031 4.332 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2nc(C3CC3)sc2c1 ZINC000438097458 863503326 /nfs/dbraw/zinc/50/33/26/863503326.db2.gz TYCGUPBHLFFRMG-SFHVURJKSA-N 2 0 415.607 4.054 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)cc1OC ZINC000467834673 881668756 /nfs/dbraw/zinc/66/87/56/881668756.db2.gz LVUDOJGMBQTVEI-OAQYLSRUSA-N 2 0 411.590 4.265 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NC[C@@H]1CCC[N@@H+]1C1CCCCC1 ZINC000438146206 863566550 /nfs/dbraw/zinc/56/65/50/863566550.db2.gz FLRPFENEBCFJHC-QHCPKHFHSA-N 2 0 400.611 4.077 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NC[C@H]2CCC[NH+]2C2CCCCC2)[C@@H]1c1cccs1 ZINC000438159579 863580195 /nfs/dbraw/zinc/58/01/95/863580195.db2.gz YITBVEIFQPXJSJ-SYYKKAFVSA-N 2 0 418.651 4.227 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)NC[C@H]2CCC[N@@H+]2C2CCCCC2)CC1 ZINC000438345278 863815322 /nfs/dbraw/zinc/81/53/22/863815322.db2.gz LWFYLHULPWZBME-XMMPIXPASA-N 2 0 412.622 4.090 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000467860260 881710594 /nfs/dbraw/zinc/71/05/94/881710594.db2.gz YZYYWXWACLZJJO-ROUUACIJSA-N 2 0 415.553 4.397 20 0 HIADRP O=C(C[NH2+][C@@H](CCCc1ccccc1)c1ccccc1)NC1CC[NH+](C2CC2)CC1 ZINC000438768334 864262724 /nfs/dbraw/zinc/26/27/24/864262724.db2.gz DHHMKGCFPCZVLF-VWLOTQADSA-N 2 0 405.586 4.083 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(CN3CCCC3=O)cc2)CC1 ZINC000438835532 864329087 /nfs/dbraw/zinc/32/90/87/864329087.db2.gz LARFZBFKLJKNPN-UHFFFAOYSA-N 2 0 405.586 4.342 20 0 HIADRP c1cc(C[NH+]2CCC([C@@H]3CCCO3)CC2)ccc1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000439295063 864719672 /nfs/dbraw/zinc/71/96/72/864719672.db2.gz GLAQJQKIEAAYQX-WMPKNSHKSA-N 2 0 412.618 4.469 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000439593791 864914897 /nfs/dbraw/zinc/91/48/97/864914897.db2.gz GWNXAVVDBGWXEL-QHCPKHFHSA-N 2 0 423.944 4.460 20 0 HIADRP Cc1ccccc1CN(C)C(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000439594295 864916251 /nfs/dbraw/zinc/91/62/51/864916251.db2.gz KMUHXAZXHADXIA-OAQYLSRUSA-N 2 0 419.569 4.357 20 0 HIADRP CC(=O)c1cccc(NC(=O)[C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c1 ZINC000439597796 864920424 /nfs/dbraw/zinc/92/04/24/864920424.db2.gz PGNXWZKVXMMSGP-SFHVURJKSA-N 2 0 419.525 4.231 20 0 HIADRP Cc1ccc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1NC(=O)CC[NH+](C)C ZINC000468038999 881868532 /nfs/dbraw/zinc/86/85/32/881868532.db2.gz NIXAREMRIIVUIW-NZQKXSOJSA-N 2 0 408.590 4.350 20 0 HIADRP O=C(NCC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000468045607 881873420 /nfs/dbraw/zinc/87/34/20/881873420.db2.gz WFJVHWDPLKTGKU-RUZDIDTESA-N 2 0 405.586 4.070 20 0 HIADRP CSc1ccccc1[C@H](C)[NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000440626912 865846404 /nfs/dbraw/zinc/84/64/04/865846404.db2.gz OUOKFYZONIYTPJ-KRWDZBQOSA-N 2 0 415.628 4.247 20 0 HIADRP O=C(C[NH2+]C1(c2cccc(C(F)(F)F)c2)CCCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000441017313 866085391 /nfs/dbraw/zinc/08/53/91/866085391.db2.gz XRXNFGFNMZPXIQ-UHFFFAOYSA-N 2 0 423.523 4.197 20 0 HIADRP Cc1ccccc1[C@H](OC[C@@H](O)C[N@H+](C)CC[C@@H]1CCCC[NH+]1C)c1ccccc1 ZINC000441364259 866434438 /nfs/dbraw/zinc/43/44/38/866434438.db2.gz ZACFCDUQCDNCID-KYPHJKQUSA-N 2 0 410.602 4.268 20 0 HIADRP COCCC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(F)cc1 ZINC000442787431 867675622 /nfs/dbraw/zinc/67/56/22/867675622.db2.gz APRNOKAXPLYUDX-DEOSSOPVSA-N 2 0 400.538 4.040 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(Oc4cccc(F)c4)cc3)cn2)CC1 ZINC000443970693 868500832 /nfs/dbraw/zinc/50/08/32/868500832.db2.gz RUNBSRPIJNCBHG-UHFFFAOYSA-N 2 0 406.505 4.055 20 0 HIADRP C(CN1CCN(CCC[NH+]2CCCCC2)C2(CCCCC2)C1)C[NH+]1CCCCC1 ZINC000444570810 868886391 /nfs/dbraw/zinc/88/63/91/868886391.db2.gz PPLOKUOFQKLUMD-UHFFFAOYSA-N 2 0 404.687 4.059 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)Nc2ccccc2CC[NH+](C)C)C1 ZINC000446573973 870484919 /nfs/dbraw/zinc/48/49/19/870484919.db2.gz YUEGXJBFQXGACI-FQEVSTJZSA-N 2 0 408.590 4.344 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000446589483 870497541 /nfs/dbraw/zinc/49/75/41/870497541.db2.gz AOHCGGVEPCXAKY-UHFFFAOYSA-N 2 0 408.590 4.167 20 0 HIADRP COC(=O)c1ccc(COc2ccccc2C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446885238 870805024 /nfs/dbraw/zinc/80/50/24/870805024.db2.gz UFTAYOACAMAQLY-UHFFFAOYSA-N 2 0 408.542 4.016 20 0 HIADRP C[NH+](C)Cc1ccsc1C(=O)NCCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000446910598 870827364 /nfs/dbraw/zinc/82/73/64/870827364.db2.gz BRRBMIVJDDDFSX-UHFFFAOYSA-N 2 0 413.631 4.274 20 0 HIADRP COc1ccc([C@@H](CCn2cncn2)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1 ZINC000446938554 870848507 /nfs/dbraw/zinc/84/85/07/870848507.db2.gz WYILERGOGDQUMN-UBVWURDFSA-N 2 0 411.594 4.051 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H](Cc3ccc(F)cc3)c3ccccc3)ccn2)CC1 ZINC000447530058 871393406 /nfs/dbraw/zinc/39/34/06/871393406.db2.gz NCQRALKPTJHHRI-DEOSSOPVSA-N 2 0 404.533 4.046 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000448212158 872112372 /nfs/dbraw/zinc/11/23/72/872112372.db2.gz GUPDIBAXYQJKNO-JHMXWDHMSA-N 2 0 424.633 4.077 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000448212160 872112546 /nfs/dbraw/zinc/11/25/46/872112546.db2.gz GUPDIBAXYQJKNO-QFZRFWILSA-N 2 0 424.633 4.077 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000448218840 872124381 /nfs/dbraw/zinc/12/43/81/872124381.db2.gz WLLJSNMDIDLTCS-PBXXJUDPSA-N 2 0 424.633 4.219 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC(CC)(CC)[NH2+][C@@H](C)c2ccccc2)[C@H](C)C1 ZINC000448524980 872521714 /nfs/dbraw/zinc/52/17/14/872521714.db2.gz MQSVKSAOWQZFOX-URVUXULASA-N 2 0 402.627 4.268 20 0 HIADRP CCC(CC)(CNC(=O)NCC1(SC)CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000460224576 872810185 /nfs/dbraw/zinc/81/01/85/872810185.db2.gz CNCDFFCEKHAPDN-IBGZPJMESA-N 2 0 420.667 4.023 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+]Cc2ccccc2Oc2ccc(F)cc2Cl)CC1 ZINC000461428221 874464283 /nfs/dbraw/zinc/46/42/83/874464283.db2.gz MOBKYGWVFKIXBA-UHFFFAOYSA-N 2 0 405.945 4.387 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)[C@@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)CC1 ZINC000462092140 875201574 /nfs/dbraw/zinc/20/15/74/875201574.db2.gz WEMIDXFWWJQIJB-HXUWFJFHSA-N 2 0 413.528 4.469 20 0 HIADRP Cc1cc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)ccc1-n1cncn1 ZINC000462748190 875815310 /nfs/dbraw/zinc/81/53/10/875815310.db2.gz BUDMYYAYUGCLKS-UHFFFAOYSA-N 2 0 417.601 4.400 20 0 HIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000462801859 875850046 /nfs/dbraw/zinc/85/00/46/875850046.db2.gz DRLDKHQHLBSHDY-IBGZPJMESA-N 2 0 405.590 4.161 20 0 HIADRP C[C@H](CCN1CCOCC1)[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462817212 875858973 /nfs/dbraw/zinc/85/89/73/875858973.db2.gz NEPPSXLUEIXMCE-QPPBQGQZSA-N 2 0 405.602 4.079 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+]C2CCN(C(=O)C3CC3)CC2)c2ccc(F)cc2)CC1 ZINC000462883764 875910576 /nfs/dbraw/zinc/91/05/76/875910576.db2.gz NLTWKRNRWNLBOF-DEOSSOPVSA-N 2 0 415.597 4.370 20 0 HIADRP C[C@@H]1C[C@H](NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000463238031 876295383 /nfs/dbraw/zinc/29/53/83/876295383.db2.gz NDLQFDPXDBPBDG-UGCZDOJFSA-N 2 0 409.540 4.434 20 0 HIADRP COc1cccc([C@H]2[C@H](NC3CC[NH+](CCc4ccccc4)CC3)CC[N@@H+]2C2CC2)c1 ZINC000463280360 876338516 /nfs/dbraw/zinc/33/85/16/876338516.db2.gz LNIYIHUFYOPNFH-SXOMAYOGSA-N 2 0 419.613 4.270 20 0 HIADRP COc1cccc(N2CCC[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000463285891 876344351 /nfs/dbraw/zinc/34/43/51/876344351.db2.gz UUORXWHMYUAVCI-GTSJCLCLSA-N 2 0 405.586 4.449 20 0 HIADRP COc1cccc([C@H](C)N2CCN(C(=O)c3oc4ccccc4c3C[NH+](C)C)CC2)c1 ZINC000468992123 883059241 /nfs/dbraw/zinc/05/92/41/883059241.db2.gz OYWAGYFKHJJFPC-SFHVURJKSA-N 2 0 421.541 4.022 20 0 HIADRP COc1ccc(Cn2nc(C)c(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)c2C)cc1 ZINC000463739156 876859967 /nfs/dbraw/zinc/85/99/67/876859967.db2.gz MCORASIMBBBJJO-UHFFFAOYSA-N 2 0 418.585 4.442 20 0 HIADRP CCC[N@H+](CCc1cccs1)CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000464576434 877799874 /nfs/dbraw/zinc/79/98/74/877799874.db2.gz KHTCZXLLTFWEDJ-UHFFFAOYSA-N 2 0 413.631 4.092 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)cc1 ZINC000464904793 878218853 /nfs/dbraw/zinc/21/88/53/878218853.db2.gz PFTQVVYSZRCKDU-QFIPXVFZSA-N 2 0 423.601 4.144 20 0 HIADRP C[C@H]1CCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000465444447 878874317 /nfs/dbraw/zinc/87/43/17/878874317.db2.gz RDKDLIBNVUASAB-DHLKQENFSA-N 2 0 420.601 4.130 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCc1ccc(C[NH+]3CCCC[C@@H]3C)cc1)CC2 ZINC000465554177 879021391 /nfs/dbraw/zinc/02/13/91/879021391.db2.gz TUHAWHCYTZKCEF-ZTCOLXNVSA-N 2 0 412.622 4.218 20 0 HIADRP CCC(CC)[C@H](CNC(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)[NH+]1CCCC1 ZINC000465564730 879037408 /nfs/dbraw/zinc/03/74/08/879037408.db2.gz IGOYKFOIESXZFQ-JAXLGGSGSA-N 2 0 420.667 4.331 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000465580227 879059962 /nfs/dbraw/zinc/05/99/62/879059962.db2.gz YNZZLXXVFSRFGF-CWAQXLGLSA-N 2 0 420.601 4.230 20 0 HIADRP C[C@@H]1CCN(C(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000465607278 879100504 /nfs/dbraw/zinc/10/05/04/879100504.db2.gz UJQMVZNFOMTWPC-RCZVLFRGSA-N 2 0 420.601 4.130 20 0 HIADRP CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)NCc1ccccc1C[NH+]1CCCCCC1 ZINC000465926299 879589604 /nfs/dbraw/zinc/58/96/04/879589604.db2.gz POBADQNUOAPQBL-QHCPKHFHSA-N 2 0 400.611 4.078 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCC1([NH2+][C@H](C)c3ccccc3)CCCC1)CC2 ZINC000465934874 879598403 /nfs/dbraw/zinc/59/84/03/879598403.db2.gz YUTWOPNXZSPZQI-MZYLBHOOSA-N 2 0 412.622 4.307 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2c3ccccc3sc2C(=O)OC)CC1 ZINC000466722485 880509695 /nfs/dbraw/zinc/50/96/95/880509695.db2.gz KAWJJWUQAVCDQB-UHFFFAOYSA-N 2 0 404.576 4.011 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2cccc(C(=O)Nc3ccccc3)c2)CC1 ZINC000467179514 880907927 /nfs/dbraw/zinc/90/79/27/880907927.db2.gz HEQRFTMIUJWZLW-UHFFFAOYSA-N 2 0 409.574 4.262 20 0 HIADRP c1ccc(-c2nc3ccccn3c2C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000467202084 880931677 /nfs/dbraw/zinc/93/16/77/880931677.db2.gz OJWQUDJNTSRIRN-UHFFFAOYSA-N 2 0 404.558 4.078 20 0 HIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000467341312 881092571 /nfs/dbraw/zinc/09/25/71/881092571.db2.gz DLCNQOCWRSGXAZ-BTYIYWSLSA-N 2 0 401.501 4.063 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CCSc4ccc(OC)cc43)cc2)CC1 ZINC000467419461 881209648 /nfs/dbraw/zinc/20/96/48/881209648.db2.gz QHVJMHQHGFTGEU-QHCPKHFHSA-N 2 0 411.615 4.159 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000469315802 883418580 /nfs/dbraw/zinc/41/85/80/883418580.db2.gz OMZXKZXBEQRDKR-QHCPKHFHSA-N 2 0 415.528 4.087 20 0 HIADRP CCC(CC)(CNC(=O)CC1([NH+]2CCOCC2)CCCC1)[NH2+][C@H](C)c1ccccc1 ZINC000469499218 883743203 /nfs/dbraw/zinc/74/32/03/883743203.db2.gz HHZKBEPPXUPVQC-OAQYLSRUSA-N 2 0 415.622 4.047 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000503766311 912819110 /nfs/dbraw/zinc/81/91/10/912819110.db2.gz RPLUSJZYGPEDDD-OAQYLSRUSA-N 2 0 422.617 4.422 20 0 HIADRP CN(C(=O)NCc1ccc(C[NH+]2CCCC2)cc1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470752296 885218264 /nfs/dbraw/zinc/21/82/64/885218264.db2.gz WWDQYWVTAATXDX-RUZDIDTESA-N 2 0 420.601 4.088 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)N2CC[C@H](C[N@H+](C)CC3CC3)C2)CCCC1)c1ccccc1 ZINC000470894786 885393863 /nfs/dbraw/zinc/39/38/63/885393863.db2.gz NCHMBTJTSDVJCM-RBBKRZOGSA-N 2 0 412.622 4.023 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NCc1cccc(C[NH+](C)C)c1)c1ccccc1Cl ZINC000504205368 913084695 /nfs/dbraw/zinc/08/46/95/913084695.db2.gz RQEFYKCZFUDTKS-QFIPXVFZSA-N 2 0 416.997 4.284 20 0 HIADRP CC(C)[NH+]1CCN(c2cccc(NC(=O)C3CC[NH+](Cc4ccccc4)CC3)c2)CC1 ZINC000504206893 913085777 /nfs/dbraw/zinc/08/57/77/913085777.db2.gz BVZZQDLOQHZUBW-UHFFFAOYSA-N 2 0 420.601 4.068 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000472498715 887367989 /nfs/dbraw/zinc/36/79/89/887367989.db2.gz LJWWIXCJFLBLKF-PHTYHVAFSA-N 2 0 419.613 4.171 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](CC2CCC(C(F)(F)F)CC2)CC1 ZINC000473039069 887861766 /nfs/dbraw/zinc/86/17/66/887861766.db2.gz VZQLGNLEPOXDQA-UHFFFAOYSA-N 2 0 417.560 4.059 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000473276245 888033220 /nfs/dbraw/zinc/03/32/20/888033220.db2.gz KATDYQKTLKDQCG-ZZYHAFTGSA-N 2 0 405.586 4.169 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)cc1)C1CC1 ZINC000473523927 888259815 /nfs/dbraw/zinc/25/98/15/888259815.db2.gz HJKQFENCVXUULV-UHFFFAOYSA-N 2 0 423.523 4.206 20 0 HIADRP CCN(C(=O)NC1CC[NH+](C(C)(C)C)CC1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473937239 888815879 /nfs/dbraw/zinc/81/58/79/888815879.db2.gz BCNOENKDIGLUNR-SIKLNZKXSA-N 2 0 400.611 4.116 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)NC1CC([NH+]2CCCCC2)C1)C1CCCCC1 ZINC000474140665 888963837 /nfs/dbraw/zinc/96/38/37/888963837.db2.gz FTWFIPFXEVEYKZ-UHFFFAOYSA-N 2 0 412.622 4.267 20 0 HIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000474610881 889475598 /nfs/dbraw/zinc/47/55/98/889475598.db2.gz DOIGNAAHUOKSEA-SFTDATJTSA-N 2 0 404.558 4.080 20 0 HIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000474815453 889667424 /nfs/dbraw/zinc/66/74/24/889667424.db2.gz YNMKRVGKAHLPMF-SJORKVTESA-N 2 0 416.635 4.005 20 0 HIADRP CCN(C(=O)NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475160115 890025423 /nfs/dbraw/zinc/02/54/23/890025423.db2.gz AHEGCQLRFKYKTN-DEOSSOPVSA-N 2 0 412.622 4.090 20 0 HIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC(NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)CC1 ZINC000475333879 890253525 /nfs/dbraw/zinc/25/35/25/890253525.db2.gz JQQRXUMGHXKBOM-AOUGCYQESA-N 2 0 401.561 4.424 20 0 HIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC(NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)CC1 ZINC000475333881 890254677 /nfs/dbraw/zinc/25/46/77/890254677.db2.gz JQQRXUMGHXKBOM-HSZSURFESA-N 2 0 401.561 4.424 20 0 HIADRP CC[NH+]1CCN(c2ccccc2C[NH+]2CCC(n3c(C)nc4ccccc43)CC2)CC1 ZINC000475503274 890415386 /nfs/dbraw/zinc/41/53/86/890415386.db2.gz REFWKEJBAOJSTB-UHFFFAOYSA-N 2 0 417.601 4.324 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NC2CC[NH+](C3CCCCC3)CC2)[NH+]2CCCC2)cc1 ZINC000475909952 890839030 /nfs/dbraw/zinc/83/90/30/890839030.db2.gz NWBJRDBOMKIZQS-DEOSSOPVSA-N 2 0 412.622 4.228 20 0 HIADRP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000475994427 890916884 /nfs/dbraw/zinc/91/68/84/890916884.db2.gz BFBALIWKOKQCDH-NRFANRHFSA-N 2 0 404.643 4.081 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000476006864 890935349 /nfs/dbraw/zinc/93/53/49/890935349.db2.gz OFUXPCFSOWBSDC-OAQYLSRUSA-N 2 0 412.622 4.090 20 0 HIADRP CC[C@@H](C)[NH2+][C@H](CNC(=O)NCc1ccccc1C[NH+]1CCCCC1)c1ccco1 ZINC000476948857 891886739 /nfs/dbraw/zinc/88/67/39/891886739.db2.gz CZZHPYBDAPVTAZ-DENIHFKCSA-N 2 0 412.578 4.194 20 0 HIADRP C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000476990648 891916066 /nfs/dbraw/zinc/91/60/66/891916066.db2.gz ADEHUUFJASEDBK-SFTDATJTSA-N 2 0 424.633 4.192 20 0 HIADRP O=C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)N1CC[NH+](CC2CCCCC2)CC1 ZINC000477273512 892223881 /nfs/dbraw/zinc/22/38/81/892223881.db2.gz BJKDQKVVTJBOOW-QILAJZQNSA-N 2 0 424.633 4.090 20 0 HIADRP COc1cc([C@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)ccc1F ZINC000504928018 913668248 /nfs/dbraw/zinc/66/82/48/913668248.db2.gz XXFLUOQRLCSVFI-SFHVURJKSA-N 2 0 416.537 4.175 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@H](c2cccs2)[NH+](C)C)CC1 ZINC000477603820 892684165 /nfs/dbraw/zinc/68/41/65/892684165.db2.gz COKPKSZIUSPCNO-AZUAARDMSA-N 2 0 406.640 4.037 20 0 HIADRP CN(C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000478220921 893381314 /nfs/dbraw/zinc/38/13/14/893381314.db2.gz AFRMBNDDNAMDSC-VSGJHWFKSA-N 2 0 420.601 4.182 20 0 HIADRP CC[C@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479069479 894332535 /nfs/dbraw/zinc/33/25/35/894332535.db2.gz YOFVEENBXVUFHF-DYVFJYSZSA-N 2 0 422.333 4.145 20 0 HIADRP C[C@H](C[NH2+][C@H](c1ccccc1)c1ccc(Br)cc1)CN1CC[NH+](C)CC1 ZINC000479269308 894542866 /nfs/dbraw/zinc/54/28/66/894542866.db2.gz KIPRULGLERJUSE-XMSQKQJNSA-N 2 0 416.407 4.012 20 0 HIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(Br)cc1C(F)(F)F)CN1CC[NH+](C)CC1 ZINC000479276586 894552025 /nfs/dbraw/zinc/55/20/25/894552025.db2.gz XPPJUXUAKRCDHO-KGLIPLIRSA-N 2 0 422.333 4.002 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H](c2ccc(Br)cc2F)C2CC2)CC1 ZINC000479333641 894627745 /nfs/dbraw/zinc/62/77/45/894627745.db2.gz WSRAQKHDMOPTFR-FQEVSTJZSA-N 2 0 412.391 4.047 20 0 HIADRP Brc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccccc1CN1CCOCC1 ZINC000479350894 894646729 /nfs/dbraw/zinc/64/67/29/894646729.db2.gz UQGZJSFUPKMNSE-QFIPXVFZSA-N 2 0 415.375 4.449 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CCc1cccc(OCC(F)(F)F)c1 ZINC000479523528 894832950 /nfs/dbraw/zinc/83/29/50/894832950.db2.gz QFTZMXPDGBGQGO-DYESRHJHSA-N 2 0 407.480 4.065 20 0 HIADRP C[NH+]1CCN(CCC[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000480159666 895547000 /nfs/dbraw/zinc/54/70/00/895547000.db2.gz DHYLIOLHCNFBTO-SFHVURJKSA-N 2 0 405.011 4.068 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(-n2cccn2)cc1 ZINC000480231698 895636824 /nfs/dbraw/zinc/63/68/24/895636824.db2.gz SQHSPVAZEQIEBA-NJYVYQBISA-N 2 0 404.558 4.332 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21)N1CC[NH+](C)CC1 ZINC000480523441 895887035 /nfs/dbraw/zinc/88/70/35/895887035.db2.gz HHKJPEOCWMLXQK-PZJWPPBQSA-N 2 0 416.610 4.188 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H](Cc1cccc(F)c1)c1cccc(F)c1)N1CC[NH+](C)CC1 ZINC000480539201 895902830 /nfs/dbraw/zinc/90/28/30/895902830.db2.gz JVOKSZFHPIJCNC-RPWUZVMVSA-N 2 0 401.545 4.110 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H](C)c1ccc(SCC(F)(F)F)cc1)N1CC[NH+](C)CC1 ZINC000480544321 895905619 /nfs/dbraw/zinc/90/56/19/895905619.db2.gz ZFRKWUHUYGGOMZ-LPHOPBHVSA-N 2 0 403.558 4.264 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480605297 895969425 /nfs/dbraw/zinc/96/94/25/895969425.db2.gz ZOWZDVKMCQFCKZ-RBUKOAKNSA-N 2 0 415.603 4.141 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000480617769 895984034 /nfs/dbraw/zinc/98/40/34/895984034.db2.gz VVIJKNZVFOJGHS-MOPGFXCFSA-N 2 0 415.603 4.141 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC[C@@H](C)C2)[C@@H](C)C1 ZINC000480617754 895984379 /nfs/dbraw/zinc/98/43/79/895984379.db2.gz VTMFXFBRQQDEIG-SLSDLSHTSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@H](c1ccc(Cl)cc1)N1CCc2sccc2C1 ZINC000480618093 895985800 /nfs/dbraw/zinc/98/58/00/895985800.db2.gz OJZBYAUAYCDTDX-TYCQWZJGSA-N 2 0 404.023 4.431 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C3CCN(Cc4ccccn4)CC3)cc2)C1 ZINC000480706031 896068446 /nfs/dbraw/zinc/06/84/46/896068446.db2.gz NWLJSNDPRVBPRO-SZPZYZBQSA-N 2 0 406.618 4.314 20 0 HIADRP Cc1ccc(OCCCC(=O)Nc2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000480708233 896071295 /nfs/dbraw/zinc/07/12/95/896071295.db2.gz IKRXTEBKNJUQKC-NZQKXSOJSA-N 2 0 409.574 4.365 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3ccc(SC)c(OC)c3)cc2)CC1 ZINC000480722321 896082395 /nfs/dbraw/zinc/08/23/95/896082395.db2.gz OVRQOJRAWBMCRA-IBGZPJMESA-N 2 0 413.631 4.405 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3ccc(OC(F)F)cc3)cc2)CC1 ZINC000480732900 896094364 /nfs/dbraw/zinc/09/43/64/896094364.db2.gz SUJFEUCFVJENMV-SFHVURJKSA-N 2 0 403.517 4.276 20 0 HIADRP C[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000480735680 896096720 /nfs/dbraw/zinc/09/67/20/896096720.db2.gz YEPAFRLYMGEUFA-HOTGVXAUSA-N 2 0 423.388 4.086 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(SCC(F)F)cc3)cn2)CC1 ZINC000480742012 896103153 /nfs/dbraw/zinc/10/31/53/896103153.db2.gz PXFJOYWMNQKSML-KRWDZBQOSA-N 2 0 420.573 4.432 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2cnn(-c3ccc(Cl)cc3Cl)c2C)CC1 ZINC000480777496 896143079 /nfs/dbraw/zinc/14/30/79/896143079.db2.gz VLUCHSWRDLEJOS-INIZCTEOSA-N 2 0 424.420 4.166 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c2ccccc12 ZINC000480898194 896254172 /nfs/dbraw/zinc/25/41/72/896254172.db2.gz HHYNQFZWDHKLDX-HXUWFJFHSA-N 2 0 403.570 4.447 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H](O)COc1c(Cl)cccc1Cl ZINC000481179093 896517947 /nfs/dbraw/zinc/51/79/47/896517947.db2.gz ULTALLRTGPXKBS-PLMTUMEDSA-N 2 0 423.384 4.233 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1OCCN1CCOCC1)c1cccc(-c2ccncc2)c1 ZINC000481199939 896552570 /nfs/dbraw/zinc/55/25/70/896552570.db2.gz GLRIWQKYQIMQMT-NRFANRHFSA-N 2 0 417.553 4.310 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1OCCN1CCOCC1)c1cccc(OC(F)(F)F)c1 ZINC000481203400 896557130 /nfs/dbraw/zinc/55/71/30/896557130.db2.gz MYCDVAGQYALZLD-KRWDZBQOSA-N 2 0 424.463 4.147 20 0 HIADRP C[C@@H]([NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000481294592 896640304 /nfs/dbraw/zinc/64/03/04/896640304.db2.gz LJNPBQAVJJYFGV-GOSISDBHSA-N 2 0 417.544 4.220 20 0 HIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)[C@@H]1C[N@@H+](C(C)(C)C)C[C@H]1C(F)(F)F ZINC000481504760 896876510 /nfs/dbraw/zinc/87/65/10/896876510.db2.gz KHWNOOTVGYXMEL-QZTJIDSGSA-N 2 0 411.512 4.438 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000481546489 896910447 /nfs/dbraw/zinc/91/04/47/896910447.db2.gz QSAFCPDYEWLNFI-IBGZPJMESA-N 2 0 415.603 4.011 20 0 HIADRP CC1(C)CC[C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)c2ccccc21 ZINC000481653368 897038358 /nfs/dbraw/zinc/03/83/58/897038358.db2.gz BFRXFHCXVFYFPN-XMMPIXPASA-N 2 0 405.586 4.415 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)[C@@H](C)C1 ZINC000481727173 897121958 /nfs/dbraw/zinc/12/19/58/897121958.db2.gz PGVVRCSEDPNYQT-DHLKQENFSA-N 3 0 401.639 4.289 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000481731780 897125156 /nfs/dbraw/zinc/12/51/56/897125156.db2.gz DNDZBKDJBBYZAY-BKMJKUGQSA-N 2 0 406.618 4.458 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(Cn3cnc4ccccc43)cc2)[C@H](C)C1 ZINC000481733155 897127519 /nfs/dbraw/zinc/12/75/19/897127519.db2.gz GUVNHFHQHAOVIF-ZJSXRUAMSA-N 2 0 420.601 4.311 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1 ZINC000482111366 897561885 /nfs/dbraw/zinc/56/18/85/897561885.db2.gz BGKOEIUGJLRWAU-NBGIEHNGSA-N 2 0 414.553 4.334 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000482113982 897564804 /nfs/dbraw/zinc/56/48/04/897564804.db2.gz ZYEYSHJOZIMZTJ-LJQANCHMSA-N 2 0 418.541 4.125 20 0 HIADRP C[C@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1nc(-c2ccccc2)cs1 ZINC000482131472 897589043 /nfs/dbraw/zinc/58/90/43/897589043.db2.gz WTTBDQRCDLUQKR-IBGZPJMESA-N 2 0 407.587 4.068 20 0 HIADRP COC(=O)c1ccc(Cl)c(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000482247859 897729608 /nfs/dbraw/zinc/72/96/08/897729608.db2.gz VQBZWFKCFVZMLV-CALCHBBNSA-N 2 0 416.949 4.026 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(-n2cncn2)cc1Cl ZINC000482452340 898019486 /nfs/dbraw/zinc/01/94/86/898019486.db2.gz ATNKQUGJDDLJCY-QGZVFWFLSA-N 2 0 413.953 4.102 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000482483034 898060205 /nfs/dbraw/zinc/06/02/05/898060205.db2.gz IMXABRNKNRIDJU-MAUKXSAKSA-N 2 0 400.394 4.070 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000482513900 898099957 /nfs/dbraw/zinc/09/99/57/898099957.db2.gz UGRYVIGVCVJQPQ-YADARESESA-N 2 0 401.545 4.112 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000482548333 898138634 /nfs/dbraw/zinc/13/86/34/898138634.db2.gz ASGPBPAZFSTEOG-IBGZPJMESA-N 2 0 415.603 4.141 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)[C@H](C)C1 ZINC000482551517 898141774 /nfs/dbraw/zinc/14/17/74/898141774.db2.gz CWRGKUSDQKFIRM-RCZVLFRGSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(-c2ccccc2Br)s1)N1CC[NH+](C)CC1 ZINC000482555048 898145839 /nfs/dbraw/zinc/14/58/39/898145839.db2.gz JAENIMASJBWTRD-CVEARBPZSA-N 2 0 422.436 4.464 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2cccc(NC(C)=O)c2)CC1 ZINC000482556315 898147372 /nfs/dbraw/zinc/14/73/72/898147372.db2.gz RYRKBZKBJLZISG-ZWKOTPCHSA-N 2 0 412.553 4.338 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(F)c(Br)c1 ZINC000482557694 898149105 /nfs/dbraw/zinc/14/91/05/898149105.db2.gz SBGXBJQREPTBID-OAHLLOKOSA-N 2 0 421.354 4.396 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1 ZINC000482569964 898163617 /nfs/dbraw/zinc/16/36/17/898163617.db2.gz RMSZAYKWRBZTBK-RHSMWYFYSA-N 2 0 421.010 4.010 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H]2CCCc3nc(C)sc32)CC1 ZINC000482568638 898164185 /nfs/dbraw/zinc/16/41/85/898164185.db2.gz HYAVBDOGOCKCML-KXBFYZLASA-N 2 0 402.583 4.461 20 0 HIADRP O=C(NC1CC[NH+](C2CCCC2)CC1)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000482613712 898215527 /nfs/dbraw/zinc/21/55/27/898215527.db2.gz DKYKMRFLXOKENE-RDGATRHJSA-N 2 0 424.633 4.090 20 0 HIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000482634368 898238885 /nfs/dbraw/zinc/23/88/85/898238885.db2.gz SLCVHXUWGURGRC-XXBNENTESA-N 2 0 409.574 4.022 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCCc2ccc(Br)cc2F)[C@H](C)C1 ZINC000483176189 898842540 /nfs/dbraw/zinc/84/25/40/898842540.db2.gz CGWGPNSNXCNBIX-OXQOHEQNSA-N 2 0 415.391 4.247 20 0 HIADRP C[C@@H](NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000483375833 899011802 /nfs/dbraw/zinc/01/18/02/899011802.db2.gz JACXYBOJKMLWCE-RDGATRHJSA-N 2 0 419.613 4.316 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC2CC[NH+](C3CCCC3)CC2)cc1 ZINC000483695762 899351889 /nfs/dbraw/zinc/35/18/89/899351889.db2.gz BWBGJUBKKVURHU-FQEVSTJZSA-N 2 0 412.622 4.267 20 0 HIADRP O=C(NC1CC[NH+](C2CCCC2)CC1)N1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000483991225 899632028 /nfs/dbraw/zinc/63/20/28/899632028.db2.gz ZDJUCSOGKLCSJW-SANMLTNESA-N 2 0 424.633 4.091 20 0 HIADRP CC[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccccc1Br ZINC000484285204 899851918 /nfs/dbraw/zinc/85/19/18/899851918.db2.gz VJMCLMPLXCMJEK-IBGZPJMESA-N 2 0 424.427 4.117 20 0 HIADRP COc1ccc2oc([C@H](C)[NH2+]CC3CC[NH+](CC(=O)NC(C)(C)C)CC3)c(C)c2c1 ZINC000484292339 899856616 /nfs/dbraw/zinc/85/66/16/899856616.db2.gz CUUDBQPXORCOBW-KRWDZBQOSA-N 2 0 415.578 4.027 20 0 HIADRP Cc1c([C@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000484488041 899980084 /nfs/dbraw/zinc/98/00/84/899980084.db2.gz DRZHECRXADYFHT-HNNXBMFYSA-N 2 0 424.420 4.164 20 0 HIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000484501367 899992609 /nfs/dbraw/zinc/99/26/09/899992609.db2.gz VNGCYFPDPKMUMX-HXUWFJFHSA-N 2 0 409.574 4.367 20 0 HIADRP C[NH+](C)C[C@H]1CCN(C(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000484723789 900153200 /nfs/dbraw/zinc/15/32/00/900153200.db2.gz BSCVMFGVGPSPTA-JOCHJYFZSA-N 2 0 420.601 4.043 20 0 HIADRP CN(c1ccccc1)C1CC[NH+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC1 ZINC000512383913 921120717 /nfs/dbraw/zinc/12/07/17/921120717.db2.gz HEQGWLLDLNKJBC-UHFFFAOYSA-N 2 0 406.618 4.318 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000505919636 914566580 /nfs/dbraw/zinc/56/65/80/914566580.db2.gz TXDJLMYFVZTVTH-YMPZKCBVSA-N 2 0 415.597 4.151 20 0 HIADRP c1cc(C[NH+]2CCC[C@H]([C@@H]3CCOC3)C2)cc(C[N@@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000487904968 902442214 /nfs/dbraw/zinc/44/22/14/902442214.db2.gz CZSUZPGGZRMYBW-XDZVQPMWSA-N 2 0 412.618 4.184 20 0 HIADRP c1cc(C[NH+]2CCC[C@H]([C@@H]3CCOC3)C2)cc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000487904966 902442608 /nfs/dbraw/zinc/44/26/08/902442608.db2.gz CZSUZPGGZRMYBW-QEGGNFSNSA-N 2 0 412.618 4.184 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccn(-c2ccc(F)cc2F)n1 ZINC000487939299 902469136 /nfs/dbraw/zinc/46/91/36/902469136.db2.gz AFAYJEYVSBVWJO-UHFFFAOYSA-N 2 0 411.500 4.284 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)Nc3ccn(C4CC[NH+](C)CC4)n3)c2)CC1 ZINC000488602506 902895847 /nfs/dbraw/zinc/89/58/47/902895847.db2.gz VKJUNOYWVJNDGA-UHFFFAOYSA-N 2 0 424.593 4.068 20 0 HIADRP O=C(Nc1ccc(OCC[NH+]2CCCCC2)cc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000489272150 903299515 /nfs/dbraw/zinc/29/95/15/903299515.db2.gz UFBQECXKIPQVBS-UHFFFAOYSA-N 2 0 421.585 4.402 20 0 HIADRP Clc1cccc(-c2nc(C[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)co2)c1 ZINC000506028095 914709382 /nfs/dbraw/zinc/70/93/82/914709382.db2.gz QDOREMXHNNNAPO-UHFFFAOYSA-N 2 0 403.954 4.319 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000489436814 903383044 /nfs/dbraw/zinc/38/30/44/903383044.db2.gz MKENPEJVFZAHNP-PXDATVDWSA-N 2 0 422.617 4.238 20 0 HIADRP CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506032017 914715426 /nfs/dbraw/zinc/71/54/26/914715426.db2.gz OISBKLWLUQOZCC-NHCUHLMSSA-N 2 0 415.622 4.352 20 0 HIADRP CC(C)[C@@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[NH+]1CCC(C)CC1 ZINC000489864055 903638031 /nfs/dbraw/zinc/63/80/31/903638031.db2.gz JVBLDKZROJKPIK-XMMPIXPASA-N 2 0 414.638 4.049 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000489886305 903653105 /nfs/dbraw/zinc/65/31/05/903653105.db2.gz LWNZGJFYGXQVJX-UHFFFAOYSA-N 2 0 420.601 4.088 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 ZINC000490168751 903806821 /nfs/dbraw/zinc/80/68/21/903806821.db2.gz ZHVZBVXXJZLICY-GAJHUEQPSA-N 2 0 419.585 4.392 20 0 HIADRP C[C@H](NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000490828621 904272122 /nfs/dbraw/zinc/27/21/22/904272122.db2.gz QKCCSFCKMWUQHF-TUACAJSNSA-N 2 0 423.576 4.065 20 0 HIADRP CCOc1ccc([C@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2ccccc2Cl)cc1 ZINC000491011555 904367904 /nfs/dbraw/zinc/36/79/04/904367904.db2.gz WACUCMLVCLXUNK-DEOSSOPVSA-N 2 0 416.009 4.445 20 0 HIADRP C[NH+]1CCC(CC[NH2+][C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491009694 904368600 /nfs/dbraw/zinc/36/86/00/904368600.db2.gz RDTNOGSLYMWHOS-QFIPXVFZSA-N 2 0 421.006 4.154 20 0 HIADRP CCC[NH+]1CCC(C[NH2+][C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491012725 904369259 /nfs/dbraw/zinc/36/92/59/904369259.db2.gz YLLAXUYHSBEIJZ-QHCPKHFHSA-N 2 0 418.578 4.030 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@H](O)CO[C@@H]2CCCc3ccccc32)CC1 ZINC000491029208 904380673 /nfs/dbraw/zinc/38/06/73/904380673.db2.gz QLWXEPMJSNFGON-AHKZPQOWSA-N 2 0 422.613 4.286 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cc(Br)cs1 ZINC000493882142 905240925 /nfs/dbraw/zinc/24/09/25/905240925.db2.gz HLYKUIHMBGOYDE-CQSZACIVSA-N 2 0 409.393 4.318 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(Br)c(Cl)c3)cc2)CC1 ZINC000494372336 905670078 /nfs/dbraw/zinc/67/00/78/905670078.db2.gz WBHFUJLVDPAGHC-UHFFFAOYSA-N 2 0 422.798 4.140 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000494598788 905856468 /nfs/dbraw/zinc/85/64/68/905856468.db2.gz FSMKQMOYWDXFFA-RUZDIDTESA-N 2 0 420.601 4.136 20 0 HIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]C1CC[NH+]([C@@H]3CCCC[C@@H]3O)CC1)CC2 ZINC000494647880 905881448 /nfs/dbraw/zinc/88/14/48/905881448.db2.gz NIZTWHFVYDHEFM-AQNXPRMDSA-N 2 0 407.396 4.102 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc2C1 ZINC000494945571 906115838 /nfs/dbraw/zinc/11/58/38/906115838.db2.gz ATHJIRBXYBANPZ-CHZKFRDHSA-N 2 0 405.586 4.370 20 0 HIADRP c1nnc([C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C2CCCCC2)[nH]1 ZINC000495071094 906221360 /nfs/dbraw/zinc/22/13/60/906221360.db2.gz BGJNPCXMXZNFPA-HSZRJFAPSA-N 2 0 411.594 4.087 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccc(C(=O)N(C)C)cc1 ZINC000495076415 906223569 /nfs/dbraw/zinc/22/35/69/906223569.db2.gz AJTLBVGYSWCVPL-LJQANCHMSA-N 2 0 405.542 4.464 20 0 HIADRP C[C@@H]([NH2+]C1CCN(CCc2ccc(F)cc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495416399 906437753 /nfs/dbraw/zinc/43/77/53/906437753.db2.gz ZMYQNNAQNZJLLK-ZJSXRUAMSA-N 2 0 409.593 4.333 20 0 HIADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1OCC(=O)N(C)C ZINC000495438304 906451679 /nfs/dbraw/zinc/45/16/79/906451679.db2.gz GWMLXJGCGSXBIB-BKULYWANSA-N 2 0 423.601 4.105 20 0 HIADRP CC[C@@H](C)[NH2+][C@H](CNC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccco1 ZINC000496649843 906729660 /nfs/dbraw/zinc/72/96/60/906729660.db2.gz JSVQGVQNEHZRRP-YXPZWWFCSA-N 2 0 424.589 4.204 20 0 HIADRP Cc1cc(C)n(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]4C[N@H+](Cc5ccccc5)C[C@H]43)cn2)n1 ZINC000512625386 921266840 /nfs/dbraw/zinc/26/68/40/921266840.db2.gz NVRQIPLCPLQQTE-UBFVSLLYSA-N 2 0 415.585 4.274 20 0 HIADRP O=C(C1CCC1)N(CCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)C1CC1 ZINC000512641953 921270994 /nfs/dbraw/zinc/27/09/94/921270994.db2.gz LJNZZGLHIDGWHQ-ZKMPZPQNSA-N 2 0 409.618 4.058 20 0 HIADRP CCC(CC)C(=O)N1CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000512653439 921275745 /nfs/dbraw/zinc/27/57/45/921275745.db2.gz FJDUPPAUMPTTFY-ICDZXHCJSA-N 2 0 411.634 4.304 20 0 HIADRP O=C(CCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21)N1Cc2ccccc2C1 ZINC000512659663 921278357 /nfs/dbraw/zinc/27/83/57/921278357.db2.gz JCCZEDNEZFJQCL-TWJOJJKGSA-N 2 0 417.597 4.199 20 0 HIADRP c1cn(Cc2ccccc2C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000512660440 921278782 /nfs/dbraw/zinc/27/87/82/921278782.db2.gz NFTPFLKPAJSYBI-KKUQBAQOSA-N 2 0 400.570 4.322 20 0 HIADRP CC[NH+](CC)CCN(Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512693736 921289774 /nfs/dbraw/zinc/28/97/74/921289774.db2.gz KKCHLTGTOCUOMT-JTHBVZDNSA-N 2 0 414.638 4.193 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000497701508 907205603 /nfs/dbraw/zinc/20/56/03/907205603.db2.gz SPVACHQWDJZDRT-XMMPIXPASA-N 2 0 412.622 4.223 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H]3CC=C(c4ccc(F)cc4)CC3)c2)C1 ZINC000497834974 907315825 /nfs/dbraw/zinc/31/58/25/907315825.db2.gz BHRKFCYOLRMQIJ-NOZRDPDXSA-N 2 0 421.560 4.249 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]C3c4ccccc4-c4ccccc43)c2)C1 ZINC000497834915 907317011 /nfs/dbraw/zinc/31/70/11/907317011.db2.gz ASRIOKXLNGTFIW-OAQYLSRUSA-N 2 0 411.549 4.244 20 0 HIADRP CCCN(CC[NH+]1CCCCC1)C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000498029759 907533194 /nfs/dbraw/zinc/53/31/94/907533194.db2.gz USZMBMDQWWXTIC-FPOVZHCZSA-N 2 0 406.640 4.039 20 0 HIADRP CCN(CC[NH+]1CCCCCC1)C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000498042426 907550136 /nfs/dbraw/zinc/55/01/36/907550136.db2.gz BGCLJNBFUMIXMJ-TZIWHRDSSA-N 2 0 406.640 4.039 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CCC[C@H]3C[N@H+](C)CC[C@H]32)cc1 ZINC000498122937 907636015 /nfs/dbraw/zinc/63/60/15/907636015.db2.gz BJLYVCWXAVMANL-UKILVPOCSA-N 2 0 420.601 4.041 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@@H](C)[C@H]2CC[NH+](Cc3ccccc3)C2)CC1 ZINC000498724002 908149239 /nfs/dbraw/zinc/14/92/39/908149239.db2.gz ZFAZNFLOBPIHFH-URXFXBBRSA-N 2 0 414.638 4.051 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@@H](C)[C@@H]2CC[NH+](Cc3ccccc3)C2)CC1 ZINC000498724003 908149950 /nfs/dbraw/zinc/14/99/50/908149950.db2.gz ZFAZNFLOBPIHFH-XUZZJYLKSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@H]1CN(Cc2cccc(C[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2)CCO1 ZINC000499144125 908502010 /nfs/dbraw/zinc/50/20/10/908502010.db2.gz VHMHWWXCJUXDFL-OAHAWELDSA-N 2 0 419.613 4.193 20 0 HIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499144079 908502282 /nfs/dbraw/zinc/50/22/82/908502282.db2.gz CHPYOCNVZRUKID-QEIWAGNOSA-N 3 0 407.602 4.302 20 0 HIADRP COc1cccc(N2CC[C@@H](C[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499161357 908516240 /nfs/dbraw/zinc/51/62/40/908516240.db2.gz LRLKZLRLWZRFBX-OPBMBUAESA-N 2 0 405.586 4.307 20 0 HIADRP COc1cccc(N2CCC[C@H]([NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499213872 908569398 /nfs/dbraw/zinc/56/93/98/908569398.db2.gz UUORXWHMYUAVCI-OPBMBUAESA-N 2 0 405.586 4.449 20 0 HIADRP O=C(c1ccccc1)N1CCC(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499255766 908631142 /nfs/dbraw/zinc/63/11/42/908631142.db2.gz NVXPWZUQRTUGEK-PBROBROCSA-N 2 0 417.597 4.324 20 0 HIADRP Cc1ccc(NC(=O)[C@@H]2C[N@H+](Cc3ccccc3)CCC2(F)F)c(C[NH+](C)C)c1 ZINC000512967815 921444530 /nfs/dbraw/zinc/44/45/30/921444530.db2.gz UABSEWCMLUFVHT-FQEVSTJZSA-N 2 0 401.501 4.153 20 0 HIADRP c1ccc(CC2CC[NH+](CCCC[NH2+]C3CCN(c4ccccn4)CC3)CC2)cc1 ZINC000513060651 921517234 /nfs/dbraw/zinc/51/72/34/921517234.db2.gz YUDOPZPRTXMZSM-UHFFFAOYSA-N 2 0 406.618 4.375 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(C)CC2CCN(c3cc[nH+]cc3)CC2)cc1)C1CC1 ZINC000500423346 909846581 /nfs/dbraw/zinc/84/65/81/909846581.db2.gz LHTMUSNTKOVECS-UHFFFAOYSA-N 2 0 406.574 4.055 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CCC(CCC[NH+](C)C)CC2)C1 ZINC000500820238 910101653 /nfs/dbraw/zinc/10/16/53/910101653.db2.gz FEHIHTMVDBXIDP-NRFANRHFSA-N 2 0 414.638 4.182 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1ccccc1 ZINC000501023032 910240780 /nfs/dbraw/zinc/24/07/80/910240780.db2.gz LTSFZAAVJNLJDQ-FCHUYYIVSA-N 2 0 414.981 4.079 20 0 HIADRP C[C@H](NC(=O)[C@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1cc2ccccc2o1 ZINC000501024850 910242624 /nfs/dbraw/zinc/24/26/24/910242624.db2.gz OBXIDQJJSAGRHR-OALUTQOASA-N 2 0 420.557 4.242 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1ccsc1 ZINC000501027526 910245086 /nfs/dbraw/zinc/24/50/86/910245086.db2.gz ZVSXYUOTPCZQSP-PMACEKPBSA-N 2 0 421.010 4.141 20 0 HIADRP C[N@@H+](Cc1nn(-c2ccccc2)c2c1CCC2)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501041652 910254552 /nfs/dbraw/zinc/25/45/52/910254552.db2.gz ZUDGNPQUFDZZOL-UHFFFAOYSA-N 2 0 401.558 4.104 20 0 HIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CCCN3CC[NH+](C(C)C)CC3)s2)cc1 ZINC000501059209 910268634 /nfs/dbraw/zinc/26/86/34/910268634.db2.gz MLSXAEDUDMFOSY-SFHVURJKSA-N 2 0 416.635 4.194 20 0 HIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCCN1CC[NH+](C(C)C)CC1 ZINC000501060510 910270117 /nfs/dbraw/zinc/27/01/17/910270117.db2.gz SILKNNHWEUUJEL-IBGZPJMESA-N 2 0 400.636 4.494 20 0 HIADRP C[C@@H](NC(=O)[C@@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000501090577 910290132 /nfs/dbraw/zinc/29/01/32/910290132.db2.gz SVLVGZUPAHXYMV-QZTJIDSGSA-N 2 0 414.981 4.149 20 0 HIADRP Cc1ccc([C@@H](NC(=O)C[NH+]2CCC(CCC[NH+](C)C)CC2)c2cccs2)cc1 ZINC000501779437 910834680 /nfs/dbraw/zinc/83/46/80/910834680.db2.gz WUMROISJODJPPC-XMMPIXPASA-N 2 0 413.631 4.316 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)N3CCC[C@H](C[NH+]4CCCCCC4)C3)CC2)CC1 ZINC000502767735 911790011 /nfs/dbraw/zinc/79/00/11/911790011.db2.gz MQKFOMGJXLAIPS-ZKMFCFPVSA-N 2 0 418.670 4.327 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000502921738 911908611 /nfs/dbraw/zinc/90/86/11/911908611.db2.gz VUQAMIAFOZPSED-UHFFFAOYSA-N 2 0 422.617 4.334 20 0 HIADRP CCC(CC)(CNC(=O)NC1CC[NH+](CC(C)C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000502926602 911912666 /nfs/dbraw/zinc/91/26/66/911912666.db2.gz SISZTOJVKJEMGK-HXUWFJFHSA-N 2 0 402.627 4.316 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000502962106 911942297 /nfs/dbraw/zinc/94/22/97/911942297.db2.gz UZPKJQJBPBGLHH-OAQYLSRUSA-N 2 0 422.617 4.122 20 0 HIADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)CC1 ZINC000513329198 921717411 /nfs/dbraw/zinc/71/74/11/921717411.db2.gz BPYVAKVBYQDGCF-OAHLLOKOSA-N 2 0 404.908 4.185 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)[NH+]2CCCC2)o1 ZINC000506632033 915299458 /nfs/dbraw/zinc/29/94/58/915299458.db2.gz GDEWELALUXMHPS-BVSLBCMMSA-N 2 0 416.610 4.021 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)C1 ZINC000506862982 915651113 /nfs/dbraw/zinc/65/11/13/915651113.db2.gz JDULBFJZEGJCMB-GPXNEJASSA-N 2 0 412.622 4.120 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)C1 ZINC000506918310 915719066 /nfs/dbraw/zinc/71/90/66/915719066.db2.gz REOJHPPBJGKDPV-YADHBBJMSA-N 2 0 412.622 4.078 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1 ZINC000506934406 915737483 /nfs/dbraw/zinc/73/74/83/915737483.db2.gz RDOXDGKBZKUMLD-URXFXBBRSA-N 2 0 414.638 4.324 20 0 HIADRP C[NH+](C/C=C\C[N@@H+](C)C[C@@H]1OCCc2ccccc21)C[C@@H]1OCCc2ccccc21 ZINC000507263147 916026129 /nfs/dbraw/zinc/02/61/29/916026129.db2.gz YSECPBDTHDZMHN-DEVNVCHMSA-N 2 0 406.570 4.034 20 0 HIADRP CSc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000507465335 916234381 /nfs/dbraw/zinc/23/43/81/916234381.db2.gz AFRWSWGADUBUON-RTBURBONSA-N 2 0 411.615 4.228 20 0 HIADRP CCOc1c(Cl)cc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)cc1OC ZINC000507694886 916469454 /nfs/dbraw/zinc/46/94/54/916469454.db2.gz OEWWYWALHLZWSX-UHFFFAOYSA-N 2 0 410.986 4.072 20 0 HIADRP C[C@H](c1ccccc1)[N@H+](CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)C1CC1 ZINC000507698032 916479063 /nfs/dbraw/zinc/47/90/63/916479063.db2.gz MWLUQNREOKEGGT-LJQANCHMSA-N 2 0 409.599 4.400 20 0 HIADRP Cc1ccc(NC(=O)C2CC[NH+](CC(C)(C)C[N@H+](C)Cc3ccccc3)CC2)nc1 ZINC000507988412 916830643 /nfs/dbraw/zinc/83/06/43/916830643.db2.gz ZDCZYVIISUMTBZ-UHFFFAOYSA-N 2 0 408.590 4.199 20 0 HIADRP C[C@@H](Nc1ccccc1C[NH+]1CCC(CO)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508699520 917460766 /nfs/dbraw/zinc/46/07/66/917460766.db2.gz OICMRIBWLJVKPD-ZJSXRUAMSA-N 2 0 407.602 4.213 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722178 917484497 /nfs/dbraw/zinc/48/44/97/917484497.db2.gz RHTNABJQVROCOJ-AZGAKELHSA-N 3 0 420.645 4.089 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)[C@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508926236 917686677 /nfs/dbraw/zinc/68/66/77/917686677.db2.gz JNJCTVRQUCDLDF-NRFANRHFSA-N 2 0 405.464 4.141 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3ccc(-c4cnn(C)c4)s3)CC2)c1 ZINC000509537760 918186664 /nfs/dbraw/zinc/18/66/64/918186664.db2.gz HHRVXZLCWBQDEF-UHFFFAOYSA-N 2 0 423.630 4.149 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)c1ccco1 ZINC000509568470 918217688 /nfs/dbraw/zinc/21/76/88/918217688.db2.gz LNGUYBIFSIHLLE-UGKGYDQZSA-N 2 0 412.578 4.015 20 0 HIADRP C[C@H]1C[C@@H](CCNC(=O)NCCCC[NH+]2CCC(C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000509772520 918385997 /nfs/dbraw/zinc/38/59/97/918385997.db2.gz AXOSESZQIJHHGR-LADGPHEKSA-N 2 0 414.638 4.098 20 0 HIADRP Cc1ccccc1[C@H]([C@@H](C)NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000510547588 918992770 /nfs/dbraw/zinc/99/27/70/918992770.db2.gz OZOUEUDVSYZGEM-QPPBQGQZSA-N 2 0 407.602 4.405 20 0 HIADRP Cc1cccc([C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c2cccc(F)c2)c1 ZINC000510649453 919090113 /nfs/dbraw/zinc/09/01/13/919090113.db2.gz IEBFHXPZXLIBLS-VWLOTQADSA-N 2 0 419.544 4.305 20 0 HIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)cc1 ZINC000511394041 920004600 /nfs/dbraw/zinc/00/46/00/920004600.db2.gz AOSVCRNGUMVCNC-RPWUZVMVSA-N 2 0 416.009 4.343 20 0 HIADRP Cn1nccc1-c1ccccc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000511563716 920206486 /nfs/dbraw/zinc/20/64/86/920206486.db2.gz OOKBDPWEDDOGLS-UHFFFAOYSA-N 2 0 418.585 4.248 20 0 HIADRP Cc1ccc(C[N@@H+](CCc2ccccc2)CC(=O)NC2CC[NH+](C(C)C)CC2)s1 ZINC000511692473 920356429 /nfs/dbraw/zinc/35/64/29/920356429.db2.gz SRFCYYJDRBZCGL-UHFFFAOYSA-N 2 0 413.631 4.090 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)[C@H]2C[NH+](Cc3ccccc3)CCC2(F)F)CC1 ZINC000512327742 921078940 /nfs/dbraw/zinc/07/89/40/921078940.db2.gz HROBVTMACYQZAO-JOCHJYFZSA-N 2 0 421.576 4.114 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512332043 921080224 /nfs/dbraw/zinc/08/02/24/921080224.db2.gz MUYGMLYIAQDVCE-IKGGRYGDSA-N 2 0 422.411 4.409 20 0 HIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2c[nH]nc2-c2ccc3c(c2)OCO3)C[N@@H+]1Cc1ccccc1 ZINC000513501609 921850899 /nfs/dbraw/zinc/85/08/99/921850899.db2.gz UMUXDQBQBRSTJA-UYAOXDASSA-N 2 0 418.541 4.196 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000514107716 922437285 /nfs/dbraw/zinc/43/72/85/922437285.db2.gz PKVKSRRCYYFARU-NJYVYQBISA-N 2 0 420.667 4.017 20 0 HIADRP COc1cccc(OC)c1OCCCC[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000514689051 922756675 /nfs/dbraw/zinc/75/66/75/922756675.db2.gz SWJMZJAYAMVSSQ-LEWJYISDSA-N 2 0 404.595 4.449 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1)c1ccccc1 ZINC000515290614 923037856 /nfs/dbraw/zinc/03/78/56/923037856.db2.gz AGTYZKNZWFWFLN-SFTDATJTSA-N 2 0 414.619 4.267 20 0 HIADRP CCOc1ccc(NC(=O)[C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000515521764 923153427 /nfs/dbraw/zinc/15/34/27/923153427.db2.gz UUBATNOLASUJMC-WOJBJXKFSA-N 2 0 409.574 4.434 20 0 HIADRP CCOc1ccccc1NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000515756748 923329023 /nfs/dbraw/zinc/32/90/23/923329023.db2.gz UZHQOJXTSQTWCY-PMACEKPBSA-N 2 0 409.574 4.434 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000515759717 923333279 /nfs/dbraw/zinc/33/32/79/923333279.db2.gz WCHPCKJQFHWBOS-OTWHNJEPSA-N 2 0 423.557 4.010 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)c2ccccc2)CC1 ZINC000516155408 923578837 /nfs/dbraw/zinc/57/88/37/923578837.db2.gz CGMWWPZHFFEMBV-JOCHJYFZSA-N 2 0 400.611 4.022 20 0 HIADRP Clc1ccc(-c2ncc(C[NH+]3CCC(CC[NH+]4CCOCC4)CC3)s2)cc1 ZINC000516497305 923760258 /nfs/dbraw/zinc/76/02/58/923760258.db2.gz NIHADSQTBQHLIZ-UHFFFAOYSA-N 2 0 405.995 4.398 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)N[C@@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)CC1 ZINC000516579888 923800512 /nfs/dbraw/zinc/80/05/12/923800512.db2.gz ZVOWGYPHOBBMDM-SQJMNOBHSA-N 2 0 420.601 4.094 20 0 HIADRP CCOc1c(Br)cc(C[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000517537115 924252451 /nfs/dbraw/zinc/25/24/51/924252451.db2.gz HPSMZNXXHUJXBB-UHFFFAOYSA-N 2 0 413.400 4.458 20 0 HIADRP Cc1nc(-c2cc([C@H](C)[NH2+]Cc3ccncc3OCC[NH+](C)C)cs2)cs1 ZINC000517777992 926832080 /nfs/dbraw/zinc/83/20/80/926832080.db2.gz PALLUGBAHDEWMQ-AWEZNQCLSA-N 2 0 402.589 4.366 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000518888671 927600182 /nfs/dbraw/zinc/60/01/82/927600182.db2.gz LWKMPZMNJZHWHI-RPBOFIJWSA-N 2 0 402.586 4.432 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)C1 ZINC000519505581 927998567 /nfs/dbraw/zinc/99/85/67/927998567.db2.gz FKPDVYUPTAFODT-PMACEKPBSA-N 2 0 423.045 4.171 20 0 HIADRP CC[NH+](CC)CCN(Cc1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000519989620 928217562 /nfs/dbraw/zinc/21/75/62/928217562.db2.gz CFEDTXPBBZYDBK-UHFFFAOYSA-N 2 0 422.617 4.205 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC[NH+](C(C)(C)C)CC1 ZINC000520198156 928383712 /nfs/dbraw/zinc/38/37/12/928383712.db2.gz GMXAMUQVAULADL-FQEVSTJZSA-N 2 0 400.611 4.077 20 0 HIADRP CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)NC1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000520377734 928530925 /nfs/dbraw/zinc/53/09/25/928530925.db2.gz NBHWHECPYLDJOD-UCBGAZFYSA-N 2 0 412.622 4.136 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCC[C@H]2C[NH+]2CCCCC2)cc1 ZINC000520613262 928673126 /nfs/dbraw/zinc/67/31/26/928673126.db2.gz YMBOHFVKQZDQRT-URXFXBBRSA-N 2 0 412.622 4.221 20 0 HIADRP CC(C)[N@@H+]1CCC[C@H](CNC(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000520612952 928673403 /nfs/dbraw/zinc/67/34/03/928673403.db2.gz JZOCBGRSGVAXEH-JOCHJYFZSA-N 2 0 422.617 4.335 20 0 HIADRP C[NH+](C)CCCOc1cccc(NC(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)c1 ZINC000524692491 929801448 /nfs/dbraw/zinc/80/14/48/929801448.db2.gz JPKAFSKZGGWREJ-HXUWFJFHSA-N 2 0 413.537 4.007 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000524886879 929873644 /nfs/dbraw/zinc/87/36/44/929873644.db2.gz SHVXMIVWGCIDPE-RDGATRHJSA-N 2 0 420.601 4.130 20 0 HIADRP C[C@@H]1CCc2ccc(Br)cc2[C@H]([NH2+]CCCC[NH+]2CCN(C)CC2)C1 ZINC000526041610 930512425 /nfs/dbraw/zinc/51/24/25/930512425.db2.gz BICCIZNOMKEBPP-DYESRHJHSA-N 2 0 408.428 4.080 20 0 HIADRP c1cn(-c2ccc(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)cc2)cn1 ZINC000530664564 930791167 /nfs/dbraw/zinc/79/11/67/930791167.db2.gz DXFGNOHNBXHPML-UHFFFAOYSA-N 2 0 404.558 4.033 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NCc1cccc(C[NH+]2CCCC2)c1)c1ccc(Cl)cc1 ZINC000530839320 930837686 /nfs/dbraw/zinc/83/76/86/930837686.db2.gz MWMWRKRLGZJIGM-JOCHJYFZSA-N 2 0 414.981 4.038 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)C[C@H]1C ZINC000530902271 930854044 /nfs/dbraw/zinc/85/40/44/930854044.db2.gz QTIRHFHPQLYBHA-DJOPODEESA-N 2 0 410.602 4.267 20 0 HIADRP Cc1ccc(OCc2nc(C[NH2+]CCCC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cs2)cc1 ZINC000531349948 931026329 /nfs/dbraw/zinc/02/63/29/931026329.db2.gz POZQWXOKJAIVQP-KDURUIRLSA-N 2 0 403.592 4.010 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(NC(=O)NC(C)C)cc2)CC1 ZINC000531531895 931094642 /nfs/dbraw/zinc/09/46/42/931094642.db2.gz BJKJSZIYVXCLHC-UHFFFAOYSA-N 2 0 423.605 4.038 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2ccc(F)c3cccnc23)c1)C1CCOCC1 ZINC000531581664 931109051 /nfs/dbraw/zinc/10/90/51/931109051.db2.gz ITPQYDHVZZQLSY-UHFFFAOYSA-N 2 0 423.532 4.153 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNCc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccccc1 ZINC000531595834 931114565 /nfs/dbraw/zinc/11/45/65/931114565.db2.gz OHUDWZLUPSMMKD-NRFANRHFSA-N 2 0 408.634 4.436 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2cnc(C3CC3)s2)CC1 ZINC000531628922 931132748 /nfs/dbraw/zinc/13/27/48/931132748.db2.gz VWHIDXORXZELMA-UHFFFAOYSA-N 2 0 410.509 4.081 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3ccc(OC)c(Cl)c3)cc2)CC1 ZINC000531682580 931150729 /nfs/dbraw/zinc/15/07/29/931150729.db2.gz VVTURODFEAKLAD-SFHVURJKSA-N 2 0 401.982 4.337 20 0 HIADRP CC[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(Br)c1 ZINC000531710545 931169140 /nfs/dbraw/zinc/16/91/40/931169140.db2.gz XDASGSBWKHGZDA-YADHBBJMSA-N 2 0 416.407 4.479 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000531850920 931220718 /nfs/dbraw/zinc/22/07/18/931220718.db2.gz KAEGLMAFWXEVSX-UHFFFAOYSA-N 3 0 408.634 4.349 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccccc1OCc1ccccc1 ZINC000531941788 931254998 /nfs/dbraw/zinc/25/49/98/931254998.db2.gz XWYFLNGIYMBTOC-NRFANRHFSA-N 2 0 416.569 4.263 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000531944387 931256569 /nfs/dbraw/zinc/25/65/69/931256569.db2.gz NBYYACFABKBQDI-IBGZPJMESA-N 2 0 413.993 4.463 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1ccc(S(C)(=O)=O)cc1 ZINC000531946364 931259029 /nfs/dbraw/zinc/25/90/29/931259029.db2.gz FDAWRMVBRYPDRB-RBUKOAKNSA-N 2 0 400.588 4.315 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](CCc3ccccc3)c3ccccc3)cn2)CC1 ZINC000531989567 931278393 /nfs/dbraw/zinc/27/83/93/931278393.db2.gz KUTFZEBXPZPMBH-VWLOTQADSA-N 2 0 400.570 4.297 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(Oc2ccccc2)cc1 ZINC000531989389 931278629 /nfs/dbraw/zinc/27/86/29/931278629.db2.gz USEAZALVJGXPOP-HXUWFJFHSA-N 2 0 402.542 4.477 20 0 HIADRP COc1cc(C)ccc1[C@H](C)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000532213550 931355323 /nfs/dbraw/zinc/35/53/23/931355323.db2.gz YGIXKRCSZRDOHM-FQEVSTJZSA-N 2 0 412.574 4.344 20 0 HIADRP CC(C)[NH+]1CCC([NH2+]CCSCCOc2cccc(Br)c2)CC1 ZINC000532227586 931362607 /nfs/dbraw/zinc/36/26/07/931362607.db2.gz HXXPUTLVEGOSPU-UHFFFAOYSA-N 2 0 401.414 4.024 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccc(N2CCCCCC2)nc1)C1CC[NH+](C)CC1 ZINC000532361345 931409321 /nfs/dbraw/zinc/40/93/21/931409321.db2.gz MXEYSFXPTQWHQT-UHFFFAOYSA-N 2 0 421.633 4.282 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](c2ccccc2Cl)N2CCCC2)[C@@H](C)C1 ZINC000532461229 931445712 /nfs/dbraw/zinc/44/57/12/931445712.db2.gz BRAGNURPVUJDAB-VJBMBRPKSA-N 2 0 408.030 4.204 20 0 HIADRP C[C@@H](CC[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1)[N@H+](C)Cc1ccccc1 ZINC000532522656 931474369 /nfs/dbraw/zinc/47/43/69/931474369.db2.gz XTMCJEUMPKNNKG-IBGZPJMESA-N 2 0 413.993 4.445 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000532794482 931632795 /nfs/dbraw/zinc/63/27/95/931632795.db2.gz OMYCBHDXBTWSDF-GGAORHGYSA-N 2 0 420.601 4.023 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCC2(CC)CC[NH+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC000532814240 931636928 /nfs/dbraw/zinc/63/69/28/931636928.db2.gz VIXKAZJEYRTIFN-JTHBVZDNSA-N 2 0 414.638 4.051 20 0 HIADRP COc1cc(C[NH2+]C2CCC(C[NH+](C)C)CC2)cc(OC)c1OCc1ccccc1 ZINC000533069488 931762452 /nfs/dbraw/zinc/76/24/52/931762452.db2.gz GYFWLMSMIRCZDM-UHFFFAOYSA-N 2 0 412.574 4.493 20 0 HIADRP C[C@H](C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000533248288 931818746 /nfs/dbraw/zinc/81/87/46/931818746.db2.gz OYTODLLIKJXINH-GOSISDBHSA-N 2 0 415.578 4.109 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cnc(CC(C)C)s2)CC1 ZINC000533446549 931871704 /nfs/dbraw/zinc/87/17/04/931871704.db2.gz OLJANMJPIIKWCO-QGZVFWFLSA-N 2 0 404.599 4.473 20 0 HIADRP CCSc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000533784980 932031679 /nfs/dbraw/zinc/03/16/79/932031679.db2.gz XZNKRKIRSNEWTR-PGRDOPGGSA-N 2 0 411.615 4.347 20 0 HIADRP c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+][C@@H]3[C@H]4CCO[C@@H]4C34CCC4)CC2)cc1 ZINC000534064218 932242356 /nfs/dbraw/zinc/24/23/56/932242356.db2.gz RNQNYZGKESRAQG-CYXNTTPDSA-N 2 0 417.597 4.056 20 0 HIADRP C[C@@H](c1ccccc1)N(C)C(=O)C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534230596 932350528 /nfs/dbraw/zinc/35/05/28/932350528.db2.gz QMJOIAKUUUPIIT-QFIPXVFZSA-N 2 0 405.586 4.194 20 0 HIADRP COc1cc(C[NH2+]Cc2ccc(C[NH+](C)C)c(F)c2)ccc1OCc1ccncc1 ZINC000534240048 932358916 /nfs/dbraw/zinc/35/89/16/932358916.db2.gz HLTNNFPGMQTOJT-UHFFFAOYSA-N 2 0 409.505 4.160 20 0 HIADRP COc1cc(C[NH2+]Cc2ccc(C[NH+](C)C)c(F)c2)ccc1OCC(F)(F)F ZINC000534241484 932359933 /nfs/dbraw/zinc/35/99/33/932359933.db2.gz IWMQXRWGQQVQLK-UHFFFAOYSA-N 2 0 400.416 4.127 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000535088130 932902306 /nfs/dbraw/zinc/90/23/06/932902306.db2.gz LKMDICAXOAVKIA-GJZUVCINSA-N 2 0 407.602 4.082 20 0 HIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1F ZINC000535687520 933341781 /nfs/dbraw/zinc/34/17/81/933341781.db2.gz ANUSVUHDZRNWGP-UHFFFAOYSA-N 2 0 406.427 4.382 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000537293763 933701048 /nfs/dbraw/zinc/70/10/48/933701048.db2.gz FPCSJLVJGBZQHY-HZPDHXFCSA-N 2 0 408.384 4.120 20 0 HIADRP CC[C@@H]([NH2+]CCCC[NH+]1CCN(CC)CC1)c1cc(F)cc(Br)c1 ZINC000537296156 933702139 /nfs/dbraw/zinc/70/21/39/933702139.db2.gz UNUKZGOFSKIOAO-LJQANCHMSA-N 2 0 400.380 4.047 20 0 HIADRP C[C@H]([NH2+]CC(=O)NC1CC[NH+](C2CC2)CC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000562902271 945145805 /nfs/dbraw/zinc/14/58/05/945145805.db2.gz DNRLDJWDFDZMOH-HNNXBMFYSA-N 2 0 418.006 4.462 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CC[C@H](COCc2ccccc2)C1)C1CC[NH+](C)CC1 ZINC000537648708 938346097 /nfs/dbraw/zinc/34/60/97/938346097.db2.gz URTFBSKEHZQNCD-QHCPKHFHSA-N 2 0 407.602 4.256 20 0 HIADRP C[C@H](C(=O)Nc1cc(Cl)ccc1F)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537840728 938387380 /nfs/dbraw/zinc/38/73/80/938387380.db2.gz FPHGXBXXJITISE-MRXNPFEDSA-N 2 0 418.944 4.440 20 0 HIADRP Cn1cc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c(-c2ccccc2)n1 ZINC000537866284 938394840 /nfs/dbraw/zinc/39/48/40/938394840.db2.gz WBUQKAMSYUJGKB-UHFFFAOYSA-N 2 0 418.585 4.248 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCc3c2cc(Br)cc3Cl)CC1 ZINC000537957736 938433615 /nfs/dbraw/zinc/43/36/15/938433615.db2.gz SGHOVQPSCODTGZ-GBESFXJTSA-N 2 0 413.787 4.057 20 0 HIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cc1 ZINC000537959076 938434072 /nfs/dbraw/zinc/43/40/72/938434072.db2.gz UITOVYJQIUHLOG-AMDXRBSFSA-N 2 0 400.607 4.320 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000537959215 938434468 /nfs/dbraw/zinc/43/44/68/938434468.db2.gz YDMRKLRLZNRMIG-SESVDKBCSA-N 2 0 415.578 4.294 20 0 HIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000537971132 938440500 /nfs/dbraw/zinc/44/05/00/938440500.db2.gz AJDPXBNRRBFOEF-XAPVIXHLSA-N 2 0 422.585 4.314 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)cc1Cl ZINC000537972697 938441570 /nfs/dbraw/zinc/44/15/70/938441570.db2.gz XXECQUUPDOGSBN-QGZVFWFLSA-N 2 0 415.965 4.025 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1cnn(Cc2ccccc2)c1 ZINC000537991958 938452979 /nfs/dbraw/zinc/45/29/79/938452979.db2.gz UUMVXNIIYDFZTE-HSZRJFAPSA-N 2 0 417.601 4.184 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)NC2CC[NH+](C3CCCC3)CC2)CC1)CC(C)C ZINC000538067113 938492624 /nfs/dbraw/zinc/49/26/24/938492624.db2.gz PLHQHLOGQFWMST-UHFFFAOYSA-N 2 0 406.659 4.183 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000538115129 938506040 /nfs/dbraw/zinc/50/60/40/938506040.db2.gz YWIXAQPVZWOZCZ-HBMCJLEFSA-N 2 0 407.396 4.258 20 0 HIADRP CCc1c2ccccc2oc1[C@@H](C)[NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1 ZINC000538394195 938610189 /nfs/dbraw/zinc/61/01/89/938610189.db2.gz RHRIGHWOBUEWOX-LJQANCHMSA-N 2 0 407.562 4.038 20 0 HIADRP CC(C)N1CC[C@H](NC(=O)c2ccc(C[NH+](C)C)cc2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000538624214 938664683 /nfs/dbraw/zinc/66/46/83/938664683.db2.gz NMMNZQZFRRHGDI-FCHUYYIVSA-N 2 0 417.956 4.495 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000538886580 938730646 /nfs/dbraw/zinc/73/06/46/938730646.db2.gz XGJPAXOLAIEOCT-DEOSSOPVSA-N 2 0 408.590 4.230 20 0 HIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000539041070 938777898 /nfs/dbraw/zinc/77/78/98/938777898.db2.gz HAZCNCUXENDABX-CMKODMSKSA-N 2 0 418.578 4.181 20 0 HIADRP CCC1(C[NH2+][C@@H](C)c2ccc(S(C)(=O)=O)cc2)CC[NH+](Cc2ccccc2)CC1 ZINC000539041999 938778590 /nfs/dbraw/zinc/77/85/90/938778590.db2.gz ADOGEYQSXUBNJS-FQEVSTJZSA-N 2 0 414.615 4.433 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)cc1 ZINC000539070382 938792886 /nfs/dbraw/zinc/79/28/86/938792886.db2.gz GJDPANNKVVZHSS-HSZRJFAPSA-N 2 0 419.569 4.048 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1nc2ccc(Cl)cc2n1C ZINC000539201232 938818417 /nfs/dbraw/zinc/81/84/17/938818417.db2.gz SBJGACXAIJCPIY-MRXNPFEDSA-N 2 0 412.965 4.034 20 0 HIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1nc2ccccc2n1C ZINC000539218376 938820411 /nfs/dbraw/zinc/82/04/11/938820411.db2.gz RRYLULHKRBVGPB-FQEVSTJZSA-N 2 0 406.574 4.295 20 0 HIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000539263258 938829593 /nfs/dbraw/zinc/82/95/93/938829593.db2.gz VCEFFAWUKAILOJ-HXUWFJFHSA-N 2 0 409.574 4.037 20 0 HIADRP C[C@H]1C[NH+](CCOc2ccc(CC[NH2+]C3CC[NH+](C4CCCC4)CC3)cc2)C[C@@H]1C ZINC000539296035 938835603 /nfs/dbraw/zinc/83/56/03/938835603.db2.gz WKCUQMGNXVISJD-VXKWHMMOSA-N 3 0 413.650 4.192 20 0 HIADRP COC[C@H]([NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1)c1ccc(F)c(F)c1 ZINC000539316947 938840000 /nfs/dbraw/zinc/84/00/00/938840000.db2.gz DSRIPFBWGRETLI-QHCPKHFHSA-N 2 0 404.501 4.163 20 0 HIADRP C[C@@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1nc(-c2ccccc2)no1 ZINC000539409041 938856398 /nfs/dbraw/zinc/85/63/98/938856398.db2.gz IAPINBRKMVZVRB-GHTZIAJQSA-N 2 0 418.541 4.418 20 0 HIADRP CN(c1ccccc1C[NH2+]C1CCC(C(=O)OC(C)(C)C)CC1)C1CC[NH+](C)CC1 ZINC000539871227 938962856 /nfs/dbraw/zinc/96/28/56/938962856.db2.gz AREQYWDVHUGNQQ-UHFFFAOYSA-N 2 0 415.622 4.207 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[NH+]4CC[C@H]5[C@@H](CCC[N@H+]5C)C4)cc3)nc12 ZINC000539897992 938971835 /nfs/dbraw/zinc/97/18/35/938971835.db2.gz GFGGMEJLRZYGDG-URXFXBBRSA-N 2 0 404.558 4.138 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1Br ZINC000540137652 939087121 /nfs/dbraw/zinc/08/71/21/939087121.db2.gz KIKDSDJXWBFFDH-OAHLLOKOSA-N 2 0 404.352 4.420 20 0 HIADRP COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000540170850 939101522 /nfs/dbraw/zinc/10/15/22/939101522.db2.gz YJTFJFQQQJJZFN-QGZVFWFLSA-N 2 0 415.965 4.025 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H](c3cccc(C(F)(F)F)c3)C3CC3)ccn2)CC1 ZINC000540262492 939176587 /nfs/dbraw/zinc/17/65/87/939176587.db2.gz IXNYTEHWANMEHK-OAQYLSRUSA-N 2 0 404.480 4.093 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](c3ccc4[nH]c(=O)oc4c3)C(C)C)cc2)CC1 ZINC000540263290 939176775 /nfs/dbraw/zinc/17/67/75/939176775.db2.gz QOTWFQCTVYTSQB-DEOSSOPVSA-N 2 0 422.573 4.158 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1C(F)(F)F ZINC000540442338 939251881 /nfs/dbraw/zinc/25/18/81/939251881.db2.gz RSDOUWOTJYGZCZ-ZIFCJYIRSA-N 2 0 419.491 4.135 20 0 HIADRP CN(C)[C@@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1c(F)cccc1F ZINC000540493079 939274029 /nfs/dbraw/zinc/27/40/29/939274029.db2.gz SDGKACMOSKNGLI-RTWAWAEBSA-N 2 0 415.528 4.145 20 0 HIADRP Cc1cc([C@@H]([NH2+][C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C2CC2)ccc1F ZINC000540523146 939286452 /nfs/dbraw/zinc/28/64/52/939286452.db2.gz LEFAVKPOYCYDBU-CLOONOSVSA-N 2 0 423.576 4.344 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)CC3 ZINC000540988045 939425785 /nfs/dbraw/zinc/42/57/85/939425785.db2.gz FPXXQTRCLQSPLT-YADHBBJMSA-N 2 0 403.570 4.080 20 0 HIADRP C[C@@H]1[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C[C@H]1c1ccccc1 ZINC000541238636 939487087 /nfs/dbraw/zinc/48/70/87/939487087.db2.gz YBFNRTWQCCNEKZ-GKBBYZSKSA-N 2 0 408.586 4.458 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000541545500 939549871 /nfs/dbraw/zinc/54/98/71/939549871.db2.gz IHQOJGZRSBUMHZ-MIOZMULLSA-N 2 0 410.558 4.046 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1ccc(-c2ccccc2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541601864 939565362 /nfs/dbraw/zinc/56/53/62/939565362.db2.gz SXVWBBRQKKCEJZ-QUURXOELSA-N 2 0 408.586 4.336 20 0 HIADRP CC[C@H](c1ccc(Br)cc1)[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000541662977 939594881 /nfs/dbraw/zinc/59/48/81/939594881.db2.gz UALBAYSBUYIICB-HXUWFJFHSA-N 2 0 408.428 4.250 20 0 HIADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000541785629 939629679 /nfs/dbraw/zinc/62/96/79/939629679.db2.gz WJRHSENRWAQDNF-QHAWAJNXSA-N 2 0 414.638 4.036 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cccc(Br)c1 ZINC000541915762 939652678 /nfs/dbraw/zinc/65/26/78/939652678.db2.gz YZEYFPFKFNLESR-SFTDATJTSA-N 2 0 403.364 4.257 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cccc(OC(F)(F)F)c1 ZINC000541917891 939653889 /nfs/dbraw/zinc/65/38/89/939653889.db2.gz HDVIRDHYLWONMT-UZLBHIALSA-N 2 0 408.464 4.393 20 0 HIADRP COc1cc(-c2ccccc2)ccc1C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000541923949 939655160 /nfs/dbraw/zinc/65/51/60/939655160.db2.gz NRHSCAVQTMTRSC-VWLOTQADSA-N 2 0 402.538 4.219 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)N[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)CC1 ZINC000542085865 939705797 /nfs/dbraw/zinc/70/57/97/939705797.db2.gz SHJSPZVWOAMGHJ-UNMCSNQZSA-N 2 0 406.659 4.183 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](c3ccc(F)cc3)c3cnccn3)CC2)cc1 ZINC000542479438 939830105 /nfs/dbraw/zinc/83/01/05/939830105.db2.gz VEFVLGRKNVATKS-RUZDIDTESA-N 2 0 420.532 4.216 20 0 HIADRP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000542501702 939833478 /nfs/dbraw/zinc/83/34/78/939833478.db2.gz DNFAHHQRAJQMED-VWLOTQADSA-N 2 0 419.613 4.269 20 0 HIADRP CC1CC[NH+](CCCC[NH2+]Cc2ncc(Br)cc2Br)CC1 ZINC000542518552 939836194 /nfs/dbraw/zinc/83/61/94/939836194.db2.gz XEXCRFIJTOWPIE-UHFFFAOYSA-N 2 0 419.205 4.208 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(F)c(-c4cccs4)c3)CC2)CC1 ZINC000542689420 939854352 /nfs/dbraw/zinc/85/43/52/939854352.db2.gz CUHBUFFZMACEGB-UHFFFAOYSA-N 2 0 401.595 4.404 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCOc2cc(Cl)ccc21 ZINC000542845668 939862373 /nfs/dbraw/zinc/86/23/73/939862373.db2.gz GUTRSEKEKNIVKZ-RBBKRZOGSA-N 2 0 400.950 4.300 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000542847225 939862703 /nfs/dbraw/zinc/86/27/03/939862703.db2.gz OPYQYGZEHSIJQQ-KNQAVFIVSA-N 2 0 400.950 4.300 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccccc1Br ZINC000542848314 939862751 /nfs/dbraw/zinc/86/27/51/939862751.db2.gz XOCLSNIFUQHDRB-RXVVDRJESA-N 2 0 403.364 4.257 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000543408215 940055340 /nfs/dbraw/zinc/05/53/40/940055340.db2.gz AHEFAPUYOAMNOB-PMACEKPBSA-N 2 0 410.558 4.464 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000543410510 940056833 /nfs/dbraw/zinc/05/68/33/940056833.db2.gz YTVOBONIHDIJDE-AREMUKBSSA-N 2 0 420.576 4.471 20 0 HIADRP Cc1ccccc1[C@@H](CN1CCOCC1)[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000543411203 940057530 /nfs/dbraw/zinc/05/75/30/940057530.db2.gz QVNAVKXVZNUSRN-AREMUKBSSA-N 2 0 407.602 4.144 20 0 HIADRP Fc1ccc([C@H]([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)c2cnccn2)cc1 ZINC000543422618 940060354 /nfs/dbraw/zinc/06/03/54/940060354.db2.gz FHGOZXCPVCZAGD-VWLOTQADSA-N 2 0 420.532 4.012 20 0 HIADRP COc1cc(CN2CC[C@H](C[NH+](C)C)C2)ccc1OCCOc1ccccc1Cl ZINC000543768875 940181173 /nfs/dbraw/zinc/18/11/73/940181173.db2.gz SKSPFPIESPXXAF-LJQANCHMSA-N 2 0 418.965 4.190 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(Cl)cc1F ZINC000543776560 940182392 /nfs/dbraw/zinc/18/23/92/940182392.db2.gz YPOFGOSTJBLCLD-NRFANRHFSA-N 2 0 405.945 4.257 20 0 HIADRP CSC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(C(F)(F)F)cc1 ZINC000543777279 940183185 /nfs/dbraw/zinc/18/31/85/940183185.db2.gz SUMUXYKUMDZXMQ-SFTDATJTSA-N 2 0 424.532 4.466 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCOc2cc3c(cc21)CCC3 ZINC000543776835 940183390 /nfs/dbraw/zinc/18/33/90/940183390.db2.gz XJBVOEBBLPSMCD-ILBGXUMGSA-N 2 0 406.570 4.136 20 0 HIADRP COc1cc(OC)c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1Cl ZINC000543777085 940183782 /nfs/dbraw/zinc/18/37/82/940183782.db2.gz JUPKUWATOJYLMO-APWZRJJASA-N 2 0 418.965 4.165 20 0 HIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000543776881 940183816 /nfs/dbraw/zinc/18/38/16/940183816.db2.gz PTIMNYZQOXWBIR-MBSDFSHPSA-N 2 0 421.610 4.460 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)s1 ZINC000543777911 940184282 /nfs/dbraw/zinc/18/42/82/940184282.db2.gz XNUVOVBWJYBBAZ-WMLDXEAASA-N 2 0 409.393 4.318 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000563849163 945313966 /nfs/dbraw/zinc/31/39/66/945313966.db2.gz LRWQGYOFGYWJGN-LKUPVBHCSA-N 2 0 423.384 4.233 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CN1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000544349391 940396807 /nfs/dbraw/zinc/39/68/07/940396807.db2.gz UOPFLMZDGMTCCQ-RCZVLFRGSA-N 2 0 401.558 4.062 20 0 HIADRP Cc1cc(C[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)cc2cccnc12 ZINC000544352881 940397872 /nfs/dbraw/zinc/39/78/72/940397872.db2.gz BWXLQBHRYKKHBQ-UHFFFAOYSA-N 2 0 419.569 4.323 20 0 HIADRP C[C@H]([NH2+]CC[S@](=O)c1cc(Cl)ccc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544419263 940418421 /nfs/dbraw/zinc/41/84/21/940418421.db2.gz AIKASDUHQGLBDA-AYNSBQOLSA-N 2 0 403.419 4.344 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3cn(-c4ccccc4)nc3C(C)(C)C)CC2)CC1 ZINC000544594344 940486399 /nfs/dbraw/zinc/48/63/99/940486399.db2.gz KQHVUYRIFCGUDO-UHFFFAOYSA-N 2 0 423.649 4.019 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000544631011 940494626 /nfs/dbraw/zinc/49/46/26/940494626.db2.gz UYZVLINTVXXXEU-AWEZNQCLSA-N 2 0 402.917 4.157 20 0 HIADRP CC(C)C[C@H](CNC(=O)N(C)[C@H](C)C1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000544650517 940498462 /nfs/dbraw/zinc/49/84/62/940498462.db2.gz PBVICVUCJGAXKF-TXTKFYIRSA-N 2 0 402.627 4.124 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(COC2CCOCC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547828342 941077561 /nfs/dbraw/zinc/07/75/61/941077561.db2.gz FCMFEJNFOZEIAM-BWKNWUBXSA-N 2 0 408.586 4.382 20 0 HIADRP C[N@H+](CCC(=O)Nc1ccc(NC(=O)CC[NH+]2CCCCC2)cc1)C1CCCCC1 ZINC000548388837 941099346 /nfs/dbraw/zinc/09/93/46/941099346.db2.gz GRXCXKADAXVXFR-UHFFFAOYSA-N 2 0 414.594 4.094 20 0 HIADRP Clc1ccc2ncc(C[NH2+]C[C@@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)n2c1 ZINC000549867890 941221065 /nfs/dbraw/zinc/22/10/65/941221065.db2.gz GSVSSIQENPBBFG-HXUWFJFHSA-N 2 0 424.976 4.006 20 0 HIADRP CC(C)(C)c1ncc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)s1 ZINC000550263540 941305820 /nfs/dbraw/zinc/30/58/20/941305820.db2.gz QQMYOAFOXPSSJZ-FQEVSTJZSA-N 2 0 413.631 4.459 20 0 HIADRP CC(C)[C@]1(CO)CCC[NH+](Cc2ccccc2C[N@H+]2CCC[C@@](CO)(C(C)C)C2)C1 ZINC000550433225 941326208 /nfs/dbraw/zinc/32/62/08/941326208.db2.gz FUIYSIVNGWRMMO-CLJLJLNGSA-N 2 0 416.650 4.148 20 0 HIADRP O[C@H](C[NH2+]Cc1ccccc1C[NH+]1CCCCC1)COc1cccc2ccccc21 ZINC000550597999 941344276 /nfs/dbraw/zinc/34/42/76/941344276.db2.gz DAGQVBNZNSCMRW-XMMPIXPASA-N 2 0 404.554 4.355 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(C(=O)OC)cc1 ZINC000550605947 941345613 /nfs/dbraw/zinc/34/56/13/941345613.db2.gz IJZHPLVCEZWCFF-GLDPYIMESA-N 2 0 410.558 4.323 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCc3sc(Br)cc32)CC1 ZINC000551063123 941402890 /nfs/dbraw/zinc/40/28/90/941402890.db2.gz KGJAZFLDHLJEJG-GOSISDBHSA-N 2 0 421.404 4.244 20 0 HIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551264482 941438676 /nfs/dbraw/zinc/43/86/76/941438676.db2.gz ZVFYMHYDLCRNKA-SDUSCBPUSA-N 2 0 408.586 4.281 20 0 HIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000551263859 941438871 /nfs/dbraw/zinc/43/88/71/941438871.db2.gz VDEJSEYYTAQTHG-HYBUGGRVSA-N 2 0 421.585 4.224 20 0 HIADRP CC[N@H+](CCC1CC[NH+](C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1)CC1CC1 ZINC000551391955 941467886 /nfs/dbraw/zinc/46/78/86/941467886.db2.gz UTWJLMWLJHABHT-AREMUKBSSA-N 2 0 413.650 4.112 20 0 HIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1Cl ZINC000551534384 941497043 /nfs/dbraw/zinc/49/70/43/941497043.db2.gz NODCGWPIHJOTGQ-KRWDZBQOSA-N 2 0 402.970 4.125 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000551815850 941551808 /nfs/dbraw/zinc/55/18/08/941551808.db2.gz DCZCWAKPFSOSBG-IBGZPJMESA-N 2 0 407.558 4.137 20 0 HIADRP Cc1cc(OC[C@@H](O)C[NH2+]Cc2ccc(C[NH+](C)C)cc2)c(C(C)C)cc1Cl ZINC000551999748 941565489 /nfs/dbraw/zinc/56/54/89/941565489.db2.gz AYZJGUUPZHKGPQ-FQEVSTJZSA-N 2 0 404.982 4.363 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC1 ZINC000552063949 941577276 /nfs/dbraw/zinc/57/72/76/941577276.db2.gz SMHZIJABNLRBDN-NJYVYQBISA-N 2 0 412.496 4.394 20 0 HIADRP Cc1ccc(S(=O)(=O)C[C@H](C)[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000552066522 941578476 /nfs/dbraw/zinc/57/84/76/941578476.db2.gz MGIGYGCUPIQAJS-RBKXMNCYSA-N 2 0 414.615 4.190 20 0 HIADRP CN(c1ccccc1C[N@H+](CCCO)Cc1cccc(Cl)c1)C1CC[NH+](C)CC1 ZINC000552190183 941599058 /nfs/dbraw/zinc/59/90/58/941599058.db2.gz BCMIIJCLYVTXKB-UHFFFAOYSA-N 2 0 416.009 4.255 20 0 HIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000552263974 941617340 /nfs/dbraw/zinc/61/73/40/941617340.db2.gz UNDWNBHYFLDCLB-OZXSUGGESA-N 2 0 401.554 4.486 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H](C)c2ccc(OC(C)C)cc2)CC1 ZINC000552864224 941791804 /nfs/dbraw/zinc/79/18/04/941791804.db2.gz YSZVGRIAZZZWBA-OAQYLSRUSA-N 2 0 423.601 4.214 20 0 HIADRP Cc1nc(-c2cc([C@H](C)[NH2+]Cc3ccnc(OCC[NH+](C)C)c3)cs2)cs1 ZINC000552923774 941803985 /nfs/dbraw/zinc/80/39/85/941803985.db2.gz WGPLBRPXUXEINN-AWEZNQCLSA-N 2 0 402.589 4.366 20 0 HIADRP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000554150976 942050583 /nfs/dbraw/zinc/05/05/83/942050583.db2.gz CDYNMCRITCPFKT-UHFFFAOYSA-N 2 0 417.597 4.411 20 0 HIADRP CCc1ccc([C@H](CNC(=O)C2CCN(c3cc[nH+]cc3C)CC2)[NH+](CC)CC)cc1 ZINC000554220513 942070937 /nfs/dbraw/zinc/07/09/37/942070937.db2.gz VZISIRRQDOOFBY-VWLOTQADSA-N 2 0 422.617 4.368 20 0 HIADRP CCOc1cc2[nH+]ccc(N(C)C3C[C@H]4CC[C@@H](C3)[N@H+]4CCOC)c2cc1OCC ZINC000555240681 942442317 /nfs/dbraw/zinc/44/23/17/942442317.db2.gz MXBIPASTCHCPQT-DFNIBXOVSA-N 2 0 413.562 4.110 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3cccc(Br)c3C2)[C@@H](C)C1 ZINC000555545775 942636136 /nfs/dbraw/zinc/63/61/36/942636136.db2.gz CQKXDSHOIOMWAZ-MDKPJZGXSA-N 2 0 409.412 4.033 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCc4sc(Br)cc43)cc2)CC1 ZINC000556075684 942801479 /nfs/dbraw/zinc/80/14/79/942801479.db2.gz CRZDIDIUYFFVOA-GOSISDBHSA-N 2 0 421.404 4.244 20 0 HIADRP COc1ccc2c(c1F)CC[C@H]2[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230666 942823209 /nfs/dbraw/zinc/82/32/09/942823209.db2.gz AGKPVHGSUWZUQT-NFBKMPQASA-N 2 0 424.560 4.340 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(Cl)c1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556605691 942912340 /nfs/dbraw/zinc/91/23/40/942912340.db2.gz FHKQXXRTCSBQLA-KRWDZBQOSA-N 2 0 415.965 4.320 20 0 HIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000556608087 942913152 /nfs/dbraw/zinc/91/31/52/942913152.db2.gz KQSAMAHKOOASSV-QPPBQGQZSA-N 3 0 407.602 4.302 20 0 HIADRP c1csc(N2CCC([NH2+][C@@H]3CCCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)CC2)n1 ZINC000556887627 942951977 /nfs/dbraw/zinc/95/19/77/942951977.db2.gz ZOKCXPPSPRLIIW-ACIOBRDBSA-N 2 0 410.631 4.392 20 0 HIADRP COc1ccc(Br)c(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000557262664 943062789 /nfs/dbraw/zinc/06/27/89/943062789.db2.gz NKBWWXUVGIWYLA-OAHLLOKOSA-N 2 0 407.352 4.249 20 0 HIADRP c1ccc(C[C@H]2CCC[N@@H+]2CC2(C[NH+]3CCC[C@H]3Cc3ccccc3)COC2)cc1 ZINC000558604567 943614925 /nfs/dbraw/zinc/61/49/25/943614925.db2.gz SQOUEGOGERCJRT-WMPKNSHKSA-N 2 0 404.598 4.417 20 0 HIADRP Brc1ccc2c(c1)CCCC[C@@H]2[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000558972618 943777167 /nfs/dbraw/zinc/77/71/67/943777167.db2.gz WYIYEMGLSZZHHR-IERDGZPVSA-N 2 0 407.396 4.307 20 0 HIADRP c1ccc([C@@H](C[C@@H]2CCOC2)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc1 ZINC000559147368 943854098 /nfs/dbraw/zinc/85/40/98/943854098.db2.gz VRNUCBDUAMSZMU-JYFHCDHNSA-N 2 0 407.602 4.346 20 0 HIADRP C[N@@H+]1CCCC[C@@H]1CC[NH2+]C1(Cc2ccc(F)cc2Br)CCOCC1 ZINC000559266545 943888035 /nfs/dbraw/zinc/88/80/35/943888035.db2.gz GVDXNYFMALQYOQ-GOSISDBHSA-N 2 0 413.375 4.144 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]C2CCC(CS(C)(=O)=O)CC2)cc1 ZINC000559735362 944040483 /nfs/dbraw/zinc/04/04/83/944040483.db2.gz HRJRVHPPRBJENL-UHFFFAOYSA-N 2 0 414.615 4.108 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@H]2CCc3sc(Br)cc32)(N2CCCCC2)CC1 ZINC000559767210 944047348 /nfs/dbraw/zinc/04/73/48/944047348.db2.gz RLDVBLJYEWTCHA-INIZCTEOSA-N 2 0 412.441 4.038 20 0 HIADRP Cc1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c(N2CCOCC2)c1 ZINC000559920590 944086048 /nfs/dbraw/zinc/08/60/48/944086048.db2.gz CDNUAWKVWQLBRM-UHFFFAOYSA-N 2 0 407.602 4.364 20 0 HIADRP C[C@@H]1CN(c2ccc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)cn2)C[C@@H](C)O1 ZINC000560531955 944245079 /nfs/dbraw/zinc/24/50/79/944245079.db2.gz OQDFUIATYWWLSB-AGYDLCDTSA-N 2 0 422.617 4.228 20 0 HIADRP COCCOc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1OC ZINC000560542273 944248040 /nfs/dbraw/zinc/24/80/40/944248040.db2.gz BUVWPBNEYSYWNN-UHFFFAOYSA-N 2 0 424.585 4.209 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)[C@@H]1C[NH+](C(C)(C)C)C[C@H]1C(F)(F)F ZINC000561145131 944480310 /nfs/dbraw/zinc/48/03/10/944480310.db2.gz ZDZAMBIMIUUJOF-RTBURBONSA-N 2 0 413.528 4.052 20 0 HIADRP Brc1cccc(N2CC[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)c1 ZINC000561541801 944664935 /nfs/dbraw/zinc/66/49/35/944664935.db2.gz OFUKZRDLALMQGQ-IBGZPJMESA-N 2 0 406.412 4.415 20 0 HIADRP CSc1ccccc1NC(=O)CC[N@@H+]1C[C@@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000562061168 944918337 /nfs/dbraw/zinc/91/83/37/944918337.db2.gz GCANIDHZRKMRTD-LEWJYISDSA-N 2 0 409.599 4.191 20 0 HIADRP COC(=O)[C@@H](C)Oc1ccc(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000562213170 945021585 /nfs/dbraw/zinc/02/15/85/945021585.db2.gz DAFAIQPPCLLTHG-OFNKIYASSA-N 2 0 410.558 4.019 20 0 HIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCC(=O)Nc3cccc(Br)c3)C2)CC1 ZINC000562237317 945036989 /nfs/dbraw/zinc/03/69/89/945036989.db2.gz UXPCUZRWRZQKKP-GOSISDBHSA-N 2 0 422.411 4.222 20 0 HIADRP COCCC[C@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccc(Br)cc1 ZINC000564433986 945583450 /nfs/dbraw/zinc/58/34/50/945583450.db2.gz KUEKHENYCFZICI-SFHVURJKSA-N 2 0 415.441 4.334 20 0 HIADRP CSc1ccc([C@H](CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)[NH+](C)C)cc1 ZINC000565502772 945840585 /nfs/dbraw/zinc/84/05/85/945840585.db2.gz JBUWYGIRRLMRNY-QHCPKHFHSA-N 2 0 411.615 4.040 20 0 HIADRP C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000565902778 945909106 /nfs/dbraw/zinc/90/91/06/945909106.db2.gz BINMQIKTSREGRY-WIUXTJDCSA-N 2 0 403.998 4.243 20 0 HIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](CCCc4nc(-c5ccccc5)no4)C[C@@H]3C2)cc1 ZINC000566884557 946154539 /nfs/dbraw/zinc/15/45/39/946154539.db2.gz PBODDNKIIBEISL-XZOQPEGZSA-N 2 0 402.542 4.123 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000566996703 946207525 /nfs/dbraw/zinc/20/75/25/946207525.db2.gz LLJVFOMKMYDOOB-OXJNMPFZSA-N 2 0 420.395 4.134 20 0 HIADRP O[C@@H](C[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)COCc1ccc(Cl)cc1 ZINC000567188079 946264203 /nfs/dbraw/zinc/26/42/03/946264203.db2.gz ZKWFLVZBUKNPCA-UPVQGACJSA-N 2 0 416.993 4.109 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000567545209 946370090 /nfs/dbraw/zinc/37/00/90/946370090.db2.gz QAGVWDMFAPJTQJ-FQEVSTJZSA-N 2 0 410.558 4.321 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000567545210 946370163 /nfs/dbraw/zinc/37/01/63/946370163.db2.gz QAGVWDMFAPJTQJ-HXUWFJFHSA-N 2 0 410.558 4.321 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CC2 ZINC000568420428 946535954 /nfs/dbraw/zinc/53/59/54/946535954.db2.gz ARDXYZQDTQNQKQ-DHLKQENFSA-N 2 0 406.570 4.201 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CC2 ZINC000568420434 946536666 /nfs/dbraw/zinc/53/66/66/946536666.db2.gz ARDXYZQDTQNQKQ-WIOPSUGQSA-N 2 0 406.570 4.201 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+]Cc1ccc(Oc2cc(F)cc(F)c2)cc1 ZINC000568910818 946746896 /nfs/dbraw/zinc/74/68/96/946746896.db2.gz GSZQSLPDQSCNHS-UHFFFAOYSA-N 2 0 413.468 4.382 20 0 HIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000569158484 946827468 /nfs/dbraw/zinc/82/74/68/946827468.db2.gz MULMCENKEZAAAB-BENYOCTQSA-N 2 0 415.528 4.270 20 0 HIADRP CCc1ccc([C@H]([NH2+]C2CCC([NH+](C)C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000569271065 946846368 /nfs/dbraw/zinc/84/63/68/946846368.db2.gz XABRUHBPDMGSBV-IWAAJCSBSA-N 2 0 414.615 4.204 20 0 HIADRP O=C(C[NH2+][C@H](c1ccccc1)[C@H]1CCCc2ccccc21)NC1CC[NH+](C2CC2)CC1 ZINC000569272623 946846840 /nfs/dbraw/zinc/84/68/40/946846840.db2.gz DCAZHRIPGYEQMO-AHKZPQOWSA-N 2 0 417.597 4.180 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1-c1noc([C@]2(F)CC[N@@H+](C(C)(C)C)C2)n1 ZINC000569860698 947023576 /nfs/dbraw/zinc/02/35/76/947023576.db2.gz AMICQBSOTDTAPB-QFIPXVFZSA-N 2 0 404.530 4.126 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+]C1CC(c2cccc(Br)c2)C1 ZINC000570197139 947133399 /nfs/dbraw/zinc/13/33/99/947133399.db2.gz SPVUVDFVNBVPEV-UHFFFAOYSA-N 2 0 418.379 4.210 20 0 HIADRP COc1ncc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1Cl ZINC000570913671 947391414 /nfs/dbraw/zinc/39/14/14/947391414.db2.gz OATQVNLAJMQYKV-IXDOHACOSA-N 2 0 403.954 4.204 20 0 HIADRP COc1ncc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)cc1Cl ZINC000570913672 947391705 /nfs/dbraw/zinc/39/17/05/947391705.db2.gz OATQVNLAJMQYKV-ULQDDVLXSA-N 2 0 403.954 4.204 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](c1sccc1Br)C1CCCCC1 ZINC000574386739 948429703 /nfs/dbraw/zinc/42/97/03/948429703.db2.gz HCWDCFXZJDKZMW-CRAIPNDOSA-N 2 0 414.457 4.358 20 0 HIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)cc1 ZINC000575010937 948572238 /nfs/dbraw/zinc/57/22/38/948572238.db2.gz HZVVINVILMXNOO-HXUWFJFHSA-N 2 0 409.574 4.150 20 0 HIADRP CC(=O)N1CC[C@@H]([NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c2ccccc2C1 ZINC000575031744 948578259 /nfs/dbraw/zinc/57/82/59/948578259.db2.gz WICHTXXKIJNVDY-JYFHCDHNSA-N 2 0 405.586 4.372 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)OCC(=O)N2 ZINC000575975453 948805323 /nfs/dbraw/zinc/80/53/23/948805323.db2.gz QIINIYUNDDFWTA-OTWHNJEPSA-N 2 0 407.558 4.346 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)OCC(=O)N2 ZINC000575975419 948805793 /nfs/dbraw/zinc/80/57/93/948805793.db2.gz QIINIYUNDDFWTA-CEXWTWQISA-N 2 0 407.558 4.346 20 0 HIADRP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1[nH+]c(N3CCCC3)cc3ccccc31)C2 ZINC001164815050 720175588 /nfs/dbraw/zinc/17/55/88/720175588.db2.gz HJEJBFIEQFGVPT-BKMJKUGQSA-N 2 0 420.601 4.020 20 0 HIADRP CC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[NH+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1 ZINC001164910693 721564599 /nfs/dbraw/zinc/56/45/99/721564599.db2.gz XFIZAXFSKRLLSS-YFNKSVMNSA-N 2 0 424.564 4.110 20 0 HIADRP COc1ccc([C@@H](CNC(=O)C[N@@H+]2CCC[C@@H]2c2ccccc2)[NH+]2CCCCC2)cc1 ZINC000022549354 846585692 /nfs/dbraw/zinc/58/56/92/846585692.db2.gz SMQCZVHIRFGYEW-JWQCQUIFSA-N 2 0 421.585 4.176 20 0 HIADRP CN1CC[C@H](C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000436480894 861819823 /nfs/dbraw/zinc/81/98/23/861819823.db2.gz JJHSROGILXPSDI-VGOFRKELSA-N 2 0 402.945 4.126 20 0 HIADRP COc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000030907142 847795244 /nfs/dbraw/zinc/79/52/44/847795244.db2.gz IUPNKRQXPCXNDM-IBGZPJMESA-N 2 0 402.542 4.122 20 0 HIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000030907277 847795620 /nfs/dbraw/zinc/79/56/20/847795620.db2.gz CSYWSANBENMCIY-QFIPXVFZSA-N 2 0 400.570 4.481 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+]Cc3ccc(-c4nc5ccccc5s4)o3)CC2)CC1 ZINC000051189692 849441067 /nfs/dbraw/zinc/44/10/67/849441067.db2.gz FUROJEKLCXQRJK-UHFFFAOYSA-N 2 0 410.587 4.205 20 0 HIADRP CCOc1ccc(-c2nc(C[NH+]3CCC(CC[NH+](C)C)CC3)cs2)cc1OC ZINC000056522985 850383056 /nfs/dbraw/zinc/38/30/56/850383056.db2.gz OXFKATJBCIDYPJ-UHFFFAOYSA-N 2 0 403.592 4.381 20 0 HIADRP Cc1ccc([C@@H](OC[C@H](O)C[NH+]2CCC(CC[NH+](C)C)CC2)c2ccccc2)cc1 ZINC000056523034 850383116 /nfs/dbraw/zinc/38/31/16/850383116.db2.gz PFTXPUBFPCYMBV-FTJBHMTQSA-N 2 0 410.602 4.126 20 0 HIADRP O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)Nc1ccc(CC[NH+]2CCCCC2)cc1 ZINC000056764413 850472008 /nfs/dbraw/zinc/47/20/08/850472008.db2.gz AXTYADVFPXJXMQ-QFIPXVFZSA-N 2 0 410.562 4.267 20 0 HIADRP CC1CC[NH+](C[C@H]2CCCN(C(=O)[C@@H]3CCC[N@H+](Cc4cccc(F)c4)C3)C2)CC1 ZINC000060275552 851058299 /nfs/dbraw/zinc/05/82/99/851058299.db2.gz BHFYXAGSZJLJPB-DHIUTWEWSA-N 2 0 415.597 4.008 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)NC[C@H](c1ccccc1)[NH+]1CCCC1 ZINC000061230327 851324325 /nfs/dbraw/zinc/32/43/25/851324325.db2.gz UHFUGPMCMVORMS-RUZDIDTESA-N 2 0 420.601 4.309 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCSCC2)cc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000061571988 851407431 /nfs/dbraw/zinc/40/74/31/851407431.db2.gz GLZJIRRODCVOMP-UHFFFAOYSA-N 2 0 423.626 4.129 20 0 HIADRP O=C(Nc1cccc(C[NH+]2CCSCC2)c1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000061572575 851408938 /nfs/dbraw/zinc/40/89/38/851408938.db2.gz FUCFJNLFPABHJI-UHFFFAOYSA-N 2 0 409.599 4.086 20 0 HIADRP CC[C@@H](CNC(=O)NCc1ccccc1C[N@H+](C)C(C)C)[NH+]1CCc2ccccc2C1 ZINC000061869056 851464404 /nfs/dbraw/zinc/46/44/04/851464404.db2.gz YUFIAPURBIGTCX-VWLOTQADSA-N 2 0 422.617 4.163 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCC(C)CC2)CC1 ZINC000062647618 851585262 /nfs/dbraw/zinc/58/52/62/851585262.db2.gz SBNVQBOIVHMPPO-XMMPIXPASA-N 2 0 414.638 4.221 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3cnc(C(C)(C)C)s3)CC2)c1 ZINC000063511051 851706405 /nfs/dbraw/zinc/70/64/05/851706405.db2.gz JGWWNEWDONJYOZ-UHFFFAOYSA-N 2 0 400.636 4.441 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@@H](c2ccc(C)cc2)[NH+]2CCCC2)c1 ZINC000064237093 851855362 /nfs/dbraw/zinc/85/53/62/851855362.db2.gz VKRHCFDUIGAXEB-DEOSSOPVSA-N 2 0 408.590 4.083 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NCc1ccccc1C[NH+]1CCCCC1)c1ccco1 ZINC000065481182 852152343 /nfs/dbraw/zinc/15/23/43/852152343.db2.gz DPSXGPQLWDIPJF-JOCHJYFZSA-N 2 0 412.578 4.148 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000065522372 852166480 /nfs/dbraw/zinc/16/64/80/852166480.db2.gz ZNTSZGXYCONFGT-OFVILXPXSA-N 2 0 420.601 4.307 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)cc1 ZINC000071816173 852411353 /nfs/dbraw/zinc/41/13/53/852411353.db2.gz QPVTXDIBSMAUCW-XMMPIXPASA-N 2 0 408.590 4.165 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)c1oc2ccccc2c1C[NH+](C)C)c1cccc(OC)c1 ZINC000079308735 852542086 /nfs/dbraw/zinc/54/20/86/852542086.db2.gz FNUDHXCQJOGJPQ-JOCHJYFZSA-N 2 0 423.557 4.316 20 0 HIADRP COc1ccccc1[C@@H](CNC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccc1)[NH+]1CCCCC1 ZINC000108934209 852895649 /nfs/dbraw/zinc/89/56/49/852895649.db2.gz DXTZVTYDYJYJJM-BJKOFHAPSA-N 2 0 421.585 4.003 20 0 HIADRP CC1CC[NH+](Cc2ccc(NC(=O)[C@H]3CCC[N@H+](Cc4cccnc4)C3)cc2)CC1 ZINC000116393535 853301154 /nfs/dbraw/zinc/30/11/54/853301154.db2.gz XCEWBEUFNYPGEG-QHCPKHFHSA-N 2 0 406.574 4.164 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc(NC(=O)CC(C)C)c2)CC1 ZINC000236803178 853924522 /nfs/dbraw/zinc/92/45/22/853924522.db2.gz NYJCUGWMZARLOC-UHFFFAOYSA-N 2 0 422.617 4.493 20 0 HIADRP CCCOc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)ccc1OC ZINC000236925609 853938270 /nfs/dbraw/zinc/93/82/70/853938270.db2.gz JHIXOEQWWLSWFM-PMACEKPBSA-N 2 0 412.574 4.383 20 0 HIADRP C[NH+](C)CCCOc1ccc(C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)cc1 ZINC000237110127 853966620 /nfs/dbraw/zinc/96/66/20/853966620.db2.gz QZBNFKVVAMCIKR-UHFFFAOYSA-N 2 0 416.009 4.425 20 0 HIADRP Cc1ccc(-c2cccc(C[NH2+]Cc3ccc(C(=O)NCC[NH+](C)C)cc3)c2)cc1 ZINC000237177986 853976386 /nfs/dbraw/zinc/97/63/86/853976386.db2.gz NESLPOFSWFPWIZ-UHFFFAOYSA-N 2 0 401.554 4.243 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000237232777 853987660 /nfs/dbraw/zinc/98/76/60/853987660.db2.gz MUHGIAVVDWXRRR-UHFFFAOYSA-N 2 0 413.871 4.106 20 0 HIADRP COc1cc(C[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)c(-c2ccccc2)cc1OC ZINC000237387127 854019399 /nfs/dbraw/zinc/01/93/99/854019399.db2.gz YHAGYKNXPDEUMR-WOJBJXKFSA-N 2 0 412.574 4.350 20 0 HIADRP COc1cccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)c1OC(F)F ZINC000237388252 854020483 /nfs/dbraw/zinc/02/04/83/854020483.db2.gz QDQZEQSWMCUKPM-IAGOWNOFSA-N 2 0 420.500 4.196 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2cc3ccccc3nc2N2CCCCC2)C[C@@H](C)O1 ZINC000237570989 854056361 /nfs/dbraw/zinc/05/63/61/854056361.db2.gz CRGFNFCKNHNKDM-NHCUHLMSSA-N 2 0 410.606 4.204 20 0 HIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)c1 ZINC000237583102 854058523 /nfs/dbraw/zinc/05/85/23/854058523.db2.gz XKXJTSOWLXXCTP-FDFHNCONSA-N 2 0 423.601 4.420 20 0 HIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000237608852 854061662 /nfs/dbraw/zinc/06/16/62/854061662.db2.gz HSXNDHMQCLMSLG-ROUUACIJSA-N 2 0 419.013 4.181 20 0 HIADRP FC(F)(F)c1cccc(N2CC[NH+](CCCC[NH2+]C3CCSCC3)CC2)c1 ZINC000237682264 854074982 /nfs/dbraw/zinc/07/49/82/854074982.db2.gz ZHXNMMWUYZPFMY-UHFFFAOYSA-N 2 0 401.542 4.093 20 0 HIADRP Cc1nn(-c2ccccc2)cc1C[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000237778732 854095874 /nfs/dbraw/zinc/09/58/74/854095874.db2.gz ATRDFPMDHNVDMW-PMACEKPBSA-N 2 0 404.558 4.080 20 0 HIADRP Cc1[nH+]c2ccc(Br)cc2c(NC2CC[NH+]([C@H]3CCOC3)CC2)c1C ZINC000301873740 854481323 /nfs/dbraw/zinc/48/13/23/854481323.db2.gz LMPGLIYIJRYUCC-KRWDZBQOSA-N 2 0 404.352 4.279 20 0 HIADRP O=C(Nc1cccc(C[NH+]2CCSCC2)c1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000303017956 854724662 /nfs/dbraw/zinc/72/46/62/854724662.db2.gz LBTCFCLAWIOSPA-JOCHJYFZSA-N 2 0 409.599 4.086 20 0 HIADRP COc1ccc2cc(CN(C)C(=O)[C@@H](C)[NH+]3CCC(C[NH+]4CCCC4)CC3)ccc2c1 ZINC000303144162 854783576 /nfs/dbraw/zinc/78/35/76/854783576.db2.gz DIYJTJVPERCHND-HXUWFJFHSA-N 2 0 423.601 4.003 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NC[C@H](c1cccc(OC)c1)[NH+]1CCCC1)c1ccccc1 ZINC000303306580 854863389 /nfs/dbraw/zinc/86/33/89/854863389.db2.gz ZVNQNCDUNPJWOL-DNQXCXABSA-N 2 0 409.574 4.031 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC000303630922 855089563 /nfs/dbraw/zinc/08/95/63/855089563.db2.gz FRVIEDQBCHIMGJ-NHCUHLMSSA-N 2 0 400.611 4.023 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)c2cccc(C[NH+](C)C)c2)cc1 ZINC000303819941 855221789 /nfs/dbraw/zinc/22/17/89/855221789.db2.gz FKLRVTOPXOFUGQ-UHFFFAOYSA-N 2 0 401.554 4.407 20 0 HIADRP CC(C)(C)OC(=O)N1CCC[C@@H]([NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000309710180 855364013 /nfs/dbraw/zinc/36/40/13/855364013.db2.gz JAAARKXARXPWCX-QPPBQGQZSA-N 2 0 401.595 4.278 20 0 HIADRP C[C@H]([NH2+][C@H]1CCCN(C(=O)OC(C)(C)C)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309807029 855365352 /nfs/dbraw/zinc/36/53/52/855365352.db2.gz UUZSGTMVZYRLTI-NNWRFLSQSA-N 2 0 401.595 4.276 20 0 HIADRP C[C@@H]([NH2+]C[C@H]1CN(Cc2ccccc2)CCCO1)c1cc(Br)cs1 ZINC000390846813 855457092 /nfs/dbraw/zinc/45/70/92/855457092.db2.gz FRLRWUIAYKWQHE-QAPCUYQASA-N 2 0 409.393 4.452 20 0 HIADRP C[C@H]1CC[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CN1C(=O)OC(C)(C)C ZINC000399221213 855478273 /nfs/dbraw/zinc/47/82/73/855478273.db2.gz BYXNPBRLQYBLES-SIKLNZKXSA-N 2 0 401.595 4.276 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NCc2ccccc2C[NH+]2CCCC2)CC1 ZINC000410318621 855925658 /nfs/dbraw/zinc/92/56/58/855925658.db2.gz PRCQISBKYKSSPD-UHFFFAOYSA-N 2 0 420.601 4.055 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC000410348871 855942378 /nfs/dbraw/zinc/94/23/78/855942378.db2.gz BVOHEZOMPCMHRG-OAQYLSRUSA-N 2 0 414.638 4.182 20 0 HIADRP C[C@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NCCC[N@H+]1CCCC[C@@H]1C ZINC000410364473 855952581 /nfs/dbraw/zinc/95/25/81/855952581.db2.gz ILFDLRRDUVLGKP-SFTDATJTSA-N 2 0 400.611 4.125 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)cc2)C1 ZINC000410365851 855954103 /nfs/dbraw/zinc/95/41/03/855954103.db2.gz MKBTWORQCVPBBJ-SFHVURJKSA-N 2 0 400.611 4.027 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccccc2C[N@@H+]2CCCC[C@H]2C)CC1 ZINC000410373192 855958801 /nfs/dbraw/zinc/95/88/01/855958801.db2.gz KACZASRKQDIKND-OAQYLSRUSA-N 2 0 414.638 4.324 20 0 HIADRP COc1ccc(CC[C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)cc1O ZINC000426394888 856273409 /nfs/dbraw/zinc/27/34/09/856273409.db2.gz KRUKCFZIMZYGDW-XUVXKRRUSA-N 2 0 412.574 4.121 20 0 HIADRP Cc1ccc([C@@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)C2CCC2)cc1 ZINC000427694480 856911290 /nfs/dbraw/zinc/91/12/90/856911290.db2.gz JJDKJRUKEZNLPM-RPBOFIJWSA-N 2 0 405.586 4.323 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCCc4ncc(C(F)(F)F)cc43)cc2)CC1 ZINC000427710269 856918453 /nfs/dbraw/zinc/91/84/53/856918453.db2.gz NTDKTCGDHKRGNF-NRFANRHFSA-N 2 0 419.491 4.224 20 0 HIADRP COc1cc(Br)ccc1C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000427866612 856986824 /nfs/dbraw/zinc/98/68/24/856986824.db2.gz RVEVNOBUUQLBMQ-OAHLLOKOSA-N 2 0 407.352 4.249 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+]C4CCN(c5ccccn5)CC4)[C@@H]3C2)cc1 ZINC000428243426 857123864 /nfs/dbraw/zinc/12/38/64/857123864.db2.gz BTXPUQPNLDRGHG-CAOCKLPOSA-N 2 0 404.602 4.331 20 0 HIADRP CN(C(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000428531508 857246199 /nfs/dbraw/zinc/24/61/99/857246199.db2.gz YPFFYKBMUVNTSH-DEOSSOPVSA-N 2 0 405.586 4.022 20 0 HIADRP CC[NH+](CC)CCO[C@H]1CCN([C@H](c2nc(-c3ccccc3)no2)c2ccccc2)C1 ZINC000430000435 857990335 /nfs/dbraw/zinc/99/03/35/857990335.db2.gz PKGSUSRHGKYDCV-GOTSBHOMSA-N 2 0 420.557 4.259 20 0 HIADRP C[C@H]1C[C@H](NC(=O)c2ccc(C[NH+]3CCSCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000430628159 858240796 /nfs/dbraw/zinc/24/07/96/858240796.db2.gz OGVDYDPGDPQQFZ-GBXCKJPGSA-N 2 0 423.626 4.018 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)c2ccc(C[NH+]3CCSCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000430628160 858241279 /nfs/dbraw/zinc/24/12/79/858241279.db2.gz OGVDYDPGDPQQFZ-HYBUGGRVSA-N 2 0 423.626 4.018 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ncc(-c4cccc(F)c4)o3)CC2)CC1 ZINC000430914658 858369396 /nfs/dbraw/zinc/36/93/96/858369396.db2.gz LVIVPQPEZZIHLJ-UHFFFAOYSA-N 2 0 414.569 4.109 20 0 HIADRP Cc1ccc(-c2cnc(C[N@@H+](C)CCC3CC[NH+](C4CCN(C)CC4)CC3)o2)cc1 ZINC000430955581 858382483 /nfs/dbraw/zinc/38/24/83/858382483.db2.gz ZJGDSURRSMOERV-UHFFFAOYSA-N 2 0 410.606 4.278 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)CC1 ZINC000432800593 859367157 /nfs/dbraw/zinc/36/71/57/859367157.db2.gz OLHWUPNHBCVYRW-JWQCQUIFSA-N 2 0 405.586 4.002 20 0 HIADRP C[NH+](Cc1cc(Br)ccc1C[N@@H+](C)[C@@H]1CCSC1)[C@@H]1CCSC1 ZINC000433261817 859599877 /nfs/dbraw/zinc/59/98/77/859599877.db2.gz XMJILSSAHAARGX-QZTJIDSGSA-N 2 0 415.466 4.324 20 0 HIADRP CC1CC[NH+](C2CCC([NH2+][C@@H](c3ccc(Cl)cc3)[C@H]3CN(C)CCO3)CC2)CC1 ZINC000467734923 881537164 /nfs/dbraw/zinc/53/71/64/881537164.db2.gz KGKGKDMXSMXMLW-ZQHBMWIYSA-N 2 0 420.041 4.344 20 0 HIADRP C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000434897598 860542478 /nfs/dbraw/zinc/54/24/78/860542478.db2.gz XAFHRNJJXBRJNR-WMZHIEFXSA-N 2 0 409.599 4.052 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000467747662 881551113 /nfs/dbraw/zinc/55/11/13/881551113.db2.gz UHLNGOGRZHVXCE-MRXNPFEDSA-N 2 0 412.525 4.415 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)c1 ZINC000467748234 881551556 /nfs/dbraw/zinc/55/15/56/881551556.db2.gz VIBHSDQSHSULBP-BJKOFHAPSA-N 2 0 416.009 4.342 20 0 HIADRP C[C@H](Cc1ccccc1F)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000438206542 863638424 /nfs/dbraw/zinc/63/84/24/863638424.db2.gz NYEFULDDOBMMIM-LJQANCHMSA-N 2 0 400.538 4.036 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc(F)c(F)c1 ZINC000467874962 881735190 /nfs/dbraw/zinc/73/51/90/881735190.db2.gz NRKGAVJITUAYHZ-QGZVFWFLSA-N 2 0 404.501 4.305 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCN(C(=O)CCc3ccccc3)C2)CC1 ZINC000438826545 864320002 /nfs/dbraw/zinc/32/00/02/864320002.db2.gz DRIOJQQKGRHVGG-JNLGVIEDSA-N 2 0 419.613 4.253 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000439138124 864571150 /nfs/dbraw/zinc/57/11/50/864571150.db2.gz JSVBRGPUIMJVCI-MDZRGWNJSA-N 2 0 413.425 4.319 20 0 HIADRP c1ccc(C[NH+]2CCN(CCC[NH2+]Cc3cccc(-c4ccncc4)c3)CC2)cc1 ZINC000439463853 864841612 /nfs/dbraw/zinc/84/16/12/864841612.db2.gz BZELCFKFVZYHNP-UHFFFAOYSA-N 2 0 400.570 4.046 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)Nc1c(F)cccc1F ZINC000439597277 864920336 /nfs/dbraw/zinc/92/03/36/864920336.db2.gz NRKBGHHMIJULRY-MRXNPFEDSA-N 2 0 413.468 4.307 20 0 HIADRP Cc1ccc(NC(=O)[C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c(F)c1 ZINC000439597761 864920483 /nfs/dbraw/zinc/92/04/83/864920483.db2.gz OVDNODSVBRJFBW-SFHVURJKSA-N 2 0 409.505 4.476 20 0 HIADRP Cc1ccc(NC(=O)[C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c(F)c1 ZINC000439597760 864921145 /nfs/dbraw/zinc/92/11/45/864921145.db2.gz OVDNODSVBRJFBW-GOSISDBHSA-N 2 0 409.505 4.476 20 0 HIADRP CCC[NH+]1CCC(N(C)C(=O)NC[C@H](CC(C)C)[NH2+][C@H](C)c2ccccc2)CC1 ZINC000468015050 881853252 /nfs/dbraw/zinc/85/32/52/881853252.db2.gz AUDMBISQMKKGBM-IRLDBZIGSA-N 2 0 402.627 4.268 20 0 HIADRP CC(C)C[C@@H](CNC(=O)N1CCC(CC[NH+](C)C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000468026783 881860567 /nfs/dbraw/zinc/86/05/67/881860567.db2.gz ARVLNTNWKHLXKF-REWPJTCUSA-N 2 0 402.627 4.125 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)[C@H](C)C1 ZINC000440689179 865866958 /nfs/dbraw/zinc/86/69/58/865866958.db2.gz HSNQBEWIEXPGDD-CBRSEMLDSA-N 2 0 410.602 4.124 20 0 HIADRP CC(C)[NH+]1CCC(N2CC[NH+](CCCOc3cccc(C(C)(C)C)c3)CC2)CC1 ZINC000441061722 866143790 /nfs/dbraw/zinc/14/37/90/866143790.db2.gz JIHOJRLZKNDDOS-UHFFFAOYSA-N 2 0 401.639 4.243 20 0 HIADRP c1cc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)ccc1C[NH+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441274692 866349600 /nfs/dbraw/zinc/34/96/00/866349600.db2.gz HBHMWEYOVAACHI-QEGGNFSNSA-N 2 0 412.618 4.184 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CCN2CC[N@H+](C)C(C)(C)C2)cnn1-c1ccc(Cl)cc1Cl ZINC000442872154 867706412 /nfs/dbraw/zinc/70/64/12/867706412.db2.gz HJIXBDUVFJVHPO-OAHLLOKOSA-N 2 0 424.420 4.164 20 0 HIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000443011800 867790788 /nfs/dbraw/zinc/79/07/88/867790788.db2.gz HHRWNJUKLXMNBB-HXUWFJFHSA-N 2 0 419.491 4.001 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)Nc1ccccc1CC[NH+](C)C ZINC000446565575 870477515 /nfs/dbraw/zinc/47/75/15/870477515.db2.gz PLMUMQXRRZKQSI-GZOXUSKESA-N 2 0 408.590 4.069 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H](Cc3ccc(F)cc3)c3ccccc3)ccn2)CC1 ZINC000447530059 871392400 /nfs/dbraw/zinc/39/24/00/871392400.db2.gz NCQRALKPTJHHRI-XMMPIXPASA-N 2 0 404.533 4.046 20 0 HIADRP OCC1CC[NH+](Cc2cccc(N[C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2)CC1 ZINC000447596213 871500737 /nfs/dbraw/zinc/50/07/37/871500737.db2.gz BWDIIXFPMVHWLJ-LGKQTMLJSA-N 2 0 419.613 4.498 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)N3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)cc2)CC1 ZINC000448203791 872094099 /nfs/dbraw/zinc/09/40/99/872094099.db2.gz YVSGBPLQHBQHMA-ILBGXUMGSA-N 2 0 424.633 4.077 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)N3CC[C@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)c2)CC1 ZINC000448208190 872103412 /nfs/dbraw/zinc/10/34/12/872103412.db2.gz FQGIEXUQWKKFHO-ZCYQVOJMSA-N 2 0 424.633 4.077 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)N3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2)C1 ZINC000448216635 872122475 /nfs/dbraw/zinc/12/24/75/872122475.db2.gz FFCBSIORTQXZRF-QFZRFWILSA-N 2 0 424.633 4.077 20 0 HIADRP C[NH+](C)CC1(C(=O)NC[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CCCCC1 ZINC000460110379 872575623 /nfs/dbraw/zinc/57/56/23/872575623.db2.gz DQDLIFQNQCTVMX-FXAWDEMLSA-N 2 0 409.977 4.100 20 0 HIADRP CCC(CC)(CNC(=O)NCC1(SC)CC[NH+](C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000460224577 872809829 /nfs/dbraw/zinc/80/98/29/872809829.db2.gz CNCDFFCEKHAPDN-LJQANCHMSA-N 2 0 420.667 4.023 20 0 HIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH2+]CCc1ccc(OCC[NH+](C)C)cc1 ZINC000462751508 875818224 /nfs/dbraw/zinc/81/82/24/875818224.db2.gz YHPLTCBMFPGBAR-UHFFFAOYSA-N 2 0 412.965 4.107 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)[C@H](C)C1 ZINC000463126312 876170500 /nfs/dbraw/zinc/17/05/00/876170500.db2.gz TUIQIDWHECCWSU-XXBNENTESA-N 2 0 408.030 4.031 20 0 HIADRP C[NH+](C)CCOc1ccc(CC[NH2+]C2CCN(Cc3ccccc3Cl)CC2)cc1 ZINC000463150397 876203198 /nfs/dbraw/zinc/20/31/98/876203198.db2.gz MRPRENGQHTXHOY-UHFFFAOYSA-N 2 0 416.009 4.077 20 0 HIADRP CCN(CC)C(=O)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000463233221 876288641 /nfs/dbraw/zinc/28/86/41/876288641.db2.gz AMMOMJPIXHAZLL-QILAJZQNSA-N 2 0 405.586 4.454 20 0 HIADRP CC1(C)[C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)C[C@@H]1c1ccccc1 ZINC000464093832 877249251 /nfs/dbraw/zinc/24/92/51/877249251.db2.gz QDUJILCWUGNSTP-WXFUMESZSA-N 2 0 405.586 4.056 20 0 HIADRP C[N@H+](C[C@H](O)COc1ccc(Cl)cc1Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464834866 878094657 /nfs/dbraw/zinc/09/46/57/878094657.db2.gz HNICKRCXKSBKBP-QUCCMNQESA-N 2 0 423.384 4.187 20 0 HIADRP C[N@H+](C[C@@H](O)COc1c(Cl)cccc1Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464853497 878134364 /nfs/dbraw/zinc/13/43/64/878134364.db2.gz RZGHZVQBJMNUTP-RTBURBONSA-N 2 0 423.384 4.187 20 0 HIADRP C[C@H]1CC[N@H+](CCOc2ccc(NC(=O)[C@@H]3CCC[NH+]3Cc3ccccc3)cc2)C1 ZINC000465201257 878605513 /nfs/dbraw/zinc/60/55/13/878605513.db2.gz UJMZHGUUTALDRV-RDPSFJRHSA-N 2 0 407.558 4.010 20 0 HIADRP C[C@@H]1CC[N@H+](CCOc2ccc(NC(=O)[C@@H]3CCC[NH+]3Cc3ccccc3)cc2)C1 ZINC000465201258 878606479 /nfs/dbraw/zinc/60/64/79/878606479.db2.gz UJMZHGUUTALDRV-YKSBVNFPSA-N 2 0 407.558 4.010 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCc2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)C1 ZINC000465517376 878964673 /nfs/dbraw/zinc/96/46/73/878964673.db2.gz CTSDLPFTEIROJW-HFMPRLQTSA-N 2 0 414.638 4.038 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCc1ccc(C[NH+]3CCC(C)CC3)cc1)CC2 ZINC000465554897 879022689 /nfs/dbraw/zinc/02/26/89/879022689.db2.gz VQWOVFXOUUQGOF-RPWUZVMVSA-N 2 0 412.622 4.075 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CNC(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000465567228 879041258 /nfs/dbraw/zinc/04/12/58/879041258.db2.gz IFUNQVKAGFBKGM-XMMPIXPASA-N 2 0 420.601 4.233 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N(C)CC[C@@H]1CCCC[NH+]1C ZINC000465571754 879046937 /nfs/dbraw/zinc/04/69/37/879046937.db2.gz OCUIPHMGPJWNMS-REWPJTCUSA-N 2 0 400.611 4.077 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@H]1CCC[NH+](C)[C@H]1c1cccs1 ZINC000465591932 879076521 /nfs/dbraw/zinc/07/65/21/879076521.db2.gz GACAFLQXKMCFOM-SFHLNBCPSA-N 2 0 406.640 4.085 20 0 HIADRP CC[NH+](CC)[C@@H]1CCN(C(=O)NCc2ccccc2C[N@H+](C)C2CCCCC2)C1 ZINC000465713227 879284189 /nfs/dbraw/zinc/28/41/89/879284189.db2.gz CMVXKTJZUKOMQH-HSZRJFAPSA-N 2 0 400.611 4.077 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)[NH+](C)C)cc1 ZINC000465811481 879430665 /nfs/dbraw/zinc/43/06/65/879430665.db2.gz JNMUTRLJBFCCOS-JAXLGGSGSA-N 2 0 414.619 4.042 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)C1 ZINC000465927801 879591216 /nfs/dbraw/zinc/59/12/16/879591216.db2.gz QASLJLWGRRILOA-NHCUHLMSSA-N 2 0 400.611 4.023 20 0 HIADRP CCCN(C(=O)NC1C[C@H]2CCC[C@@H](C1)[NH+]2C)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000466166627 879869110 /nfs/dbraw/zinc/86/91/10/879869110.db2.gz NJYKIBMXIMVYQP-NHYNNZIHSA-N 2 0 412.622 4.088 20 0 HIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000467354484 881116924 /nfs/dbraw/zinc/11/69/24/881116924.db2.gz GSATVKJMYOLBHI-DEOSSOPVSA-N 2 0 412.549 4.483 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2c(-c3ccccc3)nc3ccccn32)[C@@H](C)C1 ZINC000469770692 883945358 /nfs/dbraw/zinc/94/53/58/883945358.db2.gz VWJXGCRBTYIDIA-RBBKRZOGSA-N 2 0 406.574 4.228 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)N2CCC(CC[NH+](C)C)CC2)CCCC1)c1ccccc1 ZINC000503740234 912813761 /nfs/dbraw/zinc/81/37/61/912813761.db2.gz UOBUODDTZRNUNU-HXUWFJFHSA-N 2 0 400.611 4.023 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+][C@@H](C)CCN1CC[NH+](C)CC1 ZINC000471607337 886322027 /nfs/dbraw/zinc/32/20/27/886322027.db2.gz YOLBQPDTVQZFDQ-JKSUJKDBSA-N 2 0 407.027 4.449 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccc(Br)cc1 ZINC000471655760 886370049 /nfs/dbraw/zinc/37/00/49/886370049.db2.gz YAYDSHPACPGBMH-HXUWFJFHSA-N 2 0 417.395 4.227 20 0 HIADRP CCN(CCC[NH+]1CCCC1)C(=O)NCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000472094627 886889478 /nfs/dbraw/zinc/88/94/78/886889478.db2.gz NDHYEFCVEAOXCR-UHFFFAOYSA-N 2 0 400.611 4.080 20 0 HIADRP CC[NH+]1CCN(c2cccc(NC3CC[NH+](CCc4ccc(F)cc4)CC3)c2)CC1 ZINC000473836623 888674549 /nfs/dbraw/zinc/67/45/49/888674549.db2.gz OXLJRBUZVHXEOO-UHFFFAOYSA-N 2 0 410.581 4.087 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CCCC[C@H]3[C@@H]3CCOC3)CC2)cc1 ZINC000474056754 888892814 /nfs/dbraw/zinc/89/28/14/888892814.db2.gz MCODGCBTMOTLNB-PZUNEJSGSA-N 2 0 400.607 4.243 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000474347361 889224425 /nfs/dbraw/zinc/22/44/25/889224425.db2.gz FLOBGRDDKSQHES-SFHVURJKSA-N 2 0 424.427 4.030 20 0 HIADRP CCC(CC)(CNC(=O)NC1CC([NH+]2CCCCC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000474368304 889245673 /nfs/dbraw/zinc/24/56/73/889245673.db2.gz RXSDXBQRGOGKRV-KPQWGBOZSA-N 2 0 400.611 4.212 20 0 HIADRP Clc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(-n2cncn2)c1 ZINC000474706852 889565305 /nfs/dbraw/zinc/56/53/05/889565305.db2.gz IJYWUYFVDJYUIX-FRIKZZABSA-N 2 0 407.949 4.206 20 0 HIADRP O=C(NC1CC[NH+](C2CCCCC2)CC1)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000475129656 889991762 /nfs/dbraw/zinc/99/17/62/889991762.db2.gz KZXKBNGTGGPSTF-WINZOAQQSA-N 2 0 424.633 4.278 20 0 HIADRP COc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1OCc1cccnc1 ZINC000475218382 890087221 /nfs/dbraw/zinc/08/72/21/890087221.db2.gz GTVXXZGHUGTQTB-QHCPKHFHSA-N 2 0 417.553 4.281 20 0 HIADRP FC(F)(F)C1CCN(C2CC([NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]34)C2)CC1 ZINC000475348137 890271003 /nfs/dbraw/zinc/27/10/03/890271003.db2.gz LZSSEGRLCDTXGN-WEPYCFSYSA-N 2 0 421.551 4.292 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+](C3CCCCC3)CC2)[C@@H]1c1cccs1 ZINC000475997097 890920692 /nfs/dbraw/zinc/92/06/92/890920692.db2.gz ULVCVTWFSVLXSK-PGRDOPGGSA-N 2 0 418.651 4.227 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)N[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000504928352 913667795 /nfs/dbraw/zinc/66/77/95/913667795.db2.gz BZTTWTMKAYHKCT-RUZDIDTESA-N 2 0 420.601 4.136 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccc(N3CCC([NH+](C)C)CC3)cn2)cc1 ZINC000478324178 893554432 /nfs/dbraw/zinc/55/44/32/893554432.db2.gz QRZQRWGRSRMNGF-UHFFFAOYSA-N 2 0 423.605 4.096 20 0 HIADRP CC1(C)C[C@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c2cc(Br)ccc21 ZINC000479062827 894323281 /nfs/dbraw/zinc/32/32/81/894323281.db2.gz OPZHMPMRTZKZQN-QRWLVFNGSA-N 2 0 407.396 4.262 20 0 HIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000479748950 895047882 /nfs/dbraw/zinc/04/78/82/895047882.db2.gz TWKKPCUYKINGIU-WOJBJXKFSA-N 2 0 409.640 4.022 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc2c(c1)OCCO2 ZINC000480244158 895653881 /nfs/dbraw/zinc/65/38/81/895653881.db2.gz XEZWAXSSHBMMHQ-PWHSHALESA-N 2 0 410.558 4.308 20 0 HIADRP Cc1nn(Cc2ccccc2)c(C)c1C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000480469917 895852280 /nfs/dbraw/zinc/85/22/80/895852280.db2.gz PZLNRQKGTBKCSW-LJQANCHMSA-N 2 0 406.574 4.339 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)c1ccc(-n2cnnn2)cc1 ZINC000480541796 895903679 /nfs/dbraw/zinc/90/36/79/895903679.db2.gz QOWPEQQSMBBSMC-IBGZPJMESA-N 2 0 412.541 4.242 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1OC(F)F)N1CC[NH+](C)CC1 ZINC000480548645 895909122 /nfs/dbraw/zinc/90/91/22/895909122.db2.gz JYESSODGDGPCHV-LAUBAEHRSA-N 2 0 405.533 4.364 20 0 HIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@H](C(C)C)N2CC[NH+](C)CC2)CCC3)cc1 ZINC000480557580 895917020 /nfs/dbraw/zinc/91/70/20/895917020.db2.gz RIIHYUQOWPMKNZ-RBBKRZOGSA-N 2 0 412.647 4.358 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCC[C@H]2C)[C@H](C)C1 ZINC000480610281 895975907 /nfs/dbraw/zinc/97/59/07/895975907.db2.gz NFBRKRMSFWFUFR-RQTOMXEWSA-N 3 0 401.639 4.288 20 0 HIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H](c1ccccc1)N1CCOCC1 ZINC000480621174 895989724 /nfs/dbraw/zinc/98/97/24/895989724.db2.gz JBTRAVZFQVJIMC-UBJRNLSRSA-N 2 0 419.613 4.234 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)CC1 ZINC000480744519 896107518 /nfs/dbraw/zinc/10/75/18/896107518.db2.gz YJHXJDDEQGVQEA-SFHVURJKSA-N 2 0 403.517 4.276 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000480770469 896134442 /nfs/dbraw/zinc/13/44/42/896134442.db2.gz KSPGFLYWWTXZLO-IBGZPJMESA-N 2 0 419.038 4.458 20 0 HIADRP C[N@@H+](Cc1nc2cc(Br)ccc2[nH]1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000480854206 896223498 /nfs/dbraw/zinc/22/34/98/896223498.db2.gz NTQOLJAVEHLXDW-UHFFFAOYSA-N 2 0 414.351 4.069 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(Br)s1 ZINC000480904423 896258796 /nfs/dbraw/zinc/25/87/96/896258796.db2.gz XWTYHIGJVZHERE-OAHLLOKOSA-N 2 0 408.409 4.109 20 0 HIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000481239605 896590477 /nfs/dbraw/zinc/59/04/77/896590477.db2.gz GJYJVWZWSGETMD-JOCHJYFZSA-N 2 0 406.599 4.277 20 0 HIADRP COc1ccc(Cc2nc(C)c([C@@H](C)NC[C@H](C)C[NH+]3CCCC3)s2)cc1OC ZINC000481344324 896712515 /nfs/dbraw/zinc/71/25/15/896712515.db2.gz WTLKEVQHSWQVDL-DLBZAZTESA-N 2 0 417.619 4.442 20 0 HIADRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)nnn1-c1ccc(F)cc1 ZINC000481541609 896900673 /nfs/dbraw/zinc/90/06/73/896900673.db2.gz HUPSZHIZXUCNMD-SFHVURJKSA-N 2 0 407.537 4.278 20 0 HIADRP CC1(C)CC[C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)c2ccccc21 ZINC000481653359 897038517 /nfs/dbraw/zinc/03/85/17/897038517.db2.gz BFRXFHCXVFYFPN-DEOSSOPVSA-N 2 0 405.586 4.415 20 0 HIADRP CC(C)[NH2+]C1CCN(C(=O)NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC1 ZINC000481776538 897160348 /nfs/dbraw/zinc/16/03/48/897160348.db2.gz IRVMUKCMSDQDKR-UHFFFAOYSA-N 2 0 422.617 4.251 20 0 HIADRP C[C@@H](C[NH2+][C@@H]1CCC(C)(C)c2ccc(Br)cc21)CN1CC[NH+](C)CC1 ZINC000481925935 897309621 /nfs/dbraw/zinc/30/96/21/897309621.db2.gz NKDDQRRYSXQVLI-OXJNMPFZSA-N 2 0 408.428 4.035 20 0 HIADRP COCCC[NH+]1CCC([NH2+][C@@H](Cc2ccc(F)cc2)c2ccc(OC)cc2)CC1 ZINC000481938636 897324290 /nfs/dbraw/zinc/32/42/90/897324290.db2.gz GQPMDFXJWHSJRK-DEOSSOPVSA-N 2 0 400.538 4.209 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000482113980 897564681 /nfs/dbraw/zinc/56/46/81/897564681.db2.gz ZYEYSHJOZIMZTJ-IBGZPJMESA-N 2 0 418.541 4.125 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@H]2C[C@H](C)Sc3sccc32)c1 ZINC000482232981 897712732 /nfs/dbraw/zinc/71/27/32/897712732.db2.gz VPXQNDWFGPIRJK-JXFKEZNVSA-N 2 0 406.617 4.420 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000482245269 897727632 /nfs/dbraw/zinc/72/76/32/897727632.db2.gz POHCWDGBTHAECO-HSZRJFAPSA-N 2 0 410.558 4.180 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@@H]2CCCOc3c(C)cc(C)cc32)c1 ZINC000482247231 897730106 /nfs/dbraw/zinc/73/01/06/897730106.db2.gz VDLYAMVCKTXMEZ-XMMPIXPASA-N 2 0 412.574 4.264 20 0 HIADRP Cc1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000482273040 897759322 /nfs/dbraw/zinc/75/93/22/897759322.db2.gz VVJLVLFGPVVMEK-RUZDIDTESA-N 2 0 424.585 4.488 20 0 HIADRP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)CC)c2)cc1 ZINC000482348416 897860127 /nfs/dbraw/zinc/86/01/27/897860127.db2.gz QGJLKKFBPRIWDX-LJQANCHMSA-N 2 0 417.619 4.020 20 0 HIADRP Cc1cc2cc([C@@H](C)[NH2+]CCCC[NH+]3CCN(c4ncccn4)CC3)oc2cc1C ZINC000482442322 898002820 /nfs/dbraw/zinc/00/28/20/898002820.db2.gz WGDBPWVQTSAXJM-HXUWFJFHSA-N 2 0 407.562 4.093 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc(Cl)cc(Cl)c1 ZINC000482443120 898005059 /nfs/dbraw/zinc/00/50/59/898005059.db2.gz FLGTXQLTWREYFA-INIZCTEOSA-N 2 0 408.377 4.036 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000482444664 898006792 /nfs/dbraw/zinc/00/67/92/898006792.db2.gz IINGLDYJJODHBJ-IRLDBZIGSA-N 2 0 408.590 4.432 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000482542536 898129800 /nfs/dbraw/zinc/12/98/00/898129800.db2.gz JANYFWVISYHKEE-MRXNPFEDSA-N 2 0 408.464 4.393 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cccn2)cc1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482542728 898131963 /nfs/dbraw/zinc/13/19/63/898131963.db2.gz YQQFFRUBAAGWQU-RBUKOAKNSA-N 2 0 407.537 4.175 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cccc(OC(F)(F)F)c1 ZINC000482544019 898133459 /nfs/dbraw/zinc/13/34/59/898133459.db2.gz PLRGEBMJLNNTPC-INIZCTEOSA-N 2 0 408.464 4.393 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)[C@H](C)C1 ZINC000482551520 898142036 /nfs/dbraw/zinc/14/20/36/898142036.db2.gz CWRGKUSDQKFIRM-RDGATRHJSA-N 3 0 401.639 4.145 20 0 HIADRP CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)OCCO2 ZINC000482565131 898157717 /nfs/dbraw/zinc/15/77/17/898157717.db2.gz MPMXLKGMYSRVLJ-UWJYYQICSA-N 2 0 413.537 4.151 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H]2CCCc3nc(C)sc32)CC1 ZINC000482568634 898163799 /nfs/dbraw/zinc/16/37/99/898163799.db2.gz HYAVBDOGOCKCML-DNVCBOLYSA-N 2 0 402.583 4.461 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1 ZINC000482569965 898163872 /nfs/dbraw/zinc/16/38/72/898163872.db2.gz RMSZAYKWRBZTBK-WMLDXEAASA-N 2 0 421.010 4.010 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1 ZINC000482569966 898165485 /nfs/dbraw/zinc/16/54/85/898165485.db2.gz RMSZAYKWRBZTBK-YOEHRIQHSA-N 2 0 421.010 4.010 20 0 HIADRP CC(C)Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000482631113 898233991 /nfs/dbraw/zinc/23/39/91/898233991.db2.gz CORLDNJWBPDQHJ-NLFFAJNJSA-N 2 0 407.602 4.433 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2ccccc2Br)s1 ZINC000482632493 898235161 /nfs/dbraw/zinc/23/51/61/898235161.db2.gz GTHAFIUHTMJIQJ-HOTGVXAUSA-N 2 0 422.436 4.464 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000482639105 898243965 /nfs/dbraw/zinc/24/39/65/898243965.db2.gz RJRALEYBGLEOAP-MAUKXSAKSA-N 2 0 405.011 4.066 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](CCSc1ccc(F)cc1)c1ccc(F)cc1 ZINC000482644947 898248046 /nfs/dbraw/zinc/24/80/46/898248046.db2.gz UUGGAEYASFAHCS-MBSDFSHPSA-N 2 0 419.585 4.414 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(CCO)CC1)c1ccc(-c2ccccc2Cl)s1 ZINC000483143471 898822920 /nfs/dbraw/zinc/82/29/20/898822920.db2.gz LDDFJCKMIXXCAH-SFHVURJKSA-N 2 0 422.038 4.109 20 0 HIADRP Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000483214519 898863105 /nfs/dbraw/zinc/86/31/05/898863105.db2.gz XUVIKWPKHHMYQY-HXUWFJFHSA-N 2 0 401.620 4.137 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CCCN(C)[C@@H]1c1cccs1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483710519 899365576 /nfs/dbraw/zinc/36/55/76/899365576.db2.gz HQLYSNZIYONOGY-LEDOBFOHSA-N 2 0 401.620 4.422 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CCCN(C)[C@H]1c1cccs1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483710517 899365636 /nfs/dbraw/zinc/36/56/36/899365636.db2.gz HQLYSNZIYONOGY-GREBRCKQSA-N 2 0 401.620 4.422 20 0 HIADRP COc1ccccc1[C@H](C)[NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000483730882 899391870 /nfs/dbraw/zinc/39/18/70/899391870.db2.gz OUGHIAMSZUBXPO-INIZCTEOSA-N 2 0 407.480 4.317 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@H](C)c3cccc(OCC[NH+](C)C)c3)ccc2NC1=O ZINC000483866324 899547370 /nfs/dbraw/zinc/54/73/70/899547370.db2.gz SDXDKCKTEICYEO-JLHGSKIFSA-N 2 0 411.546 4.148 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@@H](C)c3cccc(OCC[NH+](C)C)c3)ccc2NC1=O ZINC000483866318 899547603 /nfs/dbraw/zinc/54/76/03/899547603.db2.gz SDXDKCKTEICYEO-HOIFWPIMSA-N 2 0 411.546 4.148 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cccc(-c2ccncc2)c1 ZINC000484273732 899844695 /nfs/dbraw/zinc/84/46/95/899844695.db2.gz BOGIKLDBQYHORT-IBGZPJMESA-N 2 0 408.590 4.026 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cccc(Cl)c1Cl ZINC000484290685 899855519 /nfs/dbraw/zinc/85/55/19/899855519.db2.gz LFXPZLOSAYKRTF-CQSZACIVSA-N 2 0 400.394 4.271 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(OC(F)F)cc1 ZINC000484469615 899963961 /nfs/dbraw/zinc/96/39/61/899963961.db2.gz CUXRCIWLRUTPNA-JOCHJYFZSA-N 2 0 404.501 4.486 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000484484178 899975723 /nfs/dbraw/zinc/97/57/23/899975723.db2.gz NJOPLJZWAHWCBG-QFIPXVFZSA-N 2 0 420.475 4.319 20 0 HIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000484501366 899992210 /nfs/dbraw/zinc/99/22/10/899992210.db2.gz VNGCYFPDPKMUMX-FQEVSTJZSA-N 2 0 409.574 4.367 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)Nc2ccccc2CC[NH+](C)C)CC1 ZINC000484662220 900106106 /nfs/dbraw/zinc/10/61/06/900106106.db2.gz DHHPZNIGINHOQF-UHFFFAOYSA-N 2 0 408.590 4.344 20 0 HIADRP Oc1ccc(C2CC[NH+](CCOCC[NH+]3CCC(c4ccc(O)cc4)CC3)CC2)cc1 ZINC000485029394 900372528 /nfs/dbraw/zinc/37/25/28/900372528.db2.gz YYEGKABHMJRFPH-UHFFFAOYSA-N 2 0 424.585 4.173 20 0 HIADRP Cc1cc(C)c(NC(=O)CCC[NH+]2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(C)c1 ZINC000485085464 900399806 /nfs/dbraw/zinc/39/98/06/900399806.db2.gz BWWSGFOLQGPJLA-SZPZYZBQSA-N 2 0 415.622 4.152 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cc1 ZINC000485295335 900573156 /nfs/dbraw/zinc/57/31/56/900573156.db2.gz PFYYHORMVAXLCZ-ZCYQVOJMSA-N 2 0 420.601 4.041 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCC(=O)Nc2ccc(OCc3ccccc3)cc2)[C@H](C)C1 ZINC000485678184 900930193 /nfs/dbraw/zinc/93/01/93/900930193.db2.gz INBOEFQCGHHXFR-YKSBVNFPSA-N 2 0 409.574 4.256 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)CCC(C)(C)C(=O)Nc2cccc(C[NH+](C)C)c2)c1 ZINC000486807888 901865862 /nfs/dbraw/zinc/86/58/62/901865862.db2.gz ARKLDUYCCWUSFD-UHFFFAOYSA-N 2 0 424.589 4.193 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+]([C@H]2CCc3c2cccc3Cl)CC1 ZINC000487811669 902380685 /nfs/dbraw/zinc/38/06/85/902380685.db2.gz WYPNNGZJQSINDK-QFIPXVFZSA-N 2 0 403.998 4.032 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CC[NH+](C2CCC2)C[C@@H](C)C1 ZINC000488139334 902635313 /nfs/dbraw/zinc/63/53/13/902635313.db2.gz YKXUQGALLDBWIR-RTWAWAEBSA-N 2 0 412.622 4.077 20 0 HIADRP O=C(C[NH+]1CCC(C[NH+]2CCCC2)CC1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000488344026 902778358 /nfs/dbraw/zinc/77/83/58/902778358.db2.gz KUQMVTHOYHYSCG-NRFANRHFSA-N 2 0 424.416 4.465 20 0 HIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)CCCO2 ZINC000489495999 903423745 /nfs/dbraw/zinc/42/37/45/903423745.db2.gz KFTFGOCFKLRSRW-QHCPKHFHSA-N 2 0 409.574 4.105 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000489520324 903433537 /nfs/dbraw/zinc/43/35/37/903433537.db2.gz YOSOCIQECMJZHY-XUZZJYLKSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1 ZINC000489821351 903614709 /nfs/dbraw/zinc/61/47/09/903614709.db2.gz QQZCKTSTCMKBLZ-IEZKXTBUSA-N 2 0 420.601 4.033 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1 ZINC000489821353 903615761 /nfs/dbraw/zinc/61/57/61/903615761.db2.gz QQZCKTSTCMKBLZ-SDUSCBPUSA-N 2 0 420.601 4.033 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](c2ccccc2)c2ccccn2)[C@@H](c2ccccc2)C1 ZINC000490119833 903777457 /nfs/dbraw/zinc/77/74/57/903777457.db2.gz QKGJLBIFQRSKHP-CLJLJLNGSA-N 2 0 400.570 4.139 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+][C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000490124001 903780147 /nfs/dbraw/zinc/78/01/47/903780147.db2.gz HRCQHMFKHNDAQP-JOCHJYFZSA-N 2 0 416.407 4.154 20 0 HIADRP Fc1ccc(-c2nc(C[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)cs2)cc1 ZINC000506052515 914750559 /nfs/dbraw/zinc/75/05/59/914750559.db2.gz UQYPZDYUQGRHAX-UHFFFAOYSA-N 2 0 403.567 4.274 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H](c1ccccc1)c1ccc(OC(F)F)cc1)N1CC[NH+](C)CC1 ZINC000490163839 903805194 /nfs/dbraw/zinc/80/51/94/903805194.db2.gz HVOIIKDJQOCCBI-PKTZIBPZSA-N 2 0 417.544 4.239 20 0 HIADRP CSc1cccc([C@@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2cc(F)ccc2F)c1 ZINC000491002095 904361548 /nfs/dbraw/zinc/36/15/48/904361548.db2.gz BAMVANJJBQHOOC-HSZRJFAPSA-N 2 0 419.585 4.393 20 0 HIADRP Cc1ccc(C)c([C@H]([NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c2ccccc2)c1 ZINC000491054108 904396389 /nfs/dbraw/zinc/39/63/89/904396389.db2.gz PSQUAAPKZSHKNZ-AREMUKBSSA-N 2 0 415.581 4.474 20 0 HIADRP CC(C)c1ccccc1OC[C@@H](O)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000491074349 904412814 /nfs/dbraw/zinc/41/28/14/904412814.db2.gz IZWVXSGPPQWEER-DEOSSOPVSA-N 2 0 410.602 4.394 20 0 HIADRP CSc1cccc([C@H]([NH2+]CCCN2CC[NH+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491344103 904548174 /nfs/dbraw/zinc/54/81/74/904548174.db2.gz WKRONRLORCLIII-QFIPXVFZSA-N 2 0 405.558 4.003 20 0 HIADRP C[NH+]1CCC(C[NH2+]C2CC(c3ccc(Br)cc3)C2)(N2CCCCC2)CC1 ZINC000493884745 905242876 /nfs/dbraw/zinc/24/28/76/905242876.db2.gz ZTZAHJNDMLEWRK-UHFFFAOYSA-N 2 0 420.439 4.235 20 0 HIADRP C[C@@H]([NH2+]CC1=Cc2cc(Br)ccc2OC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512397048 921132962 /nfs/dbraw/zinc/13/29/62/921132962.db2.gz ZJAQNQRAUMOKAY-NVXWUHKLSA-N 2 0 405.380 4.468 20 0 HIADRP COc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1OCc1cccnc1 ZINC000512402239 921136552 /nfs/dbraw/zinc/13/65/52/921136552.db2.gz XSENEPZCMRBBLQ-DENIHFKCSA-N 2 0 409.574 4.412 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3cc(Br)cs3)cc2)CC1 ZINC000493970820 905319619 /nfs/dbraw/zinc/31/96/19/905319619.db2.gz UMOIBPHVGQETEH-MRXNPFEDSA-N 2 0 422.436 4.499 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000512407297 921141277 /nfs/dbraw/zinc/14/12/77/921141277.db2.gz VGTMIAPMTBMSRN-URXFXBBRSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@H](CCSc1ccccc1)[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000512438537 921161860 /nfs/dbraw/zinc/16/18/60/921161860.db2.gz GQAMERHVTDIWAN-ISKFKSNPSA-N 2 0 409.643 4.449 20 0 HIADRP CC(C)C[N@@H+]1Cc2cccc(NC(=O)c3ccc(C[NH+]4CCSCC4)cc3)c2C1 ZINC000494479956 905760833 /nfs/dbraw/zinc/76/08/33/905760833.db2.gz PMARBTBNILGYLO-UHFFFAOYSA-N 2 0 409.599 4.459 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000494615624 905864708 /nfs/dbraw/zinc/86/47/08/905864708.db2.gz KQCSLYUVTWSLNI-HSZRJFAPSA-N 2 0 424.589 4.292 20 0 HIADRP Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000495445622 906455821 /nfs/dbraw/zinc/45/58/21/906455821.db2.gz XXNZWLLDWLJTBR-CABCVRRESA-N 2 0 412.500 4.414 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccc2ccccc21 ZINC000495460702 906465685 /nfs/dbraw/zinc/46/56/85/906465685.db2.gz LLFWXDWVCSUTFV-CVDCTZTESA-N 2 0 401.554 4.388 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc2ccccc2c1 ZINC000495466305 906469022 /nfs/dbraw/zinc/46/90/22/906469022.db2.gz XLYCPLWJNDYCMP-CLOONOSVSA-N 2 0 401.554 4.388 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)N(C)Cc1cccc(F)c1 ZINC000497274666 906828052 /nfs/dbraw/zinc/82/80/52/906828052.db2.gz GJZZAYLISRGEBC-FQEVSTJZSA-N 2 0 411.565 4.338 20 0 HIADRP C[C@H](NC(=O)[C@H](C)[NH+]1CCC(CC[NH+](C)C)CC1)c1ccc(Cl)cc1Cl ZINC000512706485 921293276 /nfs/dbraw/zinc/29/32/76/921293276.db2.gz ANLXVWMTEHEBMQ-GJZGRUSLSA-N 2 0 400.394 4.223 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@@H]21)[NH2+][C@@H](C)c1ccccc1 ZINC000497686771 907192229 /nfs/dbraw/zinc/19/22/29/907192229.db2.gz KSOZSADMWZAHQK-NNWRFLSQSA-N 2 0 400.611 4.022 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc(F)cn1 ZINC000497843485 907323286 /nfs/dbraw/zinc/32/32/86/907323286.db2.gz QYNFMUAPDDUWRG-DEOSSOPVSA-N 2 0 415.553 4.197 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccco1 ZINC000498049162 907560089 /nfs/dbraw/zinc/56/00/89/907560089.db2.gz RMHJHTZYGRZGBN-UGNRZPKXSA-N 2 0 418.607 4.153 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)[C@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC1 ZINC000498506527 907978491 /nfs/dbraw/zinc/97/84/91/907978491.db2.gz AWFVUKIAOJOQAC-QFIPXVFZSA-N 2 0 403.586 4.008 20 0 HIADRP Clc1cc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc2c1OCCO2 ZINC000499147100 908506362 /nfs/dbraw/zinc/50/63/62/908506362.db2.gz OSTITOYSWLEMFC-MZADTFQBSA-N 2 0 412.961 4.439 20 0 HIADRP COc1ccc([C@@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N(C)C)cc1OC ZINC000499153218 908510617 /nfs/dbraw/zinc/51/06/17/908510617.db2.gz RHRNQUKPOQUSSP-UEQSERJNSA-N 2 0 423.601 4.092 20 0 HIADRP FC(F)(F)c1cccc(OCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000499186440 908541278 /nfs/dbraw/zinc/54/12/78/908541278.db2.gz KMRCUIMZGGUYNC-REPLKXPHSA-N 2 0 405.464 4.264 20 0 HIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]Cc2ccc(OCC[NH+]4CCCC4)cc2)C3)cc1 ZINC000499207248 908562461 /nfs/dbraw/zinc/56/24/61/908562461.db2.gz COFCUSHJKWQPHB-PBROBROCSA-N 3 0 419.613 4.446 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)CC1 ZINC000500077048 909547057 /nfs/dbraw/zinc/54/70/57/909547057.db2.gz WANBHJOLNLQPQH-LJQANCHMSA-N 2 0 414.421 4.253 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)NCc2cccc(C[NH+]3CCCC3)c2)c1 ZINC000500088957 909567664 /nfs/dbraw/zinc/56/76/64/909567664.db2.gz LQTZUBWBIZPTEC-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000500443082 909862642 /nfs/dbraw/zinc/86/26/42/909862642.db2.gz XHZDHXLZWPIEJK-RUZDIDTESA-N 2 0 422.519 4.453 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCc3ccccc3[C@H](c3ccccc3)[C@H]2C)CC1 ZINC000501033801 910249938 /nfs/dbraw/zinc/24/99/38/910249938.db2.gz VYTMGTLCSLUEPW-KCWPFWIISA-N 2 0 405.630 4.481 20 0 HIADRP CCc1ccc([C@H](C)NC(=O)[C@@H](C)[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000501048266 910259086 /nfs/dbraw/zinc/25/90/86/910259086.db2.gz QKLBSXWDVZRBFC-VQTJNVASSA-N 2 0 408.590 4.058 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1 ZINC000501055286 910267553 /nfs/dbraw/zinc/26/75/53/910267553.db2.gz AVORXCWYAUJGJV-HSZRJFAPSA-N 2 0 400.998 4.025 20 0 HIADRP Cc1ccc(Cl)cc1NC(=O)[C@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501076831 910277476 /nfs/dbraw/zinc/27/74/76/910277476.db2.gz HAGSMIKNUGLJIY-KRWDZBQOSA-N 2 0 400.954 4.219 20 0 HIADRP C[C@H](C(=O)Nc1ccccc1C(F)(F)F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501080680 910281473 /nfs/dbraw/zinc/28/14/73/910281473.db2.gz OHJNYNAEWDIRSF-MRXNPFEDSA-N 2 0 420.479 4.276 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+]CC(c3ccc(F)cc3)c3ccc(F)cc3)cn2)CC1 ZINC000501379156 910509952 /nfs/dbraw/zinc/50/99/52/910509952.db2.gz UZIKDKIVYIDXEO-UHFFFAOYSA-N 2 0 422.523 4.033 20 0 HIADRP c1ccc(CN2CC[NH+](CCCC[NH2+][C@H]3CCC[C@@H](c4cccnc4)C3)CC2)cc1 ZINC000501384623 910513841 /nfs/dbraw/zinc/51/38/41/910513841.db2.gz AGCATDODERNOAG-RSXGOPAZSA-N 2 0 406.618 4.295 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2coc(-c3c(F)cccc3F)n2)CC1 ZINC000501787673 910840754 /nfs/dbraw/zinc/84/07/54/910840754.db2.gz ZQBBOAMYINBARN-UHFFFAOYSA-N 2 0 407.505 4.190 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCC[C@@H]2c2ccc(Br)c(F)c2)CC1 ZINC000501887278 910904322 /nfs/dbraw/zinc/90/43/22/910904322.db2.gz MFDVCELOVAHIDV-HXUWFJFHSA-N 2 0 412.391 4.141 20 0 HIADRP CC(C)[C@@H]([NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)c1ccc(F)cc1 ZINC000502579410 911585722 /nfs/dbraw/zinc/58/57/22/911585722.db2.gz PJNBSNLUJRCHMM-HSZRJFAPSA-N 2 0 415.578 4.300 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)[NH+]2CCCC2)o1 ZINC000502779962 911803453 /nfs/dbraw/zinc/80/34/53/911803453.db2.gz ALRWPCNTRZWJJQ-HSZRJFAPSA-N 2 0 424.589 4.031 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)CC1 ZINC000502850210 911859279 /nfs/dbraw/zinc/85/92/79/911859279.db2.gz OVBZDBSERBSBHV-FQEVSTJZSA-N 2 0 400.611 4.214 20 0 HIADRP O=C(c1ccoc1)N1CCC([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)CC1 ZINC000503038466 912007695 /nfs/dbraw/zinc/00/76/95/912007695.db2.gz VRYPKADICUPXFS-UHFFFAOYSA-N 2 0 423.601 4.209 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000506913728 915712174 /nfs/dbraw/zinc/71/21/74/915712174.db2.gz BVICHYAIJXCALY-HKBOAZHASA-N 2 0 418.651 4.181 20 0 HIADRP C[C@@H](c1ccccc1)[N@H+](CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)C1CC1 ZINC000507698031 916478452 /nfs/dbraw/zinc/47/84/52/916478452.db2.gz MWLUQNREOKEGGT-IBGZPJMESA-N 2 0 409.599 4.400 20 0 HIADRP CC(C)[NH+](CCN(C)C(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)C(C)C ZINC000507956460 916814404 /nfs/dbraw/zinc/81/44/04/916814404.db2.gz OHOKKWOCSSIASE-UHFFFAOYSA-N 2 0 409.018 4.065 20 0 HIADRP CC(C)[NH+](CCN(C)C(=O)NCC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)C(C)C ZINC000508268747 917084868 /nfs/dbraw/zinc/08/48/68/917084868.db2.gz RVWIAFKJVPRQAR-GGAORHGYSA-N 2 0 402.627 4.047 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508697674 917458710 /nfs/dbraw/zinc/45/87/10/917458710.db2.gz MKACEMKOSBVHPQ-VUMQFKOGSA-N 3 0 421.629 4.296 20 0 HIADRP COc1ccc([C@H](CN[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)cc1 ZINC000508714417 917474875 /nfs/dbraw/zinc/47/48/75/917474875.db2.gz HBGQDZNIZCBGCK-QQSVUBKYSA-N 2 0 407.602 4.332 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722176 917484312 /nfs/dbraw/zinc/48/43/12/917484312.db2.gz RHTNABJQVROCOJ-AOYPEHQESA-N 3 0 420.645 4.089 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722179 917484956 /nfs/dbraw/zinc/48/49/56/917484956.db2.gz RHTNABJQVROCOJ-RSXGOPAZSA-N 3 0 420.645 4.089 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N[C@H](C)[C@@H](c1ccccc1C)[NH+](C)C)c1ccco1 ZINC000508877144 917630565 /nfs/dbraw/zinc/63/05/65/917630565.db2.gz DXLKUVZTCGUDNO-IKLNAOFOSA-N 2 0 400.567 4.008 20 0 HIADRP Cc1ccccc1[C@H]([C@H](C)NC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000508882004 917636057 /nfs/dbraw/zinc/63/60/57/917636057.db2.gz OWJGWFGTGLNGHW-RSEQLOHWSA-N 2 0 422.617 4.150 20 0 HIADRP Cc1ccccc1[C@H]([C@@H](C)NC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000508897236 917653058 /nfs/dbraw/zinc/65/30/58/917653058.db2.gz JHKDFMJSBRGDOP-BWKNWUBXSA-N 2 0 422.617 4.292 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc(-c4cnn(C)c4)s3)CC2)cc1 ZINC000509462498 918112314 /nfs/dbraw/zinc/11/23/14/918112314.db2.gz HPTLWOAILGHLTP-UHFFFAOYSA-N 2 0 410.587 4.159 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N(CC)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000509578375 918228217 /nfs/dbraw/zinc/22/82/17/918228217.db2.gz QGYFWRYXCRVJOM-ILWGZMRPSA-N 2 0 412.578 4.015 20 0 HIADRP C[C@@H]1C[C@H](CCNC(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000509793843 918401065 /nfs/dbraw/zinc/40/10/65/918401065.db2.gz YCXKABLFZDFVKF-AKFKNWHVSA-N 2 0 414.638 4.098 20 0 HIADRP C[C@H]1C[C@@H](CCNC(=O)C2CC[NH+](Cc3ccccc3)CC2)C[N@@H+]1Cc1ccccc1 ZINC000510165545 918717242 /nfs/dbraw/zinc/71/72/42/918717242.db2.gz INNHAJYVJONTNG-WIOPSUGQSA-N 2 0 419.613 4.316 20 0 HIADRP C[C@@H]1C[C@@H](CCNC(=O)C2CC[NH+](Cc3ccccc3)CC2)C[N@@H+]1Cc1ccccc1 ZINC000510165542 918717440 /nfs/dbraw/zinc/71/74/40/918717440.db2.gz INNHAJYVJONTNG-RCZVLFRGSA-N 2 0 419.613 4.316 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)N(C)C1CC[NH+](C(C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000510376241 918861344 /nfs/dbraw/zinc/86/13/44/918861344.db2.gz ICWWDKMKBVRKDQ-FQEVSTJZSA-N 2 0 413.528 4.420 20 0 HIADRP C[C@H](NC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000510492970 918940430 /nfs/dbraw/zinc/94/04/30/918940430.db2.gz SPARTXZMUMXBDH-REWPJTCUSA-N 2 0 412.622 4.125 20 0 HIADRP Cc1ccccc1[C@H]([C@H](C)NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000510547590 918992511 /nfs/dbraw/zinc/99/25/11/918992511.db2.gz OZOUEUDVSYZGEM-URXFXBBRSA-N 2 0 407.602 4.405 20 0 HIADRP C[C@@H]1C[C@H](CCNC(=O)Nc2cccc(OCC[NH+](C)C)c2)C[N@@H+]1Cc1ccccc1 ZINC000510658542 919098881 /nfs/dbraw/zinc/09/88/81/919098881.db2.gz UNKHRDQJDCYPLV-IRLDBZIGSA-N 2 0 424.589 4.049 20 0 HIADRP C[C@H]1C[C@H](CCNC(=O)Nc2cccc(OCC[NH+](C)C)c2)C[N@@H+]1Cc1ccccc1 ZINC000510658546 919099284 /nfs/dbraw/zinc/09/92/84/919099284.db2.gz UNKHRDQJDCYPLV-UNMCSNQZSA-N 2 0 424.589 4.049 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)c1cccc(C[N@H+](C)Cc2ccccc2)c1)c1ccsc1 ZINC000510736339 919182807 /nfs/dbraw/zinc/18/28/07/919182807.db2.gz PRVQWAXEZBECCV-QHCPKHFHSA-N 2 0 407.583 4.413 20 0 HIADRP CC(C)C[C@@H](CNC(=O)N1CCCC12CC[NH+](C)CC2)[NH2+][C@@H](C)c1ccccc1 ZINC000510934716 919458951 /nfs/dbraw/zinc/45/89/51/919458951.db2.gz QYXJCUPPVVXOKY-UNMCSNQZSA-N 2 0 400.611 4.022 20 0 HIADRP CC[NH+](CC)CCOc1ccc(NC(=O)c2oc3ccccc3c2C[NH+](C)C)cc1 ZINC000510937914 919461645 /nfs/dbraw/zinc/46/16/45/919461645.db2.gz IOBRHDHLWFUNJG-UHFFFAOYSA-N 2 0 409.530 4.467 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(Br)cc21 ZINC000510943027 919472532 /nfs/dbraw/zinc/47/25/32/919472532.db2.gz HLUDRSNQIYJEQI-IFMALSPDSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000510952595 919486726 /nfs/dbraw/zinc/48/67/26/919486726.db2.gz RSNDLWSWRMSDPB-HTAPYJJXSA-N 2 0 406.492 4.383 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(=O)N1CCc2sccc2C1 ZINC000511022463 919593884 /nfs/dbraw/zinc/59/38/84/919593884.db2.gz PMGHMFGTFMVAGA-OALUTQOASA-N 2 0 411.615 4.186 20 0 HIADRP FC(F)(F)c1cccc(N2CC[NH+](CCCC[NH2+][C@@H]3CCCSC3)CC2)c1 ZINC000511368003 919958407 /nfs/dbraw/zinc/95/84/07/919958407.db2.gz WJVVBXOJOHKFJZ-GOSISDBHSA-N 2 0 401.542 4.093 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000511375897 919976559 /nfs/dbraw/zinc/97/65/59/919976559.db2.gz FVCJVALODMVCMG-RPWUZVMVSA-N 2 0 416.009 4.342 20 0 HIADRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+]CC(c2ccccc2)c2ccccc2)CC1 ZINC000511488458 920096194 /nfs/dbraw/zinc/09/61/94/920096194.db2.gz NXMRBXRJSPZHNH-UHFFFAOYSA-N 2 0 407.602 4.035 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2cccc(-c3ccccc3)c2)CC1 ZINC000511669194 920335263 /nfs/dbraw/zinc/33/52/63/920335263.db2.gz WNLDUJFIRVSPRG-UHFFFAOYSA-N 2 0 407.602 4.270 20 0 HIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cnn(-c3ccc(C(F)(F)F)cc3)c2)cc1F ZINC000512066976 920833707 /nfs/dbraw/zinc/83/37/07/920833707.db2.gz IPVZKWKPLJIWJM-UHFFFAOYSA-N 2 0 406.427 4.382 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000512150904 920891834 /nfs/dbraw/zinc/89/18/34/920891834.db2.gz XCLGMZXRTHHMFK-VMGRFDJRSA-N 2 0 403.876 4.292 20 0 HIADRP CCOc1ccccc1NC(=O)CC[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512284829 921039536 /nfs/dbraw/zinc/03/95/36/921039536.db2.gz DSRMCAFIKITLNW-RUZDIDTESA-N 2 0 407.558 4.012 20 0 HIADRP C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512318371 921068465 /nfs/dbraw/zinc/06/84/65/921068465.db2.gz OODZVCCZIQIQIK-MSOLQXFVSA-N 2 0 403.998 4.187 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512323555 921074179 /nfs/dbraw/zinc/07/41/79/921074179.db2.gz NOXQHMGBKYVGMR-BRWVUGGUSA-N 2 0 422.411 4.409 20 0 HIADRP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3cccc(OCc4ccccc4Cl)c3)C2)CC1 ZINC000513486349 921839675 /nfs/dbraw/zinc/83/96/75/921839675.db2.gz XEEPCWHFHAUMBX-QFIPXVFZSA-N 2 0 413.993 4.131 20 0 HIADRP Cc1nc(COc2ccc(C[NH2+]CC[C@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)cc2)no1 ZINC000513546024 921883388 /nfs/dbraw/zinc/88/33/88/921883388.db2.gz VIYHXQVSSUEQCB-XXBNENTESA-N 2 0 420.557 4.347 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NC2CC[NH+](Cc3ccccc3)CC2)[NH+]2CCCC2)cc1 ZINC000513882643 922211908 /nfs/dbraw/zinc/21/19/08/922211908.db2.gz MZHODPDGIHJVHY-VWLOTQADSA-N 2 0 420.601 4.096 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)c(C)c1OC ZINC000514089363 922412244 /nfs/dbraw/zinc/41/22/44/922412244.db2.gz PARYZQDSJKYRER-WSTZPKSXSA-N 2 0 412.574 4.472 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)C1 ZINC000514107047 922437838 /nfs/dbraw/zinc/43/78/38/922437838.db2.gz GDHRBKVGMYLRAE-QFIPXVFZSA-N 2 0 414.638 4.374 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cccc(OCc3ccc(F)cc3)c2)C1 ZINC000514237198 922576542 /nfs/dbraw/zinc/57/65/42/922576542.db2.gz FGFWWGNOLFRHHO-RUZDIDTESA-N 2 0 420.528 4.261 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1 ZINC000514438380 922626862 /nfs/dbraw/zinc/62/68/62/922626862.db2.gz QMRKJFGDVOUMHH-XMMPIXPASA-N 2 0 408.590 4.165 20 0 HIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccc2c(c1)OCCO2 ZINC000514682385 922752661 /nfs/dbraw/zinc/75/26/61/922752661.db2.gz IXFCWJBJRPRHEN-OFNKIYASSA-N 2 0 422.569 4.037 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CCCc2ccc(Br)cc21 ZINC000514853110 922825646 /nfs/dbraw/zinc/82/56/46/922825646.db2.gz UFUGILJIRQQGRW-FQEVSTJZSA-N 2 0 418.379 4.342 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CCN(C(=O)c2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000515140535 922947053 /nfs/dbraw/zinc/94/70/53/922947053.db2.gz XBCULRNJYDDVJF-UHFFFAOYSA-N 2 0 405.586 4.267 20 0 HIADRP Cc1ccccc1CCNC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000515518806 923149824 /nfs/dbraw/zinc/14/98/24/923149824.db2.gz OIUOWHQOHVPDHF-FCHUYYIVSA-N 2 0 407.602 4.206 20 0 HIADRP Fc1cc2cccnc2c(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000516020510 923505551 /nfs/dbraw/zinc/50/55/51/923505551.db2.gz IONHWUWTMXQFID-HSZRJFAPSA-N 2 0 419.544 4.392 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc2)CC1 ZINC000516560904 923797192 /nfs/dbraw/zinc/79/71/92/923797192.db2.gz GZEJBNNBBVTRIE-OAQYLSRUSA-N 2 0 400.611 4.068 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000517472759 924214072 /nfs/dbraw/zinc/21/40/72/924214072.db2.gz BWKHMMBXHDNBCV-QFIPXVFZSA-N 2 0 420.601 4.090 20 0 HIADRP CC[N@H+](C)Cc1cccc(C[NH2+]CC2=Cc3cc(Br)ccc3OC2)c1 ZINC000517547503 924258327 /nfs/dbraw/zinc/25/83/27/924258327.db2.gz WQGSSOHKBOMLRV-UHFFFAOYSA-N 2 0 401.348 4.466 20 0 HIADRP COc1ccc(C2(C[NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CCOCC2)cc1 ZINC000518007657 926948273 /nfs/dbraw/zinc/94/82/73/926948273.db2.gz MSIVWPSSECTOHE-FYYLOGMGSA-N 2 0 408.586 4.244 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)c2ccccc2)CC1 ZINC000518363413 927221865 /nfs/dbraw/zinc/22/18/65/927221865.db2.gz FTDCNIRWZIRGFO-FGZHOGPDSA-N 2 0 414.619 4.123 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)C1 ZINC000518629019 927389373 /nfs/dbraw/zinc/38/93/73/927389373.db2.gz YEQNYRIDASVSNS-QPPBQGQZSA-N 2 0 412.622 4.078 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000518774444 927487017 /nfs/dbraw/zinc/48/70/17/927487017.db2.gz IEMVYMPLCRCFJH-UHFFFAOYSA-N 2 0 420.395 4.072 20 0 HIADRP O=C(NC1CC1)[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccccc1 ZINC000519333845 927886411 /nfs/dbraw/zinc/88/64/11/927886411.db2.gz JEBOKYDJGWVBOZ-HSZRJFAPSA-N 2 0 411.977 4.162 20 0 HIADRP CCOc1cc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)ccc1OCC(F)(F)F ZINC000519673171 928045985 /nfs/dbraw/zinc/04/59/85/928045985.db2.gz SVHXQXGOYAAUES-GOSISDBHSA-N 2 0 400.485 4.190 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)CC1 ZINC000519935842 928170285 /nfs/dbraw/zinc/17/02/85/928170285.db2.gz DNRBBHOUGXVRGH-UHFFFAOYSA-N 2 0 414.638 4.324 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 ZINC000520214378 928392232 /nfs/dbraw/zinc/39/22/32/928392232.db2.gz YXHOVBHNBJUEIY-UHFFFAOYSA-N 2 0 409.496 4.329 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H](O)COc1cccc2ccccc21 ZINC000520686649 928734345 /nfs/dbraw/zinc/73/43/45/928734345.db2.gz WSPQKEHSVGKNQB-JHMXWDHMSA-N 2 0 404.554 4.080 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1NC[C@@H]1C[NH+](Cc2ccccc2)CCCO1 ZINC000521282897 929099736 /nfs/dbraw/zinc/09/97/36/929099736.db2.gz VJVWNVYUHYTLOS-FTJBHMTQSA-N 2 0 421.629 4.168 20 0 HIADRP C[NH+](C)CCn1ccc2ccc(NC(=O)[C@H]3CCC[N@H+](Cc4ccccc4)C3)cc21 ZINC000524812420 929839892 /nfs/dbraw/zinc/83/98/92/929839892.db2.gz ITVWEFRNFZDXFD-QFIPXVFZSA-N 2 0 404.558 4.054 20 0 HIADRP O=C(NC[C@H]1CCC[N@H+](Cc2cccs2)C1)[C@H]1CCCC[NH+]1Cc1ccccc1 ZINC000524968856 929933017 /nfs/dbraw/zinc/93/30/17/929933017.db2.gz VPNVPKLVOOUSAB-FYYLOGMGSA-N 2 0 411.615 4.131 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000526945021 930555090 /nfs/dbraw/zinc/55/50/90/930555090.db2.gz KSTLHYIDFSFANV-RTBURBONSA-N 2 0 400.588 4.173 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000526945019 930555142 /nfs/dbraw/zinc/55/51/42/930555142.db2.gz KSTLHYIDFSFANV-OALUTQOASA-N 2 0 400.588 4.173 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NC1CC[NH+](C(C)(C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000530569158 930752792 /nfs/dbraw/zinc/75/27/92/930752792.db2.gz BMZJWJNEVDWKHY-LJQANCHMSA-N 2 0 413.528 4.467 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Cl)cc1 ZINC000530599570 930765154 /nfs/dbraw/zinc/76/51/54/930765154.db2.gz ZNSCFGSHRATVRA-JOCHJYFZSA-N 2 0 414.981 4.038 20 0 HIADRP Clc1ccc2ncc(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)n2c1 ZINC000530664405 930791049 /nfs/dbraw/zinc/79/10/49/930791049.db2.gz MNDUZHRBGCCKDZ-UHFFFAOYSA-N 2 0 412.965 4.149 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3csc(Br)c3)CC2)CC1 ZINC000530714029 930805917 /nfs/dbraw/zinc/80/59/17/930805917.db2.gz QDFHJFPLJLHELT-UHFFFAOYSA-N 2 0 414.457 4.139 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)CC1 ZINC000530727708 930809133 /nfs/dbraw/zinc/80/91/33/930809133.db2.gz KTUCRHKTOFUQGO-FQEVSTJZSA-N 2 0 420.601 4.155 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NCc1ccccc1C[NH+]1CCCC1)c1ccc(Cl)cc1 ZINC000530839339 930837644 /nfs/dbraw/zinc/83/76/44/930837644.db2.gz ONYSZEPBWPILBS-JOCHJYFZSA-N 2 0 414.981 4.038 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)CC1 ZINC000530966290 930870962 /nfs/dbraw/zinc/87/09/62/930870962.db2.gz UWIJRQKIXQMIMR-UHFFFAOYSA-N 2 0 420.601 4.299 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)C[C@@H]1C ZINC000531140681 930940459 /nfs/dbraw/zinc/94/04/59/930940459.db2.gz FNHLALPFUPLUHT-CPPMQADQSA-N 2 0 410.602 4.267 20 0 HIADRP Clc1ccc2nc(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)cn2c1 ZINC000531142020 930941911 /nfs/dbraw/zinc/94/19/11/930941911.db2.gz GBAXDBRDOWXWKV-UHFFFAOYSA-N 2 0 412.965 4.149 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)CC1 ZINC000531205420 930964735 /nfs/dbraw/zinc/96/47/35/930964735.db2.gz PLNKKTQOXREUPI-OAQYLSRUSA-N 2 0 420.601 4.297 20 0 HIADRP c1nc(-c2ccccc2)[nH]c1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531250826 930982108 /nfs/dbraw/zinc/98/21/08/930982108.db2.gz VJUTYMKKXDIHGU-UHFFFAOYSA-N 2 0 404.558 4.238 20 0 HIADRP COc1ccccc1-c1ccc(C[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)cc1 ZINC000531430024 931053232 /nfs/dbraw/zinc/05/32/32/931053232.db2.gz WYATXILALMMHCW-UHFFFAOYSA-N 2 0 423.601 4.079 20 0 HIADRP Cc1ccc(-n2cc(C[NH2+]C3CCN(C4CC[NH+](C)CC4)CC3)c(C(C)(C)C)n2)cc1 ZINC000531583066 931108884 /nfs/dbraw/zinc/10/88/84/931108884.db2.gz KUUIYAIMXMETMJ-UHFFFAOYSA-N 2 0 423.649 4.126 20 0 HIADRP CN(c1ccccc1C[NH2+]CCNc1ncc(Cl)cc1Cl)C1CC[NH+](C)CC1 ZINC000531595413 931114579 /nfs/dbraw/zinc/11/45/79/931114579.db2.gz PHFIFSMATOKNOU-UHFFFAOYSA-N 2 0 422.404 4.121 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1cccc(Br)c1)C1CC[NH+](C)CC1 ZINC000531596094 931115389 /nfs/dbraw/zinc/11/53/89/931115389.db2.gz KMVCSQAUNCVVRY-UHFFFAOYSA-N 2 0 402.380 4.269 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccc(OCC(F)(F)F)cc1)C1CC[NH+](C)CC1 ZINC000531597357 931116804 /nfs/dbraw/zinc/11/68/04/931116804.db2.gz DMOMOPATLYSRGQ-UHFFFAOYSA-N 2 0 421.507 4.448 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](CC(=O)N(C)Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000531645612 931137943 /nfs/dbraw/zinc/13/79/43/931137943.db2.gz QRKCYZGZQATDFB-UHFFFAOYSA-N 2 0 400.394 4.004 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1)C1CCOCC1 ZINC000531683277 931150971 /nfs/dbraw/zinc/15/09/71/931150971.db2.gz DHNHXQXKTWBQNO-SANMLTNESA-N 2 0 407.602 4.304 20 0 HIADRP C[C@@H](CC(=O)N(C)c1ccccc1)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000531724955 931175029 /nfs/dbraw/zinc/17/50/29/931175029.db2.gz LGCWAJSWHZIGGI-FQEVSTJZSA-N 2 0 405.542 4.443 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000531737592 931179081 /nfs/dbraw/zinc/17/90/81/931179081.db2.gz BLUCAPLGGCKUHL-OAHLLOKOSA-N 2 0 408.384 4.163 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000531943310 931256270 /nfs/dbraw/zinc/25/62/70/931256270.db2.gz RVVCFFPMMUMKGU-LJQANCHMSA-N 2 0 413.993 4.463 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1ccc(S(C)(=O)=O)cc1 ZINC000531946362 931258684 /nfs/dbraw/zinc/25/86/84/931258684.db2.gz FDAWRMVBRYPDRB-MOPGFXCFSA-N 2 0 400.588 4.315 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531967840 931269101 /nfs/dbraw/zinc/26/91/01/931269101.db2.gz WEIBLEOMBYJYOR-CQSZACIVSA-N 2 0 422.342 4.157 20 0 HIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000531989122 931277352 /nfs/dbraw/zinc/27/73/52/931277352.db2.gz DLLRWBUJYVXIHT-SFHVURJKSA-N 2 0 421.614 4.425 20 0 HIADRP CN(c1ccccc1C[NH2+]C1CCN(Cc2ccc(F)cc2)CC1)C1CC[NH+](C)CC1 ZINC000532107301 931315529 /nfs/dbraw/zinc/31/55/29/931315529.db2.gz VFSCRGBYSBJGQO-UHFFFAOYSA-N 2 0 424.608 4.110 20 0 HIADRP Fc1cc2cccnc2c(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)c1 ZINC000532113722 931318218 /nfs/dbraw/zinc/31/82/18/931318218.db2.gz TVDOGMYRVZLRBC-UHFFFAOYSA-N 2 0 406.549 4.062 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000532196140 931345124 /nfs/dbraw/zinc/34/51/24/931345124.db2.gz ZDDKAAUVPJJBER-STQMWFEESA-N 2 0 403.876 4.150 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccccc1OCC(=O)N(C)C ZINC000532201831 931347007 /nfs/dbraw/zinc/34/70/07/931347007.db2.gz AOBHDWJAHCACLV-DEOSSOPVSA-N 2 0 423.601 4.380 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccccc1C(F)(F)F ZINC000532230554 931364454 /nfs/dbraw/zinc/36/44/54/931364454.db2.gz ADXOVAVHGHPMCL-VQIMIIECSA-N 2 0 419.491 4.254 20 0 HIADRP CC[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1OC(F)F ZINC000532481120 931455707 /nfs/dbraw/zinc/45/57/07/931455707.db2.gz OXLKUMSYHOTUKE-RTWAWAEBSA-N 2 0 403.517 4.317 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)OCCCO2 ZINC000532483201 931456429 /nfs/dbraw/zinc/45/64/29/931456429.db2.gz WGCNAPBBOBOUGX-ROUUACIJSA-N 2 0 413.537 4.151 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccc(S(C)(=O)=O)cc1 ZINC000532514904 931470539 /nfs/dbraw/zinc/47/05/39/931470539.db2.gz VYQSSLKZBFWRLG-KRWDZBQOSA-N 2 0 421.006 4.306 20 0 HIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1sccc1Br ZINC000532525534 931475039 /nfs/dbraw/zinc/47/50/39/931475039.db2.gz CHLHLFWRRULDRP-HNNXBMFYSA-N 2 0 400.430 4.112 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H]1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1 ZINC000533090533 931768511 /nfs/dbraw/zinc/76/85/11/931768511.db2.gz SVTQEPZHFOVMTF-NJYVYQBISA-N 2 0 411.590 4.228 20 0 HIADRP CC1CC[NH+](CCCC[NH2+][C@H]2CCCC[C@H](N3C(=O)c4ccccc4C3=O)C2)CC1 ZINC000533090493 931768875 /nfs/dbraw/zinc/76/88/75/931768875.db2.gz MHWJOCNDKPDXML-SFTDATJTSA-N 2 0 411.590 4.086 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCC2(CC)CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC000533133568 931778291 /nfs/dbraw/zinc/77/82/91/931778291.db2.gz WXYZCNXBERFGHU-JTHBVZDNSA-N 2 0 414.638 4.193 20 0 HIADRP O=C(CC[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)N[C@@H](c1cccs1)c1ccccc1 ZINC000533293224 931830697 /nfs/dbraw/zinc/83/06/97/931830697.db2.gz CGCNSCAOVLQLEU-ZJSXRUAMSA-N 2 0 411.615 4.294 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)CC1 ZINC000533408196 931860154 /nfs/dbraw/zinc/86/01/54/931860154.db2.gz RZLHNTBBXNBEQW-UHFFFAOYSA-N 2 0 405.892 4.350 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1)c1ccccc1Cl ZINC000533763321 932018671 /nfs/dbraw/zinc/01/86/71/932018671.db2.gz BPHWGJCZZGVYDA-KNQAVFIVSA-N 2 0 421.029 4.096 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2c(Cl)oc3ccccc32)cc1 ZINC000534168045 932312381 /nfs/dbraw/zinc/31/23/81/932312381.db2.gz KTCDVZHIEKTKGW-UHFFFAOYSA-N 2 0 411.933 4.202 20 0 HIADRP C[N@@H+]1CC[C@@H](CNC(=O)NCC(C)(C)[NH+]2CCCCC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000534234219 932354237 /nfs/dbraw/zinc/35/42/37/932354237.db2.gz BRIWIJDDLPVZTP-PXNSSMCTSA-N 2 0 424.992 4.036 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)NC[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000534243185 932361265 /nfs/dbraw/zinc/36/12/65/932361265.db2.gz VVCNJHKMYDZIGZ-LAUBAEHRSA-N 2 0 418.944 4.355 20 0 HIADRP C[N@@H+]1CC[C@@H](CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000534971475 932868770 /nfs/dbraw/zinc/86/87/70/932868770.db2.gz OJGSXAZKBAXKNE-JXFKEZNVSA-N 2 0 424.992 4.034 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000535176456 932991878 /nfs/dbraw/zinc/99/18/78/932991878.db2.gz ZTOFOPKIKALBRM-FGCOXFRFSA-N 2 0 414.638 4.125 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000535176457 932992225 /nfs/dbraw/zinc/99/22/25/932992225.db2.gz ZTOFOPKIKALBRM-NKKJXINNSA-N 2 0 414.638 4.125 20 0 HIADRP COc1ccc(OCc2ccccn2)c(C[NH2+]Cc2ccc(C[NH+](C)C)c(F)c2)c1 ZINC000535680316 933330635 /nfs/dbraw/zinc/33/06/35/933330635.db2.gz JQQHBFWQOLNBNO-UHFFFAOYSA-N 2 0 409.505 4.160 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)NC[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000535683630 933337082 /nfs/dbraw/zinc/33/70/82/933337082.db2.gz LANITUWAVVHCAH-DYESRHJHSA-N 2 0 424.992 4.036 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cn(-c3ccccc3)nc2-c2cccnc2)CC1 ZINC000535811996 933406961 /nfs/dbraw/zinc/40/69/61/933406961.db2.gz XYMVYCYSVGFAIU-UHFFFAOYSA-N 2 0 403.574 4.487 20 0 HIADRP CN1CC[C@H](NC(=O)Nc2cccc(C[NH+](C)C)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000535839376 933424282 /nfs/dbraw/zinc/42/42/82/933424282.db2.gz YGJDJIKXEYFKEB-VQTJNVASSA-N 2 0 404.917 4.108 20 0 HIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cn(Cc3ccccc3)nc2-c2cccnc2)[C@@H](C)C1 ZINC000537615072 938333484 /nfs/dbraw/zinc/33/34/84/938333484.db2.gz KSFYPAPDKRVVKF-GBXCKJPGSA-N 2 0 403.574 4.156 20 0 HIADRP C[NH+](C)CCOC1CC[NH+](Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 ZINC000537628792 938339867 /nfs/dbraw/zinc/33/98/67/938339867.db2.gz BEQOJJNJEUDPJH-UHFFFAOYSA-N 2 0 415.965 4.135 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CC1 ZINC000537658434 938348510 /nfs/dbraw/zinc/34/85/10/938348510.db2.gz GHGFZASFGYYZHF-UHFFFAOYSA-N 2 0 424.511 4.214 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)c2)CC1 ZINC000537672372 938350744 /nfs/dbraw/zinc/35/07/44/938350744.db2.gz XOQAUKIXOPFVIW-UHFFFAOYSA-N 2 0 400.611 4.392 20 0 HIADRP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000537786125 938375507 /nfs/dbraw/zinc/37/55/07/938375507.db2.gz ZNBRYOGIBKIVEV-UHFFFAOYSA-N 2 0 406.574 4.056 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)CC1)CC1CC1 ZINC000537807985 938381516 /nfs/dbraw/zinc/38/15/16/938381516.db2.gz HZVWANMUDYXVGM-UHFFFAOYSA-N 2 0 418.670 4.327 20 0 HIADRP Fc1cc(Br)cc2c1CC[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000537935644 938421951 /nfs/dbraw/zinc/42/19/51/938421951.db2.gz AJRFTETUECVIOT-HXUWFJFHSA-N 2 0 404.327 4.477 20 0 HIADRP OC[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1ccccc1C(F)(F)F ZINC000537957357 938432482 /nfs/dbraw/zinc/43/24/82/938432482.db2.gz CEJLTQOBEJMAJG-HXUWFJFHSA-N 2 0 420.519 4.153 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000537959214 938434690 /nfs/dbraw/zinc/43/46/90/938434690.db2.gz YDMRKLRLZNRMIG-HMXCVIKNSA-N 2 0 415.578 4.294 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H]2CCCOc3cc(Br)ccc32)C[C@H](C)O1 ZINC000537971355 938441745 /nfs/dbraw/zinc/44/17/45/938441745.db2.gz LDPJDGYQQUXQAM-JTDSTZFVSA-N 2 0 411.384 4.142 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H]2CCCOc3cc(Br)ccc32)C[C@@H](C)O1 ZINC000537971356 938442036 /nfs/dbraw/zinc/44/20/36/938442036.db2.gz LDPJDGYQQUXQAM-MDZRGWNJSA-N 2 0 411.384 4.142 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](c2ccc3[nH]c(=O)oc3c2)C(C)C)CC1 ZINC000538061761 938491417 /nfs/dbraw/zinc/49/14/17/938491417.db2.gz IHHLRPCXJGFSPH-XMMPIXPASA-N 2 0 422.573 4.158 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000538115131 938506276 /nfs/dbraw/zinc/50/62/76/938506276.db2.gz YWIXAQPVZWOZCZ-NJYVYQBISA-N 2 0 407.396 4.258 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@@H]1CCN(c3c(F)cccc3F)C1)c1ccccc1O2 ZINC000538293564 938584964 /nfs/dbraw/zinc/58/49/64/938584964.db2.gz IVXKQZPLYZWXEV-DYESRHJHSA-N 2 0 413.512 4.121 20 0 HIADRP Cc1ccccc1[C@H]([NH2+][C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)C1CC1 ZINC000538390463 938609366 /nfs/dbraw/zinc/60/93/66/938609366.db2.gz ALIZXOIYSFMFPR-CJFMBICVSA-N 2 0 405.586 4.205 20 0 HIADRP Fc1cccc(Cl)c1CN1CCC([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)CC1 ZINC000539036797 938776687 /nfs/dbraw/zinc/77/66/87/938776687.db2.gz AAQIOEZIVFDQBD-UHFFFAOYSA-N 2 0 416.972 4.345 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(Br)cc2)C1 ZINC000539052678 938783752 /nfs/dbraw/zinc/78/37/52/938783752.db2.gz KJIXMIRHPCYUFE-DLBZAZTESA-N 2 0 410.400 4.124 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]Cc1ccnc(OCC[NH+](C)C)c1 ZINC000539058578 938786374 /nfs/dbraw/zinc/78/63/74/938786374.db2.gz IFULMHYHYWCLIW-HNNXBMFYSA-N 2 0 414.550 4.444 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000539063473 938789295 /nfs/dbraw/zinc/78/92/95/938789295.db2.gz GWOWBBUPBVHVHM-QAMTZSDWSA-N 2 0 401.378 4.117 20 0 HIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000539072327 938793621 /nfs/dbraw/zinc/79/36/21/938793621.db2.gz PMUUNNGZOISQQW-ZCNNSNEGSA-N 2 0 404.599 4.100 20 0 HIADRP CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000539072320 938793892 /nfs/dbraw/zinc/79/38/92/938793892.db2.gz PMUUNNGZOISQQW-AQNXPRMDSA-N 2 0 404.599 4.100 20 0 HIADRP C[C@H]([NH2+]CCC[NH2+][C@@H](C)c1ccc(-n2cccn2)cc1)c1ccc(-n2cccn2)cc1 ZINC000539343472 938845483 /nfs/dbraw/zinc/84/54/83/938845483.db2.gz YXAWHXGASRRLLV-SFTDATJTSA-N 2 0 414.557 4.450 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCc1ccn(-c3ccc(F)cc3)n1)c1ccccc1O2 ZINC000539396229 938854254 /nfs/dbraw/zinc/85/42/54/938854254.db2.gz FTYDSWCPCGFUBB-QHCPKHFHSA-N 2 0 420.532 4.132 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc(F)cc(Br)c1 ZINC000539508450 938870684 /nfs/dbraw/zinc/87/06/84/938870684.db2.gz AGNWGZCWOOJRBS-GOSISDBHSA-N 2 0 410.331 4.165 20 0 HIADRP Cc1cc(Br)cc2cc([C@H]([NH2+]CC3(O)CC[NH+](C)CC3)C(C)C)oc21 ZINC000539546158 938877693 /nfs/dbraw/zinc/87/76/93/938877693.db2.gz HPKATDWGRJZIJI-GOSISDBHSA-N 2 0 409.368 4.247 20 0 HIADRP CC(C)Oc1ccc([C@H]2CCC[C@@H]2[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)cc1 ZINC000539609428 938887648 /nfs/dbraw/zinc/88/76/48/938887648.db2.gz GXDZGKACNAGTGV-RPBOFIJWSA-N 2 0 423.601 4.191 20 0 HIADRP C[C@H](Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000539630408 938890344 /nfs/dbraw/zinc/89/03/44/938890344.db2.gz PZPPGALGQGTDFT-NRFANRHFSA-N 2 0 422.617 4.332 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+](Cc2csc3ccccc23)CC1)Cc1ccccc1 ZINC000539836259 938952990 /nfs/dbraw/zinc/95/29/90/938952990.db2.gz ZNHYDPZTLGVUHA-UHFFFAOYSA-N 2 0 421.610 4.362 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)[C@H](C)C1 ZINC000539874122 938963274 /nfs/dbraw/zinc/96/32/74/938963274.db2.gz KMHBFWDZMSWTSL-NFBKMPQASA-N 2 0 400.611 4.155 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)Nc1cccc2ccccc21 ZINC000540044703 939048062 /nfs/dbraw/zinc/04/80/62/939048062.db2.gz ZJOAEEYYOJHOOU-UHFFFAOYSA-N 2 0 402.542 4.412 20 0 HIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CCN(C(=O)CCc3ccccc3)CC2)CC1 ZINC000540119229 939079556 /nfs/dbraw/zinc/07/95/56/939079556.db2.gz LZGOYNUPSLWUJR-PXDATVDWSA-N 2 0 411.634 4.243 20 0 HIADRP CC[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccccc1OCC(=O)N(C)C ZINC000540144321 939089948 /nfs/dbraw/zinc/08/99/48/939089948.db2.gz NCJVBDYKANBCHT-BBHUYCHWSA-N 2 0 415.622 4.237 20 0 HIADRP C[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)c2cccc(Br)c21 ZINC000540159138 939095602 /nfs/dbraw/zinc/09/56/02/939095602.db2.gz XHWADELKWRWHRZ-ZVEHZALQSA-N 2 0 407.396 4.355 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000540172379 939102904 /nfs/dbraw/zinc/10/29/04/939102904.db2.gz BIFATFPXKJODTA-QGZVFWFLSA-N 2 0 419.491 4.382 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ncc(Br)s1 ZINC000540192968 939118882 /nfs/dbraw/zinc/11/88/82/939118882.db2.gz WKOZNUKDUKYAEM-INIZCTEOSA-N 2 0 423.424 4.159 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](c3ccc4[nH]c(=O)oc4c3)C(C)C)cc2)CC1 ZINC000540263292 939176880 /nfs/dbraw/zinc/17/68/80/939176880.db2.gz QOTWFQCTVYTSQB-XMMPIXPASA-N 2 0 422.573 4.158 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000540299509 939186294 /nfs/dbraw/zinc/18/62/94/939186294.db2.gz JORFHRCMZBTWCO-QHCPKHFHSA-N 2 0 409.530 4.495 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000540302745 939187911 /nfs/dbraw/zinc/18/79/11/939187911.db2.gz SLCZIIADBXJACH-OAQYLSRUSA-N 2 0 421.507 4.484 20 0 HIADRP CCSc1ccc([C@H](C)[NH2+]CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000540401644 939235445 /nfs/dbraw/zinc/23/54/45/939235445.db2.gz NPLJIQPBBCBAML-IBGZPJMESA-N 2 0 411.615 4.361 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1ccccc1C(F)(F)F)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000540442335 939251902 /nfs/dbraw/zinc/25/19/02/939251902.db2.gz RSDOUWOTJYGZCZ-JENIJYKNSA-N 2 0 419.491 4.135 20 0 HIADRP Cc1ccc([C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C2CCCC2)o1 ZINC000540501907 939279430 /nfs/dbraw/zinc/27/94/30/939279430.db2.gz WSLDGJSATKOGMB-DEOSSOPVSA-N 2 0 409.574 4.435 20 0 HIADRP C[N@H+](CC(=O)NC1CC[NH+](C2CC2)CC1)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000540676710 939336743 /nfs/dbraw/zinc/33/67/43/939336743.db2.gz YIEIDDWMDKSFDB-SFTDATJTSA-N 2 0 423.523 4.016 20 0 HIADRP CCC[NH+]1CCC(NC(=O)N[C@H]2CCN(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000540711762 939345460 /nfs/dbraw/zinc/34/54/60/939345460.db2.gz AHYFXNJCPXYMKY-SFTDATJTSA-N 2 0 424.992 4.177 20 0 HIADRP COc1ccc([C@@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000540908542 939415379 /nfs/dbraw/zinc/41/53/79/939415379.db2.gz HFZOFIVCNVHQPO-HSZRJFAPSA-N 2 0 401.982 4.055 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)NCC[NH+]2CCCCC2)cc1)C[C@@H]1CCCCO1 ZINC000541031919 939436169 /nfs/dbraw/zinc/43/61/69/939436169.db2.gz JIBWQKWWPQFLAM-QHCPKHFHSA-N 2 0 416.610 4.074 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N[C@H]2CC[NH+](C)[C@H](C)C2)cc1)C[C@H]1CCCCO1 ZINC000541034157 939436891 /nfs/dbraw/zinc/43/68/91/939436891.db2.gz YLYGBFGVUWUAKL-WTIAFYNJSA-N 2 0 416.610 4.070 20 0 HIADRP C[C@@H]1[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C[C@@H]1c1ccccc1 ZINC000541238638 939487091 /nfs/dbraw/zinc/48/70/91/939487091.db2.gz YBFNRTWQCCNEKZ-XZZVZQAVSA-N 2 0 408.586 4.458 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]CC1(C(=O)Nc2ccc(C)c(C)c2)CCCC1 ZINC000541315917 939490641 /nfs/dbraw/zinc/49/06/41/939490641.db2.gz WNWSDCMZUIMLFC-UHFFFAOYSA-N 2 0 417.557 4.481 20 0 HIADRP C[C@H](CCNC(=O)NC[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1)[NH+]1CCCCC1 ZINC000541480282 939532320 /nfs/dbraw/zinc/53/23/20/939532320.db2.gz MSTABIQVJRMJBO-PLMTUMEDSA-N 2 0 424.992 4.036 20 0 HIADRP Cc1cc([C@@H]([NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)c2cccnc2)ccc1F ZINC000541543854 939549278 /nfs/dbraw/zinc/54/92/78/939549278.db2.gz SRFLLJJKBYKRCQ-XMMPIXPASA-N 2 0 410.581 4.158 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](CC/C=C\c3ccc(Br)cc3)CC2)CC1 ZINC000541663567 939594981 /nfs/dbraw/zinc/59/49/81/939594981.db2.gz VTHFCMWXDFPOGB-HYXAFXHYSA-N 2 0 420.439 4.202 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000541744094 939618799 /nfs/dbraw/zinc/61/87/99/939618799.db2.gz BONAREYISDIUOA-ACIOBRDBSA-N 2 0 406.636 4.324 20 0 HIADRP OC[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12)c1ccc(C(F)(F)F)cc1 ZINC000541882580 939649070 /nfs/dbraw/zinc/64/90/70/939649070.db2.gz ULGFQUCHISLPAL-ZDFPQIBNSA-N 2 0 404.476 4.239 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cccc(Br)c1 ZINC000541915760 939652833 /nfs/dbraw/zinc/65/28/33/939652833.db2.gz YZEYFPFKFNLESR-NHCUHLMSSA-N 2 0 403.364 4.257 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cccc(OC(F)(F)F)c1 ZINC000541917888 939653867 /nfs/dbraw/zinc/65/38/67/939653867.db2.gz HDVIRDHYLWONMT-JXFKEZNVSA-N 2 0 408.464 4.393 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CC[C@H](C3CC[NH+](C)CC3)C2)c1 ZINC000542224631 939764390 /nfs/dbraw/zinc/76/43/90/939764390.db2.gz IQQNOWIEXMFGQN-VWLOTQADSA-N 2 0 405.586 4.123 20 0 HIADRP CO[C@@H](c1ccc(Br)cc1)[C@@H](C)[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000542307737 939793551 /nfs/dbraw/zinc/79/35/51/939793551.db2.gz UBNFQRMWGHTOKD-FOIQADDNSA-N 2 0 415.335 4.204 20 0 HIADRP CO[C@H](c1ccc(Br)cc1)[C@@H](C)[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000542307740 939793563 /nfs/dbraw/zinc/79/35/63/939793563.db2.gz UBNFQRMWGHTOKD-QRWLVFNGSA-N 2 0 415.335 4.204 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C[C@@H](c1c(F)cccc1Cl)N1CCCC1 ZINC000542317146 939798613 /nfs/dbraw/zinc/79/86/13/939798613.db2.gz BCWAJGDBMAZCSP-NRFANRHFSA-N 2 0 413.928 4.295 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000542320017 939799666 /nfs/dbraw/zinc/79/96/66/939799666.db2.gz OBEBWMQCRFIXPX-UHFFFAOYSA-N 2 0 421.508 4.113 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CN1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000542466499 939827905 /nfs/dbraw/zinc/82/79/05/939827905.db2.gz MIVRIGXEZPMGKZ-VWLOTQADSA-N 2 0 401.558 4.064 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N2CC[NH+](C)[C@H](C)[C@H]2C)cc1)C[C@@H]1CCCCO1 ZINC000542731622 939857634 /nfs/dbraw/zinc/85/76/34/939857634.db2.gz UICQRWMHLJCLSI-VIZSFHNOSA-N 2 0 416.610 4.022 20 0 HIADRP CCC(CC)(CNC(=O)N(C)[C@H](C)C1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000542748225 939858852 /nfs/dbraw/zinc/85/88/52/939858852.db2.gz FVZGUZDTJPSTCX-VQTJNVASSA-N 2 0 402.627 4.268 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCOc2ccc(Cl)cc21 ZINC000542845698 939862719 /nfs/dbraw/zinc/86/27/19/939862719.db2.gz HCXKRPYHBZWWQZ-IRLDBZIGSA-N 2 0 400.950 4.300 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]CCc1cc(Cl)ccc1Br ZINC000543238144 940004400 /nfs/dbraw/zinc/00/44/00/940004400.db2.gz FLUQWWQSXJVVAR-UHFFFAOYSA-N 2 0 405.727 4.324 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCOc2cc3c(cc21)CCC3 ZINC000543776837 940183561 /nfs/dbraw/zinc/18/35/61/940183561.db2.gz XJBVOEBBLPSMCD-UKILVPOCSA-N 2 0 406.570 4.136 20 0 HIADRP COc1cc(OC)c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1Cl ZINC000543777108 940183724 /nfs/dbraw/zinc/18/37/24/940183724.db2.gz JUPKUWATOJYLMO-VQIMIIECSA-N 2 0 418.965 4.165 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CNc1cccc(NC(=O)CC[NH+]2CCCCC2)c1 ZINC000544176539 940344796 /nfs/dbraw/zinc/34/47/96/940344796.db2.gz IQVZZIKPYIFGGU-UHFFFAOYSA-N 2 0 418.545 4.002 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CNc1ccc(NC(=O)C[NH+]2CCCCCC2)cc1 ZINC000544190436 940348421 /nfs/dbraw/zinc/34/84/21/940348421.db2.gz PBXKMPPVLFXAKV-UHFFFAOYSA-N 2 0 418.545 4.002 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000563849156 945313865 /nfs/dbraw/zinc/31/38/65/945313865.db2.gz LRWQGYOFGYWJGN-BSIFCXSSSA-N 2 0 423.384 4.233 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000544347450 940396634 /nfs/dbraw/zinc/39/66/34/940396634.db2.gz VXXRKKSLEZJHMJ-GOSISDBHSA-N 2 0 418.476 4.144 20 0 HIADRP Fc1ccc(-c2noc(CCC[NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]34)n2)cc1 ZINC000544367022 940403303 /nfs/dbraw/zinc/40/33/03/940403303.db2.gz IALXEZAWGUUHGN-YMPZKCBVSA-N 2 0 420.532 4.309 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ncc(Br)cc2Br)C1 ZINC000544407136 940415055 /nfs/dbraw/zinc/41/50/55/940415055.db2.gz MMQJUYOXJKEFFX-CYBMUJFWSA-N 2 0 419.205 4.208 20 0 HIADRP C[C@H](CS(=O)(=O)c1ccccc1)[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000544578535 940483620 /nfs/dbraw/zinc/48/36/20/940483620.db2.gz BODIWLABJBZUAU-HXUWFJFHSA-N 2 0 422.594 4.367 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)C[C@@H](C)O1 ZINC000544828910 940517926 /nfs/dbraw/zinc/51/79/26/940517926.db2.gz COQCUMBTAUBXBK-DNVFCKCGSA-N 2 0 401.982 4.498 20 0 HIADRP CN(C)c1cc[nH+]cc1CNc1cccc(N2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000545352792 940563960 /nfs/dbraw/zinc/56/39/60/940563960.db2.gz JSZUINQTGDGMRX-UHFFFAOYSA-N 2 0 415.585 4.124 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000545459409 940570909 /nfs/dbraw/zinc/57/09/09/940570909.db2.gz VPIMEPZHPNKHOH-KMDXXIMOSA-N 2 0 413.993 4.376 20 0 HIADRP Cc1nc(C(F)(F)F)c(C[N@@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)s1 ZINC000546102331 940700232 /nfs/dbraw/zinc/70/02/32/940700232.db2.gz SHDDLEOIKKHANV-UHFFFAOYSA-N 2 0 418.573 4.098 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccncc2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547505540 941065994 /nfs/dbraw/zinc/06/59/94/941065994.db2.gz RGJGHTHQCAYLKY-RDPSFJRHSA-N 2 0 414.553 4.334 20 0 HIADRP C[C@H]1C[C@@H](C(=O)N(CC[NH+]2CCCC2)Cc2ccc(Cl)c(Cl)c2)CC[N@@H+]1C ZINC000547758360 941074999 /nfs/dbraw/zinc/07/49/99/941074999.db2.gz QLPGNEZVPBQVHG-WMZOPIPTSA-N 2 0 412.405 4.148 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547827976 941077438 /nfs/dbraw/zinc/07/74/38/941077438.db2.gz VSSPQUKBCVZYRV-GBXCKJPGSA-N 2 0 414.553 4.334 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(COC2CCOCC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547828345 941077579 /nfs/dbraw/zinc/07/75/79/941077579.db2.gz FCMFEJNFOZEIAM-SQJMNOBHSA-N 2 0 408.586 4.382 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000548086173 941086279 /nfs/dbraw/zinc/08/62/79/941086279.db2.gz IKIWUXUFTWQNHV-UHFFFAOYSA-N 2 0 405.586 4.063 20 0 HIADRP Cc1nc(CN2CCC(C[NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)oc1C ZINC000548155255 941089506 /nfs/dbraw/zinc/08/95/06/941089506.db2.gz APZGYDWHALYKNK-HYBUGGRVSA-N 2 0 410.606 4.004 20 0 HIADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000548155919 941089852 /nfs/dbraw/zinc/08/98/52/941089852.db2.gz JSKXBVONUVAUKY-ATPOPXNDSA-N 2 0 417.601 4.455 20 0 HIADRP O=C(c1ccccc1)N1CC[C@@H](C[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)C1 ZINC000548919264 941129147 /nfs/dbraw/zinc/12/91/47/941129147.db2.gz OQDXBKYHWLTXCX-RPLLCQBOSA-N 2 0 417.597 4.137 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)C1CC[NH+](C2CC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000549236628 941172983 /nfs/dbraw/zinc/17/29/83/941172983.db2.gz LTOOAFLBIIHHCC-FQEVSTJZSA-N 2 0 411.512 4.079 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)C2CC[NH+](C3CC3)CC2)cc1)C[C@H]1CCCCO1 ZINC000549260168 941174844 /nfs/dbraw/zinc/17/48/44/941174844.db2.gz OAZZNWZNZDRFIN-XMMPIXPASA-N 2 0 413.606 4.279 20 0 HIADRP CC[C@H](C(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[NH+](CC)CC ZINC000549617559 941201499 /nfs/dbraw/zinc/20/14/99/941201499.db2.gz UQTVJCVIZVTKPU-UAHLEYORSA-N 2 0 406.014 4.491 20 0 HIADRP Fc1ccc(CC2([NH2+]CCC[NH+]3CCCCC3)CCOCC2)c(Br)c1 ZINC000549749187 941206325 /nfs/dbraw/zinc/20/63/25/941206325.db2.gz LSOYUVIAYXJWHD-UHFFFAOYSA-N 2 0 413.375 4.146 20 0 HIADRP O=C(c1ccccc1)N1CC[C@H](C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC000550122765 941287091 /nfs/dbraw/zinc/28/70/91/941287091.db2.gz NFTNIYDCDUTLAL-XMMPIXPASA-N 2 0 417.597 4.137 20 0 HIADRP COC(=O)CCC[C@@H]1CCC[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000550218579 941300726 /nfs/dbraw/zinc/30/07/26/941300726.db2.gz RGMBZWGLCMSDPT-FPOVZHCZSA-N 2 0 402.579 4.151 20 0 HIADRP COc1ccc2oc(C[NH2+]C[C@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)cc2c1 ZINC000550262706 941305382 /nfs/dbraw/zinc/30/53/82/941305382.db2.gz ONSZNKJNRRVXJS-QFIPXVFZSA-N 2 0 420.553 4.460 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+]Cc3ccc(OCC4CC4)cc3)C3(C2)CCOCC3)cc1 ZINC000550270860 941306997 /nfs/dbraw/zinc/30/69/97/941306997.db2.gz DXPUOJFBYTZJSF-RUZDIDTESA-N 2 0 420.597 4.494 20 0 HIADRP Cc1ccc([C@@H](OC[C@@H](O)C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc2)cc1 ZINC000550328533 941315729 /nfs/dbraw/zinc/31/57/29/941315729.db2.gz UUZISJHGEZEMHR-ZEQRLZLVSA-N 2 0 410.602 4.361 20 0 HIADRP Cc1ccc([C@H](OC[C@H](O)C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc2)cc1 ZINC000550328531 941315747 /nfs/dbraw/zinc/31/57/47/941315747.db2.gz UUZISJHGEZEMHR-DNQXCXABSA-N 2 0 410.602 4.361 20 0 HIADRP CC(C)CO[C@@H]1C[C@@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1(C)C ZINC000550882007 941378353 /nfs/dbraw/zinc/37/83/53/941378353.db2.gz HFBFDQYOVLQXKH-RBZQAINGSA-N 2 0 414.634 4.345 20 0 HIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1OC ZINC000550881854 941378650 /nfs/dbraw/zinc/37/86/50/941378650.db2.gz DVFXXDGWUBVTNB-NZQKXSOJSA-N 2 0 424.585 4.283 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CCC([NH+](C)Cc3ccccc3)CC2)[C@@H](C)C1 ZINC000550888028 941379642 /nfs/dbraw/zinc/37/96/42/941379642.db2.gz XITLLLITXRKBOK-GXXCKLNASA-N 3 0 401.639 4.156 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccncc1F ZINC000550887419 941379672 /nfs/dbraw/zinc/37/96/72/941379672.db2.gz PZJPPAYSWWIJOY-QGZVFWFLSA-N 2 0 424.486 4.493 20 0 HIADRP CCS(=O)(=O)c1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)s1 ZINC000551277877 941442114 /nfs/dbraw/zinc/44/21/14/941442114.db2.gz YMYVCVRJZXBLLA-UHFFFAOYSA-N 2 0 406.617 4.075 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]C4CCN(Cc5ccncc5)CC4)[C@H]3C2)cc1 ZINC000552040909 941571791 /nfs/dbraw/zinc/57/17/91/941571791.db2.gz KFOUHMNKVSQYNS-URORMMCBSA-N 2 0 418.629 4.326 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC1 ZINC000552063948 941577080 /nfs/dbraw/zinc/57/70/80/941577080.db2.gz SMHZIJABNLRBDN-NJDAHSKKSA-N 2 0 412.496 4.394 20 0 HIADRP c1ccc(CSCC[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000552113641 941587212 /nfs/dbraw/zinc/58/72/12/941587212.db2.gz BXSWJPAZCZEDMI-DEOSSOPVSA-N 2 0 410.627 4.438 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)CC1 ZINC000552205139 941601775 /nfs/dbraw/zinc/60/17/75/941601775.db2.gz QVLNRHCUHDNJDD-SANMLTNESA-N 2 0 423.576 4.346 20 0 HIADRP COc1ccc([C@H](Cc2ccncc2)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000552263972 941617150 /nfs/dbraw/zinc/61/71/50/941617150.db2.gz UNDWNBHYFLDCLB-BVAGGSTKSA-N 2 0 401.554 4.486 20 0 HIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000552263973 941617391 /nfs/dbraw/zinc/61/73/91/941617391.db2.gz UNDWNBHYFLDCLB-JYFHCDHNSA-N 2 0 401.554 4.486 20 0 HIADRP COCCOCc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000552273350 941619868 /nfs/dbraw/zinc/61/98/68/941619868.db2.gz FJYBPTOMSHFBSG-UHFFFAOYSA-N 2 0 408.586 4.338 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+]C2(c3cccc(Cl)c3)CC2)CC1 ZINC000553328791 941868542 /nfs/dbraw/zinc/86/85/42/941868542.db2.gz HUVBDSVCXDOBEX-UHFFFAOYSA-N 2 0 411.977 4.008 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000554809788 942253212 /nfs/dbraw/zinc/25/32/12/942253212.db2.gz DDCQTMWLTYJNBC-ROUUACIJSA-N 2 0 422.411 4.364 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+]CC(Cc3ccccc3)Cc3ccccc3)CC2)CC1 ZINC000555093644 942383790 /nfs/dbraw/zinc/38/37/90/942383790.db2.gz BHGWAHWWMNEXBJ-UHFFFAOYSA-N 2 0 405.630 4.236 20 0 HIADRP Cc1cc(NC(=O)c2ccc(C[NH+]3CCCC3)cc2)cc(N2CC[NH+](C(C)C)CC2)c1 ZINC000555106902 942387571 /nfs/dbraw/zinc/38/75/71/942387571.db2.gz ICACADXQWWMDJW-UHFFFAOYSA-N 2 0 420.601 4.374 20 0 HIADRP C[N@@H+]1CCCC[C@H]1CN1CC[NH+](CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000555335247 942481636 /nfs/dbraw/zinc/48/16/36/942481636.db2.gz DSRWOVWTCHSGBX-DEOSSOPVSA-N 2 0 413.556 4.199 20 0 HIADRP C[C@H]1C[N@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000555341341 942484604 /nfs/dbraw/zinc/48/46/04/942484604.db2.gz AFSXGMOAOLWJHI-DFBJGRDBSA-N 2 0 413.556 4.055 20 0 HIADRP c1coc(-c2ncc(C[NH2+]C[C@@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)s2)c1 ZINC000555612569 942669959 /nfs/dbraw/zinc/66/99/59/942669959.db2.gz TYUSTILHTQSGLU-HXUWFJFHSA-N 2 0 423.582 4.422 20 0 HIADRP Cc1ccccc1[C@@H](OC[C@@H](O)C[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccccc1 ZINC000555889363 942767367 /nfs/dbraw/zinc/76/73/67/942767367.db2.gz RMOXWMKMSOWOIQ-UPVQGACJSA-N 2 0 410.602 4.361 20 0 HIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccccc1N(C)C ZINC000556232441 942823570 /nfs/dbraw/zinc/82/35/70/942823570.db2.gz FXOKQZSSMWJFQI-GMAHTHKFSA-N 2 0 407.602 4.332 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000558292158 943487313 /nfs/dbraw/zinc/48/73/13/943487313.db2.gz DTPSKACBDVXOIC-GVXSCFBNSA-N 2 0 420.601 4.289 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1ccc2ccccc2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000558482502 943571087 /nfs/dbraw/zinc/57/10/87/943571087.db2.gz DFLBOAAGCNZDRL-OPXMRZJTSA-N 2 0 404.554 4.080 20 0 HIADRP CSCc1cnc(C[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)s1 ZINC000559244593 943884627 /nfs/dbraw/zinc/88/46/27/943884627.db2.gz RYPAORWRIARFAW-UHFFFAOYSA-N 2 0 404.649 4.007 20 0 HIADRP CCS(=O)(=O)c1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000560266428 944212016 /nfs/dbraw/zinc/21/20/16/944212016.db2.gz XYXAFYHUSXQLCU-IPJJNNNSSA-N 2 0 400.588 4.041 20 0 HIADRP CCOC(=O)[C@H]1CC[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000560266724 944212656 /nfs/dbraw/zinc/21/26/56/944212656.db2.gz PUKYZIUFDYUZAN-DQEYMECFSA-N 2 0 422.569 4.431 20 0 HIADRP O=C(C[NH2+][C@@H](c1cccc(Cl)c1)C1CCCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000561199640 944512001 /nfs/dbraw/zinc/51/20/01/944512001.db2.gz QEQWIMSIRLQSNQ-HSZRJFAPSA-N 2 0 403.998 4.294 20 0 HIADRP C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000561502689 944640728 /nfs/dbraw/zinc/64/07/28/944640728.db2.gz SORSEMMPOMZLPR-HYBUGGRVSA-N 2 0 412.622 4.219 20 0 HIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccc(Oc5cnccn5)cc4)C[C@H]3C2)cc1 ZINC000562214339 945023382 /nfs/dbraw/zinc/02/33/82/945023382.db2.gz PLYQFTHSJHDNLS-XZOQPEGZSA-N 2 0 400.526 4.223 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]CCC(=O)Nc2cc(F)cc(F)c2)cc1 ZINC000566047699 945996130 /nfs/dbraw/zinc/99/61/30/945996130.db2.gz ADLXEEIJZMSFEL-KRWDZBQOSA-N 2 0 401.501 4.458 20 0 HIADRP C[NH+](C)CCOc1ccc(-c2noc([C@H]3CCC[N@H+](Cc4cccc(F)c4)C3)n2)cc1 ZINC000567005295 946214078 /nfs/dbraw/zinc/21/40/78/946214078.db2.gz WNFZKHKYQGXWCJ-FQEVSTJZSA-N 2 0 424.520 4.196 20 0 HIADRP O[C@@H](C[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)COCc1ccc(Cl)cc1 ZINC000567188080 946264042 /nfs/dbraw/zinc/26/40/42/946264042.db2.gz ZKWFLVZBUKNPCA-VWNXMTODSA-N 2 0 416.993 4.109 20 0 HIADRP C[C@H]([NH2+]CCCc1nc(-c2ccc(F)cc2)no1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000569341951 946859428 /nfs/dbraw/zinc/85/94/28/946859428.db2.gz ZJZXCUSWDMHFJY-RXVVDRJESA-N 2 0 408.521 4.309 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000569627781 946899855 /nfs/dbraw/zinc/89/98/55/946899855.db2.gz WKPIUFILUUIPNU-XGHQBKJUSA-N 2 0 419.491 4.135 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H]2CCC[C@@H](c3ccnn3C)C2)CC1 ZINC000572330911 947886434 /nfs/dbraw/zinc/88/64/34/947886434.db2.gz ICRVIAKTPKZHGX-QKNQBKEWSA-N 2 0 413.585 4.078 20 0 HIADRP COc1ccc2c(c1F)CC[C@H]2[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000572439752 947906077 /nfs/dbraw/zinc/90/60/77/947906077.db2.gz FPNCDTAMDALSAH-FOIQADDNSA-N 2 0 401.501 4.063 20 0 HIADRP C[C@@H]1CC[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)[C@@H](n2cncn2)C1 ZINC000574343805 948417446 /nfs/dbraw/zinc/41/74/46/948417446.db2.gz UKFAELLIFSISQD-WTNAPCKOSA-N 2 0 401.986 4.163 20 0 HIADRP C[NH+](C)C1CCN(c2ccc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)nc2)CC1 ZINC000574715839 948510793 /nfs/dbraw/zinc/51/07/93/948510793.db2.gz QIJVRPZBFSARRU-ULPXVVAUSA-N 2 0 419.617 4.220 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc(Br)cn3)CC2)cc1 ZINC000575850225 948741441 /nfs/dbraw/zinc/74/14/41/948741441.db2.gz HHWUOEPXWJRJQA-MRXNPFEDSA-N 2 0 418.379 4.416 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2c(c1)OCC(=O)N2 ZINC000575975455 948805677 /nfs/dbraw/zinc/80/56/77/948805677.db2.gz QIINIYUNDDFWTA-QRVBRYPASA-N 2 0 407.558 4.346 20 0 HIADRP c1cn(Cc2ccccc2)c2cc[nH+]c(N3CC[C@H]4[C@@H]3CC[N@@H+]4Cc3cccnc3)c12 ZINC001164724722 720397669 /nfs/dbraw/zinc/39/76/69/720397669.db2.gz LFWAEJCPLJUOBT-DQEYMECFSA-N 2 0 409.537 4.333 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3CCC[C@@]4(C[C@@H](c5ccccc5)CO4)C3)c2)CC1 ZINC001164774582 721061372 /nfs/dbraw/zinc/06/13/72/721061372.db2.gz WSTZWXGNOSHWLE-PXDATVDWSA-N 2 0 407.558 4.098 20 0 HIADRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000436293521 861600049 /nfs/dbraw/zinc/60/00/49/861600049.db2.gz OKOQUFQHVBEFOY-UHFFFAOYSA-N 2 0 419.919 4.075 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000031097260 847822176 /nfs/dbraw/zinc/82/21/76/847822176.db2.gz RDEQNGUSHDCTFC-JOCHJYFZSA-N 2 0 414.619 4.095 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NC[C@@H](c2ccc(OC)cc2)[NH+]2CCCC2)cc1 ZINC000036833801 848167620 /nfs/dbraw/zinc/16/76/20/848167620.db2.gz AQKJRZLXICCYPT-DEOSSOPVSA-N 2 0 409.574 4.104 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000038830380 848180438 /nfs/dbraw/zinc/18/04/38/848180438.db2.gz PMXSLYDPMMFCES-RUZDIDTESA-N 2 0 405.586 4.201 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)c1 ZINC000044293645 848540472 /nfs/dbraw/zinc/54/04/72/848540472.db2.gz XRERFZYLKHUZJI-NRFANRHFSA-N 2 0 400.954 4.360 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)c1 ZINC000044293493 848540581 /nfs/dbraw/zinc/54/05/81/848540581.db2.gz OURYWYDOJBOLHA-UHFFFAOYSA-N 2 0 402.542 4.251 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NCc1ccccc1C[NH+]1CCCC1 ZINC000048220296 849193633 /nfs/dbraw/zinc/19/36/33/849193633.db2.gz DCWSVAGSMGBRTL-UHFFFAOYSA-N 2 0 408.590 4.122 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000058614804 850868526 /nfs/dbraw/zinc/86/85/26/850868526.db2.gz LTQYGPHIBNBXKR-QZTJIDSGSA-N 2 0 418.632 4.083 20 0 HIADRP c1ccc2c(c1)COC21CC[NH+](CCC[NH+]2CCC3(CC2)OCc2ccccc23)CC1 ZINC000060177421 851049408 /nfs/dbraw/zinc/04/94/08/851049408.db2.gz DGMPWLPONCBJHF-UHFFFAOYSA-N 2 0 418.581 4.420 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000060580634 851154351 /nfs/dbraw/zinc/15/43/51/851154351.db2.gz GDJIRCXALWYVLT-VWLOTQADSA-N 2 0 405.586 4.201 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NCc2ccc(C[NH+](C)C)cc2)c2cccs2)CC1 ZINC000061191182 851314129 /nfs/dbraw/zinc/31/41/29/851314129.db2.gz BAHAGOPHTPEWJH-NRFANRHFSA-N 2 0 414.619 4.082 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1 ZINC000061228560 851322773 /nfs/dbraw/zinc/32/27/73/851322773.db2.gz QMRKJFGDVOUMHH-DEOSSOPVSA-N 2 0 408.590 4.165 20 0 HIADRP C#CCOc1ccc(Br)cc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000061557063 851404711 /nfs/dbraw/zinc/40/47/11/851404711.db2.gz ZOBSDVTVLZIWOC-UHFFFAOYSA-N 2 0 413.359 4.347 20 0 HIADRP Cc1cc[n+](C(C(=O)c2ccc(C(C)(C)C)cc2)C(=S)NC2CC[NH+](C)CC2)cc1 ZINC000063441393 851690052 /nfs/dbraw/zinc/69/00/52/851690052.db2.gz WPVLWXMJWGVYKJ-UHFFFAOYSA-O 2 0 424.634 4.203 20 0 HIADRP CCc1cccc[n+]1C(C(=O)c1cc(C)c(C)cc1C)C(=S)NC1CC[NH+](C)CC1 ZINC000063441425 851690880 /nfs/dbraw/zinc/69/08/80/851690880.db2.gz UOJHVSBRWLSZQC-UHFFFAOYSA-O 2 0 424.634 4.084 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)c1 ZINC000064229347 851852804 /nfs/dbraw/zinc/85/28/04/851852804.db2.gz UPQKDNCOJLMNHU-UHFFFAOYSA-N 2 0 416.997 4.065 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000065522369 852167248 /nfs/dbraw/zinc/16/72/48/852167248.db2.gz WMLNOOSSHQKKDU-YKSBVNFPSA-N 2 0 408.590 4.163 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2cc(Cl)cc(Cl)c2OC)CC1 ZINC000065932103 852321723 /nfs/dbraw/zinc/32/17/23/852321723.db2.gz AQJPNYYJVRMRGB-UHFFFAOYSA-N 2 0 422.400 4.429 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@@H](c2ccccc2OC)[NH+]2CCCC2)cc1)C(C)C ZINC000110172330 853068715 /nfs/dbraw/zinc/06/87/15/853068715.db2.gz JGECWMPHCFINKW-DEOSSOPVSA-N 2 0 423.601 4.492 20 0 HIADRP C[C@@H]1C[NH+](CC2CC[NH+](Cc3cccc(C(=O)Nc4ccccc4)c3)CC2)C[C@@H](C)O1 ZINC000110736665 853146207 /nfs/dbraw/zinc/14/62/07/853146207.db2.gz IECKHMGJPFUSBS-NHCUHLMSSA-N 2 0 421.585 4.260 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccccc2-n2ccnc2)cc1OCc1cccnc1 ZINC000140463129 853445301 /nfs/dbraw/zinc/44/53/01/853445301.db2.gz LQAUXCZIWAUBJV-UHFFFAOYSA-N 2 0 400.482 4.145 20 0 HIADRP CC(C)c1nn(-c2ccccc2)c(Cl)c1C[NH2+]CC1CC[NH+](CCN(C)C)CC1 ZINC000236629950 853904874 /nfs/dbraw/zinc/90/48/74/853904874.db2.gz KSWILJOAYITFAI-UHFFFAOYSA-N 2 0 418.029 4.012 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+]Cc3ccc(Oc4cc(F)cc(F)c4)cc3)ccn2)CC1 ZINC000237105434 853964958 /nfs/dbraw/zinc/96/49/58/853964958.db2.gz GIFQNGZLWIKTLD-UHFFFAOYSA-N 2 0 424.495 4.194 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+]Cc2sc(Sc3ccccc3)nc2Cl)CC1 ZINC000237168592 853975003 /nfs/dbraw/zinc/97/50/03/853975003.db2.gz SXWMLNJPMKRFEP-UHFFFAOYSA-N 2 0 411.040 4.063 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)cc1 ZINC000237177728 853976309 /nfs/dbraw/zinc/97/63/09/853976309.db2.gz MPJJTURBVGKTNL-UHFFFAOYSA-N 2 0 411.933 4.181 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccccc1N1CCOCC1 ZINC000237179449 853976416 /nfs/dbraw/zinc/97/64/16/853976416.db2.gz SRWCCNJAVPFLGH-UHFFFAOYSA-N 2 0 405.542 4.038 20 0 HIADRP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)ccc1OCCOc1ccccc1Cl ZINC000237241971 853989578 /nfs/dbraw/zinc/98/95/78/853989578.db2.gz UXZSOKBBVLPXMT-IBGZPJMESA-N 2 0 418.965 4.238 20 0 HIADRP Cn1cc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)c(-c2cccnc2)n1 ZINC000237756803 854090221 /nfs/dbraw/zinc/09/02/21/854090221.db2.gz YEEGQVOGPXCAFX-UHFFFAOYSA-N 2 0 417.601 4.307 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N2CCC[N@H+](CC3CCCCC3)CC2)[NH+]2CCCC2)o1 ZINC000303110349 854764971 /nfs/dbraw/zinc/76/49/71/854764971.db2.gz FXVSPWXOWQJBTA-QFIPXVFZSA-N 2 0 416.610 4.023 20 0 HIADRP C[C@@H](C(=O)NC(c1ccccc1)c1ccccc1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000303215692 854820296 /nfs/dbraw/zinc/82/02/96/854820296.db2.gz SZIYMXACFSQNGK-NRFANRHFSA-N 2 0 405.586 4.089 20 0 HIADRP O=C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000303520427 855007861 /nfs/dbraw/zinc/00/78/61/855007861.db2.gz UZZNPCHUMDETFF-TZZBBBQFSA-N 2 0 417.597 4.210 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000303582668 855056569 /nfs/dbraw/zinc/05/65/69/855056569.db2.gz RPAHIFQNGLZFHX-UHFFFAOYSA-N 2 0 423.582 4.338 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)CC1 ZINC000303639317 855095346 /nfs/dbraw/zinc/09/53/46/855095346.db2.gz HNHZOHDECYHWLK-VSKRKVRLSA-N 2 0 414.638 4.269 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000303804795 855209537 /nfs/dbraw/zinc/20/95/37/855209537.db2.gz XQLJXQRVRWACML-RZFJZAQRSA-N 2 0 419.613 4.410 20 0 HIADRP C[C@H]([NH2+]C1CCN(C(=O)OCc2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309697258 855364386 /nfs/dbraw/zinc/36/43/86/855364386.db2.gz DVWPBCXHRXBBIX-URXFXBBRSA-N 2 0 421.585 4.288 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCN(C(=O)OC(C)(C)C)CC1 ZINC000398047814 855474939 /nfs/dbraw/zinc/47/49/39/855474939.db2.gz WLNSKVCSXKPDTR-DENIHFKCSA-N 2 0 401.595 4.134 20 0 HIADRP CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]([NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)C[C@@H]2C1 ZINC000401122385 855479645 /nfs/dbraw/zinc/47/96/45/855479645.db2.gz KCNNSGYDLNEPNZ-ACESQOTJSA-N 2 0 413.606 4.134 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NCc2ccccc2C[NH+]2CCCC[C@H]2C)C1 ZINC000410372530 855957822 /nfs/dbraw/zinc/95/78/22/855957822.db2.gz OHGYXUOZQQSRGU-FGZHOGPDSA-N 2 0 414.638 4.372 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NCCC[NH2+]C2CCCCC2)C1 ZINC000410374984 855959677 /nfs/dbraw/zinc/95/96/77/855959677.db2.gz OGXIVUYDSIGBPN-FQEVSTJZSA-N 2 0 400.611 4.030 20 0 HIADRP FC(F)(F)CN1CC[C@H](C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000428216368 857114766 /nfs/dbraw/zinc/11/47/66/857114766.db2.gz FKXXOTDFUKPQNJ-CIAFKFPVSA-N 2 0 409.540 4.151 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1Cc1ccccc1 ZINC000428277218 857136969 /nfs/dbraw/zinc/13/69/69/857136969.db2.gz PKRAQGUAUMAIAB-BWKNWUBXSA-N 2 0 420.601 4.135 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000428312803 857148857 /nfs/dbraw/zinc/14/88/57/857148857.db2.gz XCSSMNGKMWOKEF-PXDATVDWSA-N 2 0 422.617 4.381 20 0 HIADRP Cc1cccc(N2CC[NH+](CCC(=O)Nc3cc(C[NH+]4CCCC4)ccc3C)CC2)c1 ZINC000428393164 857188603 /nfs/dbraw/zinc/18/86/03/857188603.db2.gz XDMKISCPGYFPNR-UHFFFAOYSA-N 2 0 420.601 4.050 20 0 HIADRP C[C@@H]([NH2+]C/C=C\C[NH2+][C@@H](C)[C@@H]1OCCc2sccc21)[C@@H]1OCCc2sccc21 ZINC000429124963 857522243 /nfs/dbraw/zinc/52/22/43/857522243.db2.gz XQOWHFFXKUUUQA-URCJGOPASA-N 2 0 418.628 4.250 20 0 HIADRP c1ccc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c(C[NH+]2CCOC[C@H](C3CCC3)C2)c1 ZINC000429262583 857580545 /nfs/dbraw/zinc/58/05/45/857580545.db2.gz URJLHBYZVHTLLC-CLJLJLNGSA-N 2 0 412.618 4.184 20 0 HIADRP O=C(NC[C@@H]1CCC[N@@H+]1C1CCCCC1)NC[C@H]1CCC[NH+](Cc2cccs2)C1 ZINC000437664542 863005398 /nfs/dbraw/zinc/00/53/98/863005398.db2.gz DOSBZDOIHQVKRT-CTNGQTDRSA-N 2 0 418.651 4.056 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)[C@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000431316313 858560097 /nfs/dbraw/zinc/56/00/97/858560097.db2.gz CIKHQUSLXCFKBJ-PBXXJUDPSA-N 2 0 423.576 4.207 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000431316317 858560326 /nfs/dbraw/zinc/56/03/26/858560326.db2.gz CIKHQUSLXCFKBJ-XRODADMRSA-N 2 0 423.576 4.207 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCCOc4cc5c(cc43)CCC5)cc2)CC1 ZINC000431340499 858571833 /nfs/dbraw/zinc/57/18/33/858571833.db2.gz WRHHFXCTTSMCDD-RUZDIDTESA-N 2 0 406.570 4.136 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000431623179 858696162 /nfs/dbraw/zinc/69/61/62/858696162.db2.gz RYWOFDYNKBYCMQ-URXFXBBRSA-N 2 0 414.638 4.097 20 0 HIADRP O=C(NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC000431629029 858699430 /nfs/dbraw/zinc/69/94/30/858699430.db2.gz VCHNVCQKAPJOOJ-QFIPXVFZSA-N 2 0 403.998 4.218 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H](C)c2cc3ccccc3o2)CC1 ZINC000432794050 859363171 /nfs/dbraw/zinc/36/31/71/859363171.db2.gz RWTOVRIVOUJNMQ-LJQANCHMSA-N 2 0 405.542 4.173 20 0 HIADRP C[NH+](C)[C@H]1CCOc2c(NCc3c(Cl)cccc3N3CC[NH+](C)CC3)cccc21 ZINC000433204156 859566102 /nfs/dbraw/zinc/56/61/02/859566102.db2.gz FDXNFPLXPWJACS-NRFANRHFSA-N 2 0 414.981 4.089 20 0 HIADRP C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000434897596 860542354 /nfs/dbraw/zinc/54/23/54/860542354.db2.gz XAFHRNJJXBRJNR-AUSIDOKSSA-N 2 0 409.599 4.052 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NC[C@H]1CCC[N@@H+]1C1CCCCC1 ZINC000438146201 863566449 /nfs/dbraw/zinc/56/64/49/863566449.db2.gz FLRPFENEBCFJHC-HSZRJFAPSA-N 2 0 400.611 4.077 20 0 HIADRP Cc1ccc2cc(C[NH2+]Cc3cccc(OCC[N@@H+](C)C4CCOCC4)c3)ccc2n1 ZINC000438199914 863629500 /nfs/dbraw/zinc/62/95/00/863629500.db2.gz JFYKBAZUPYYNBU-UHFFFAOYSA-N 2 0 419.569 4.323 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cccc(NC(=O)[C@@H]3CCCO3)c2)CC1 ZINC000438832496 864325405 /nfs/dbraw/zinc/32/54/05/864325405.db2.gz MNUFKTAJGZATFK-DWJCEPTDSA-N 2 0 421.585 4.337 20 0 HIADRP Cc1ccc(NC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)c(OCC[NH+](C)C)c1 ZINC000438881423 864368608 /nfs/dbraw/zinc/36/86/08/864368608.db2.gz YGYQEFKAGINIKM-UHFFFAOYSA-N 2 0 424.589 4.064 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)Nc1cc(F)ccc1F ZINC000439611750 864935229 /nfs/dbraw/zinc/93/52/29/864935229.db2.gz PTSWDAQOGVRPFI-MRXNPFEDSA-N 2 0 413.468 4.307 20 0 HIADRP CC[C@@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000439788411 865110042 /nfs/dbraw/zinc/11/00/42/865110042.db2.gz MVKLEKVISBYMBC-AREMUKBSSA-N 2 0 409.618 4.380 20 0 HIADRP Cc1ccc(NC2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)cc1NC(=O)CC[NH+](C)C ZINC000468044924 881872197 /nfs/dbraw/zinc/87/21/97/881872197.db2.gz NUERZSAMWMJSPC-CVDCTZTESA-N 2 0 400.611 4.340 20 0 HIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CC2(N(C)C)CCOCC2)c2ccc(F)cc2)CC1 ZINC000468053766 881878353 /nfs/dbraw/zinc/87/83/53/881878353.db2.gz VVFDQPLQOFMPID-HSZRJFAPSA-N 2 0 405.602 4.079 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]Cc3cnc(-c4ccncc4)s3)cc2)C[C@H](C)O1 ZINC000440340413 865617603 /nfs/dbraw/zinc/61/76/03/865617603.db2.gz KYWDHRXOHXJQCE-HDICACEKSA-N 2 0 408.571 4.104 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NCc1cccc(C[NH+](C)C)c1)c1cccc(C(F)(F)F)c1 ZINC000468175693 882053505 /nfs/dbraw/zinc/05/35/05/882053505.db2.gz XRKZOZMFZRPFQS-NRFANRHFSA-N 2 0 421.507 4.466 20 0 HIADRP Cc1ccc(NC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)c(OCC[NH+](C)C)c1 ZINC000443930836 868468818 /nfs/dbraw/zinc/46/88/18/868468818.db2.gz UNTJIPVQWHCOGB-UHFFFAOYSA-N 2 0 416.610 4.055 20 0 HIADRP C[C@@H](CCc1ccc(Cl)s1)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000468427227 882369705 /nfs/dbraw/zinc/36/97/05/882369705.db2.gz IRIXIDPOEMYGAY-QFBILLFUSA-N 2 0 420.022 4.210 20 0 HIADRP CC(C)C1CCC([NH+]2CCN(C(=O)Nc3ccccc3CC[NH+](C)C)CC2)CC1 ZINC000446569772 870481867 /nfs/dbraw/zinc/48/18/67/870481867.db2.gz RWZKLUQFTAFKKW-UHFFFAOYSA-N 2 0 400.611 4.155 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N1CC[NH+](Cc2cccc3ccccc32)CC1 ZINC000446577796 870487935 /nfs/dbraw/zinc/48/79/35/870487935.db2.gz NUINTPXASNCUDT-UHFFFAOYSA-N 2 0 416.569 4.294 20 0 HIADRP CCN(C(=O)Nc1ccccc1CC[NH+](C)C)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000446588196 870495847 /nfs/dbraw/zinc/49/58/47/870495847.db2.gz YGZUJPLAGAPEFX-NZQKXSOJSA-N 2 0 408.590 4.480 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000446589708 870498243 /nfs/dbraw/zinc/49/82/43/870498243.db2.gz BJNPRZBPVXQBJF-AREMUKBSSA-N 2 0 420.601 4.311 20 0 HIADRP COc1ccc([C@@H](CCn2cncn2)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC000446747339 870654371 /nfs/dbraw/zinc/65/43/71/870654371.db2.gz CJCUKPGKDOUJSL-RUZDIDTESA-N 2 0 419.573 4.194 20 0 HIADRP Cc1nccn1-c1ccc(C[NH2+][C@@H](CCn2cncn2)c2ccc(C)cc2)cc1F ZINC000446751085 870658809 /nfs/dbraw/zinc/65/88/09/870658809.db2.gz BJJPBJFUCUUJSN-QFIPXVFZSA-N 2 0 404.493 4.141 20 0 HIADRP CC[C@@H]([NH2+]CCCN1CC[NH+](CC)CC1)c1ccc(Br)cc1Cl ZINC000446752195 870660090 /nfs/dbraw/zinc/66/00/90/870660090.db2.gz OARQPJGHBZDTIF-GOSISDBHSA-N 2 0 402.808 4.171 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]CC1(N3CCCCC3)CC[NH+](C)CC1)CCCS2 ZINC000446843082 870761984 /nfs/dbraw/zinc/76/19/84/870761984.db2.gz JMUOOKVJGKVXON-NRFANRHFSA-N 2 0 403.636 4.162 20 0 HIADRP C[NH+](C)CCOCC[NH2+][C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000447603313 871510097 /nfs/dbraw/zinc/51/00/97/871510097.db2.gz XMEBAJGUAAWTLI-MRXNPFEDSA-N 2 0 424.408 4.118 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000447604504 871512841 /nfs/dbraw/zinc/51/28/41/871512841.db2.gz AYSRBMRNMPGMFP-FTJBHMTQSA-N 2 0 404.529 4.466 20 0 HIADRP CCN(C(=O)NC[C@@H]1CCC[NH+](CC(C)C)C1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000448467168 872438750 /nfs/dbraw/zinc/43/87/50/872438750.db2.gz PKYCLGNBWUQUBV-GPXNEJASSA-N 2 0 414.638 4.221 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)N1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC000468716464 882826591 /nfs/dbraw/zinc/82/65/91/882826591.db2.gz RRUXEHMCBFRXBQ-UHFFFAOYSA-N 2 0 417.553 4.157 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N2C[C@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC000461435847 874487647 /nfs/dbraw/zinc/48/76/47/874487647.db2.gz KQJPHJKKSSLNJL-JWQCQUIFSA-N 2 0 405.586 4.123 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)C1CC[NH+](C(C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000468877641 882911114 /nfs/dbraw/zinc/91/11/14/882911114.db2.gz HIFXOCIUGNIJRL-HXUWFJFHSA-N 2 0 413.528 4.325 20 0 HIADRP Cc1cc(C)cc(-c2ccc(C[NH2+]Cc3cccnc3N3CC[NH+](C)CC3)cc2)c1 ZINC000462368974 875480971 /nfs/dbraw/zinc/48/09/71/875480971.db2.gz PFRIIUHGGSINEL-UHFFFAOYSA-N 2 0 400.570 4.407 20 0 HIADRP Cc1cc(C)cc(-c2ccc(C[NH2+]Cc3ccnc(N4CC[NH+](C)CC4)c3)cc2)c1 ZINC000462685416 875778165 /nfs/dbraw/zinc/77/81/65/875778165.db2.gz PLHJNWUNULQVJQ-UHFFFAOYSA-N 2 0 400.570 4.407 20 0 HIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(Br)cc2Cl)(N2CCCCC2)CC1 ZINC000462733525 875807544 /nfs/dbraw/zinc/80/75/44/875807544.db2.gz DWMUNBWAHYWLCG-UHFFFAOYSA-N 2 0 414.819 4.142 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(OC(C)(C)C)cc1 ZINC000463030424 876050854 /nfs/dbraw/zinc/05/08/54/876050854.db2.gz SJTFCYAVWBFGGT-GOSISDBHSA-N 2 0 403.611 4.141 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CCC[C@@](CO)(Cc2ccccc2)C1)C1CC[NH+](C)CC1 ZINC000463041817 876066954 /nfs/dbraw/zinc/06/69/54/876066954.db2.gz HRSQGANMLZZLFB-HHHXNRCGSA-N 2 0 421.629 4.034 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CCN(Cc3ccccc3Cl)CC2)[C@H](C)C1 ZINC000463126179 876168998 /nfs/dbraw/zinc/16/89/98/876168998.db2.gz YXMWQCLAPKUYQT-AUSIDOKSSA-N 2 0 408.030 4.031 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[C@@H]1CCCC[N@@H+]1C/C=C\C[NH+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000463190375 876249249 /nfs/dbraw/zinc/24/92/49/876249249.db2.gz CUDPAKWBTVRFOH-RLMROKJPSA-N 2 0 418.666 4.354 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[C@@H]1CCCC[N@@H+]1CCC[NH+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000463196950 876256842 /nfs/dbraw/zinc/25/68/42/876256842.db2.gz NOXXRQKJIXAVLP-YXNCVAEISA-N 2 0 406.655 4.188 20 0 HIADRP FC(F)(F)C1CC[NH+](C2CC(NC3CC[NH+](CCc4ccccc4)CC3)C2)CC1 ZINC000463238856 876295551 /nfs/dbraw/zinc/29/55/51/876295551.db2.gz UFAXIQARWROXQR-UHFFFAOYSA-N 2 0 409.540 4.088 20 0 HIADRP COc1cc(OC)c(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(OC)c1 ZINC000463292291 876352490 /nfs/dbraw/zinc/35/24/90/876352490.db2.gz SBGQYHYTFWCBIP-SEJPIABJSA-N 2 0 410.558 4.040 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)c1cccc(F)c1 ZINC000463699928 876819370 /nfs/dbraw/zinc/81/93/70/876819370.db2.gz RVUXSHNEWYUVIR-QFIPXVFZSA-N 2 0 421.520 4.450 20 0 HIADRP C[N@H+](C[C@@H](O)COc1cccc2ccccc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464843171 878115390 /nfs/dbraw/zinc/11/53/90/878115390.db2.gz QWVSMVVRDPIBSS-ISKFKSNPSA-N 2 0 404.554 4.033 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](CC)CC)C1 ZINC000465421380 878850654 /nfs/dbraw/zinc/85/06/54/878850654.db2.gz KRKPBSUOYYEBLX-RXVVDRJESA-N 2 0 409.018 4.096 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1Cl ZINC000465421548 878851181 /nfs/dbraw/zinc/85/11/81/878851181.db2.gz LEYISKZEYDSPOZ-GKTUAVMOSA-N 2 0 407.002 4.037 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](C1CCCCC1)[NH+](C)C ZINC000465533098 878990440 /nfs/dbraw/zinc/99/04/40/878990440.db2.gz IULGMQBBDVOEPO-VWNXMTODSA-N 2 0 414.638 4.051 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N(C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000465573003 879048568 /nfs/dbraw/zinc/04/85/68/879048568.db2.gz NWMZLJYVPDEHNH-QHCPKHFHSA-N 2 0 422.617 4.190 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCc1ccccc1C[NH+]1CCC(C)CC1)CC2 ZINC000465579054 879056301 /nfs/dbraw/zinc/05/63/01/879056301.db2.gz UQMWATNRPCHRTI-RPWUZVMVSA-N 2 0 412.622 4.075 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)NC[C@@H]2CCC[NH+](C)[C@H]2c2cccs2)C1 ZINC000465594690 879079517 /nfs/dbraw/zinc/07/95/17/879079517.db2.gz IMXPGVPLGLVEBV-CUXKYVRBSA-N 2 0 420.667 4.188 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000465594377 879080053 /nfs/dbraw/zinc/08/00/53/879080053.db2.gz HBHWOHCAQRKLSX-QHCPKHFHSA-N 2 0 422.617 4.192 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000465639443 879154547 /nfs/dbraw/zinc/15/45/47/879154547.db2.gz UXZSIZCJCWOOFL-RUZDIDTESA-N 2 0 422.617 4.192 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@@H]2CCC[NH+](C)[C@H]2c2cccs2)c1 ZINC000465818517 879444382 /nfs/dbraw/zinc/44/43/82/879444382.db2.gz UJENEOBKUQHAFH-RBBKRZOGSA-N 2 0 414.619 4.082 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccsc1 ZINC000503448414 912471084 /nfs/dbraw/zinc/47/10/84/912471084.db2.gz XKQWAWXADBODJB-RBBKRZOGSA-N 2 0 420.667 4.429 20 0 HIADRP CC[NH+](CC)CCN(CC(C)C)C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000466071326 879773441 /nfs/dbraw/zinc/77/34/41/879773441.db2.gz ADIBDMHAKVBUDG-PZJWPPBQSA-N 2 0 408.656 4.140 20 0 HIADRP C[NH+](C)CCc1ccc(CNC(=O)c2cccc(C[N@H+](C)Cc3ccccc3)c2)cc1 ZINC000467051283 880842950 /nfs/dbraw/zinc/84/29/50/880842950.db2.gz NKMZURQXLRNMKE-UHFFFAOYSA-N 2 0 415.581 4.353 20 0 HIADRP CC(C)Sc1cc(Br)ccc1C[NH2+]CC1(O)CC[NH+](C(C)C)CC1 ZINC000503591979 912678161 /nfs/dbraw/zinc/67/81/61/912678161.db2.gz KWAXGDZDSCDXFC-UHFFFAOYSA-N 2 0 415.441 4.275 20 0 HIADRP C[C@H](CCCOc1ccccc1C(N)=O)[NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000469263535 883361154 /nfs/dbraw/zinc/36/11/54/883361154.db2.gz NPSDKLLCWHMCMU-NJDAHSKKSA-N 2 0 423.601 4.079 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000469742108 883897601 /nfs/dbraw/zinc/89/76/01/883897601.db2.gz NNLPTEGQQNUBJZ-NHCUHLMSSA-N 2 0 405.586 4.169 20 0 HIADRP O[C@@H](C(F)F)[C@H](Cc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000470253986 884590541 /nfs/dbraw/zinc/59/05/41/884590541.db2.gz GOKQWKWHABRRDQ-ARHMPVJQSA-N 2 0 400.513 4.009 20 0 HIADRP C[NH+]1CCC(C)(C[NH2+]Cc2cc(Br)ccc2OCc2ccccn2)CC1 ZINC000503909653 912860523 /nfs/dbraw/zinc/86/05/23/912860523.db2.gz GLBPHVDKZURXGH-UHFFFAOYSA-N 2 0 418.379 4.245 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N(C)[C@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000470749272 885213255 /nfs/dbraw/zinc/21/32/55/885213255.db2.gz LWOFUXONRMSUJS-AKFKNWHVSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)N2CC[C@@H](C[N@H+](C)CC3CC3)C2)CCCC1)c1ccccc1 ZINC000470894785 885394265 /nfs/dbraw/zinc/39/42/65/885394265.db2.gz NCHMBTJTSDVJCM-IRLDBZIGSA-N 2 0 412.622 4.023 20 0 HIADRP CC[NH+]1CCC(NC(=O)C[N@@H+]2CCCCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000471002505 885503575 /nfs/dbraw/zinc/50/35/75/885503575.db2.gz ZYROYZSNUUUZTD-HXUWFJFHSA-N 2 0 411.512 4.223 20 0 HIADRP Cc1cccc(-c2n[nH]cc2C[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)c1 ZINC000504082122 912991407 /nfs/dbraw/zinc/99/14/07/912991407.db2.gz WNUSAJHOXUWHHU-UHFFFAOYSA-N 2 0 417.601 4.386 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@H](C)CCN1CC[NH+](C)CC1 ZINC000471607334 886322544 /nfs/dbraw/zinc/32/25/44/886322544.db2.gz YOLBQPDTVQZFDQ-CVEARBPZSA-N 2 0 407.027 4.449 20 0 HIADRP C[C@H](CCCCN1C(=O)c2ccccc2C1=O)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000471618996 886335260 /nfs/dbraw/zinc/33/52/60/886335260.db2.gz LQYZZPZRSVLFIU-VAMGGRTRSA-N 2 0 411.590 4.084 20 0 HIADRP CCN(CCC[NH+]1CCCC1)C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000472098305 886891590 /nfs/dbraw/zinc/89/15/90/886891590.db2.gz YUTZVSWVISZYED-UHFFFAOYSA-N 2 0 422.617 4.433 20 0 HIADRP Cc1ccc(C)c2c1CCC[C@H]2[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000472138339 886932113 /nfs/dbraw/zinc/93/21/13/886932113.db2.gz LYQSRZULQWADDT-ISKFKSNPSA-N 2 0 405.586 4.168 20 0 HIADRP CC[NH+](CC)CCO[C@@H]1CC[N@@H+]([C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1 ZINC000472257593 887068583 /nfs/dbraw/zinc/06/85/83/887068583.db2.gz IIBMHKWUHNQDBD-HYBUGGRVSA-N 2 0 409.574 4.433 20 0 HIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C1 ZINC000472489927 887357082 /nfs/dbraw/zinc/35/70/82/887357082.db2.gz YLQPLBGKOZIYLV-NRFANRHFSA-N 2 0 407.558 4.471 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)N2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)c1 ZINC000473617865 888358975 /nfs/dbraw/zinc/35/89/75/888358975.db2.gz MLABGQMIWXQNRM-VWLOTQADSA-N 2 0 406.574 4.268 20 0 HIADRP CCN(C(=O)NC[C@H](c1ccsc1)[NH+](C)C)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473886943 888755817 /nfs/dbraw/zinc/75/58/17/888755817.db2.gz RACGCJVCGFLBCF-STZQEDGTSA-N 2 0 414.619 4.218 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)N(CC)[C@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)CC1 ZINC000474011003 888867462 /nfs/dbraw/zinc/86/74/62/888867462.db2.gz OIWUKUJUWNQTTR-OFNKIYASSA-N 2 0 400.611 4.118 20 0 HIADRP CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@@H]1C)CC2 ZINC000474896433 889755829 /nfs/dbraw/zinc/75/58/29/889755829.db2.gz QJJWFRFWNUJGAP-OALUTQOASA-N 2 0 408.590 4.329 20 0 HIADRP CN(C(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475015104 889868116 /nfs/dbraw/zinc/86/81/16/889868116.db2.gz QEVUOZAHZDIHGT-RUZDIDTESA-N 2 0 420.601 4.088 20 0 HIADRP CN(C(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475015106 889868686 /nfs/dbraw/zinc/86/86/86/889868686.db2.gz QEVUOZAHZDIHGT-VWLOTQADSA-N 2 0 420.601 4.088 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1cc2cccc(F)c2o1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000475712869 890650140 /nfs/dbraw/zinc/65/01/40/890650140.db2.gz GWRXUZLMCPWNSY-QZTJIDSGSA-N 2 0 423.532 4.392 20 0 HIADRP CC[C@@H](C)[NH2+][C@H](CNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)c1ccco1 ZINC000476847433 891820089 /nfs/dbraw/zinc/82/00/89/891820089.db2.gz RLZYIMOTNCGFER-DENIHFKCSA-N 2 0 412.578 4.194 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)NCc1ccccc1C[NH+]1CCCCC1)c1ccco1 ZINC000476948860 891886220 /nfs/dbraw/zinc/88/62/20/891886220.db2.gz CZZHPYBDAPVTAZ-UGKGYDQZSA-N 2 0 412.578 4.194 20 0 HIADRP Cc1ccccc1[C@H]([C@@H](C)NC(=O)[C@@H]1C[N@@H+](C(C)(C)C)C[C@H]1C(F)(F)F)[NH+](C)C ZINC000504984597 913731160 /nfs/dbraw/zinc/73/11/60/913731160.db2.gz GXUPHVKESPTQSI-OWYHZJEWSA-N 2 0 413.528 4.011 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CC(=O)N2CCc3[nH]c4ccccc4c3C2)CC1 ZINC000478035200 893165593 /nfs/dbraw/zinc/16/55/93/893165593.db2.gz TYLXHINXQXEREL-HXUWFJFHSA-N 2 0 422.617 4.029 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)[C@@H]3CCC[N@H+](Cc4cccc(F)c4)C3)CC2)CC1 ZINC000505134487 913836014 /nfs/dbraw/zinc/83/60/14/913836014.db2.gz NRCNSPSRCPPCMV-DNFKCEGXSA-N 2 0 415.597 4.197 20 0 HIADRP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479279854 894556462 /nfs/dbraw/zinc/55/64/62/894556462.db2.gz GEOUGXQAGZWXAN-CQSZACIVSA-N 2 0 422.333 4.146 20 0 HIADRP COc1ccc(-c2ccncc2)cc1C[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000479419282 894728202 /nfs/dbraw/zinc/72/82/02/894728202.db2.gz IBMAWYDDCQAVDM-UHFFFAOYSA-N 2 0 417.553 4.004 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](NC[C@H](c2cccs2)[NH+]2CCC(C)CC2)[C@H](C)C1 ZINC000479848534 895179067 /nfs/dbraw/zinc/17/90/67/895179067.db2.gz FSPCAPAQRGOMPP-BHIFYINESA-N 2 0 407.668 4.248 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(-n2ccnc2)cc1 ZINC000480232586 895638299 /nfs/dbraw/zinc/63/82/99/895638299.db2.gz OQDZSCFBWJKNTQ-NJYVYQBISA-N 2 0 404.558 4.332 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21)N1CC[NH+](C)CC1 ZINC000480523443 895887183 /nfs/dbraw/zinc/88/71/83/895887183.db2.gz HHKJPEOCWMLXQK-TZIWHRDSSA-N 2 0 416.610 4.188 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000480603659 895967887 /nfs/dbraw/zinc/96/78/87/895967887.db2.gz DZOIPCBWRLOZBZ-VQIMIIECSA-N 2 0 419.038 4.457 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480699776 896060305 /nfs/dbraw/zinc/06/03/05/896060305.db2.gz BBDANRJCEVWONQ-SFHVURJKSA-N 2 0 409.574 4.488 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCN(c3ccccc3C(F)(F)F)C2)[C@H](C)C1 ZINC000480722065 896083820 /nfs/dbraw/zinc/08/38/20/896083820.db2.gz ADFNZAZLNDZGDF-HBFSDRIKSA-N 2 0 413.528 4.011 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C3CCN(Cc4cccnc4)CC3)cc2)C1 ZINC000480727189 896087362 /nfs/dbraw/zinc/08/73/62/896087362.db2.gz NGYRRGZURMSEMX-FGZHOGPDSA-N 2 0 406.618 4.314 20 0 HIADRP Cc1ccccc1OCCCC(=O)Nc1ccc(C[NH2+][C@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000480737741 896098575 /nfs/dbraw/zinc/09/85/75/896098575.db2.gz DTOOFWOWAVFEKN-OFNKIYASSA-N 2 0 409.574 4.223 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccc(Br)s2)CC1 ZINC000480740428 896103346 /nfs/dbraw/zinc/10/33/46/896103346.db2.gz PLACCWWYZPBCPD-INIZCTEOSA-N 2 0 422.436 4.499 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000480778794 896144846 /nfs/dbraw/zinc/14/48/46/896144846.db2.gz LEJXVZQIPOAJRN-QHCPKHFHSA-N 2 0 403.973 4.380 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccncc2)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000480915788 896273552 /nfs/dbraw/zinc/27/35/52/896273552.db2.gz XXBXKMCBSFXCTE-IBGZPJMESA-N 2 0 418.541 4.125 20 0 HIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2sc(Cc3ccc(OC)c(OC)c3)nc2C)C1 ZINC000481019860 896349393 /nfs/dbraw/zinc/34/93/93/896349393.db2.gz GLDYHDHULKXKDO-QFBILLFUSA-N 2 0 417.619 4.442 20 0 HIADRP C[C@H]([NH2+]CC1(c2ccc(F)cc2)CCOCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000481181316 896520981 /nfs/dbraw/zinc/52/09/81/896520981.db2.gz YZWCUKBKYVLMEL-IBGZPJMESA-N 2 0 400.538 4.165 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1OCCN1CCOCC1)c1cccc(-c2ccncc2)c1 ZINC000481199940 896552268 /nfs/dbraw/zinc/55/22/68/896552268.db2.gz GLRIWQKYQIMQMT-OAQYLSRUSA-N 2 0 417.553 4.310 20 0 HIADRP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000481234034 896583260 /nfs/dbraw/zinc/58/32/60/896583260.db2.gz PXQMRUCUVSXWQM-HOTGVXAUSA-N 2 0 423.388 4.086 20 0 HIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000481234036 896583504 /nfs/dbraw/zinc/58/35/04/896583504.db2.gz PXQMRUCUVSXWQM-JKSUJKDBSA-N 2 0 423.388 4.086 20 0 HIADRP Cc1nc(-c2cc([C@H](C)[NH2+]Cc3cccnc3N3CC[NH+](C)CC3)cs2)cs1 ZINC000481238473 896588532 /nfs/dbraw/zinc/58/85/32/896588532.db2.gz ZTEZNOKRLGOSFG-HNNXBMFYSA-N 2 0 413.616 4.178 20 0 HIADRP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000481243193 896593905 /nfs/dbraw/zinc/59/39/05/896593905.db2.gz SNTSOUXXTMVQJK-HXUWFJFHSA-N 2 0 402.542 4.477 20 0 HIADRP CCC[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000481255517 896605875 /nfs/dbraw/zinc/60/58/75/896605875.db2.gz IRASWQZDJNJPOQ-HXUWFJFHSA-N 2 0 406.496 4.483 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc(-n4cccn4)cc3)CC2)cc1 ZINC000481719149 897114070 /nfs/dbraw/zinc/11/40/70/897114070.db2.gz PMNNOUHXELYZFH-HXUWFJFHSA-N 2 0 404.558 4.444 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCc2c1cc(Br)cc2F ZINC000481731064 897125871 /nfs/dbraw/zinc/12/58/71/897125871.db2.gz PTHRRHWKYZDOGE-LJQANCHMSA-N 2 0 407.327 4.306 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(Cn3cnc4ccccc43)cc2)[C@@H](C)C1 ZINC000481733154 897127106 /nfs/dbraw/zinc/12/71/06/897127106.db2.gz GUVNHFHQHAOVIF-XUZZJYLKSA-N 2 0 420.601 4.311 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCCOc2c(Br)cccc21 ZINC000481733592 897127621 /nfs/dbraw/zinc/12/76/21/897127621.db2.gz FUZXEWCPBIXXCL-LJQANCHMSA-N 2 0 419.363 4.393 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H](c2cccnc2)C2CCC2)c1)C1CCOCC1 ZINC000481929878 897314885 /nfs/dbraw/zinc/31/48/85/897314885.db2.gz VQGRKGMIHXKFEB-RUZDIDTESA-N 2 0 409.574 4.202 20 0 HIADRP Cc1c(Cl)cccc1NC(=O)CC[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000482013195 897412580 /nfs/dbraw/zinc/41/25/80/897412580.db2.gz USZBUMGBGVYFDR-QGZVFWFLSA-N 2 0 403.954 4.268 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+][C@H](CCc3ccccc3)Cc3ccccc3)CC2)CC1 ZINC000482121832 897576373 /nfs/dbraw/zinc/57/63/73/897576373.db2.gz DGDHGQRRONKNHS-AREMUKBSSA-N 2 0 405.630 4.379 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(Br)cc3cccnc32)[C@@H](C)C1 ZINC000482140725 897600541 /nfs/dbraw/zinc/60/05/41/897600541.db2.gz SUXFGXAJDHNECU-JXFKEZNVSA-N 2 0 420.395 4.224 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000482259039 897741726 /nfs/dbraw/zinc/74/17/26/897741726.db2.gz RSYAQVYYGIFNHI-KRWDZBQOSA-N 2 0 422.598 4.261 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cc(F)cc(F)c1 ZINC000482263917 897748540 /nfs/dbraw/zinc/74/85/40/897748540.db2.gz MGNGQGAWEILJSN-QGZVFWFLSA-N 2 0 404.501 4.305 20 0 HIADRP C[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000482462485 898035989 /nfs/dbraw/zinc/03/59/89/898035989.db2.gz KFVFVUVLOLYZPE-UONOGXRCSA-N 2 0 411.434 4.258 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2ccc(SCC(F)(F)F)cc2)CC1 ZINC000482511132 898095520 /nfs/dbraw/zinc/09/55/20/898095520.db2.gz PFRZLHZMDQUNCM-DLBZAZTESA-N 2 0 403.558 4.265 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2ccc3ccccc3c2OC(F)F)CC1 ZINC000482513122 898098146 /nfs/dbraw/zinc/09/81/46/898098146.db2.gz SLMHRBPYWQTWRK-MSOLQXFVSA-N 2 0 405.533 4.365 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2ccc3ccccc3c2OC(F)F)CC1 ZINC000482513717 898100418 /nfs/dbraw/zinc/10/04/18/898100418.db2.gz SLMHRBPYWQTWRK-ROUUACIJSA-N 2 0 405.533 4.365 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(F)cc1N(C)C ZINC000482544599 898133199 /nfs/dbraw/zinc/13/31/99/898133199.db2.gz TWIHJUWWCWQNJA-IAGOWNOFSA-N 2 0 402.533 4.194 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000482557655 898149353 /nfs/dbraw/zinc/14/93/53/898149353.db2.gz PGLORSLVHPECDG-KRWDZBQOSA-N 2 0 422.598 4.321 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CCCN1CCC[N@H+](C)CC1 ZINC000482560140 898151159 /nfs/dbraw/zinc/15/11/59/898151159.db2.gz UAUQBGBMOPRYFX-MRXNPFEDSA-N 2 0 407.027 4.450 20 0 HIADRP CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)OCCO2 ZINC000482565130 898158312 /nfs/dbraw/zinc/15/83/12/898158312.db2.gz MPMXLKGMYSRVLJ-UTKZUKDTSA-N 2 0 413.537 4.151 20 0 HIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000482634362 898238823 /nfs/dbraw/zinc/23/88/23/898238823.db2.gz SLCVHXUWGURGRC-CVDCTZTESA-N 2 0 409.574 4.022 20 0 HIADRP Cc1cc(C)c2c(c1)[C@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c1)CCCO2 ZINC000482809031 898420173 /nfs/dbraw/zinc/42/01/73/898420173.db2.gz CADWMCOYUULFEP-LADGPHEKSA-N 2 0 421.585 4.004 20 0 HIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CCCC[N@@H+]3CCC[C@@H]3CO)s2)cc1 ZINC000482874107 898486187 /nfs/dbraw/zinc/48/61/87/898486187.db2.gz HITUWKBGVZEEQG-QFBILLFUSA-N 2 0 403.592 4.015 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000482886231 898500610 /nfs/dbraw/zinc/50/06/10/898500610.db2.gz IMRUZZFKVFVFCI-ZJSXRUAMSA-N 2 0 405.586 4.240 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cccc(NS(C)(=O)=O)c1 ZINC000482944274 898568039 /nfs/dbraw/zinc/56/80/39/898568039.db2.gz HVXVASBXQISTFZ-LJQANCHMSA-N 2 0 415.603 4.285 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C[N@@H+]1Cc1ccccc1 ZINC000483167289 898836632 /nfs/dbraw/zinc/83/66/32/898836632.db2.gz IGPXOAIAFLKQQV-ZJSXRUAMSA-N 2 0 405.586 4.068 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1Br ZINC000483511173 899173847 /nfs/dbraw/zinc/17/38/47/899173847.db2.gz CESIDCMIMBVKSU-QGZVFWFLSA-N 2 0 424.427 4.059 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C[C@H]1C ZINC000483691494 899349906 /nfs/dbraw/zinc/34/99/06/899349906.db2.gz JQXSMJDRXHSZOV-HYBUGGRVSA-N 2 0 422.617 4.429 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)cc1 ZINC000483713314 899371275 /nfs/dbraw/zinc/37/12/75/899371275.db2.gz RWHCJBSTEUZVHI-RTBURBONSA-N 2 0 403.592 4.009 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@H]2CCc3ccc(F)cc32)CC1 ZINC000483734170 899394755 /nfs/dbraw/zinc/39/47/55/899394755.db2.gz PCVWPOKOWHPAHD-FQEVSTJZSA-N 2 0 407.455 4.373 20 0 HIADRP C[C@H]([NH2+]C1(CN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CCOCC1)c1ccccc1 ZINC000484135992 899757000 /nfs/dbraw/zinc/75/70/00/899757000.db2.gz BFEFYVZSDXPVJW-MVERNJQCSA-N 2 0 421.629 4.387 20 0 HIADRP C[C@H]([NH2+]C1(CN[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CCOCC1)c1ccccc1 ZINC000484135988 899757165 /nfs/dbraw/zinc/75/71/65/899757165.db2.gz BFEFYVZSDXPVJW-FXSPECFOSA-N 2 0 421.629 4.387 20 0 HIADRP CC[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(Cl)ccc1OC ZINC000484289398 899854349 /nfs/dbraw/zinc/85/43/49/899854349.db2.gz JKUSQLWBNLECET-IBGZPJMESA-N 2 0 410.002 4.016 20 0 HIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccc2c(c1)OCCO2 ZINC000484478895 899971982 /nfs/dbraw/zinc/97/19/82/899971982.db2.gz VNBKLBIHRDCWEX-HXUWFJFHSA-N 2 0 410.558 4.180 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000484484177 899975841 /nfs/dbraw/zinc/97/58/41/899975841.db2.gz NJOPLJZWAHWCBG-JOCHJYFZSA-N 2 0 420.475 4.319 20 0 HIADRP C[NH+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000484723790 900153230 /nfs/dbraw/zinc/15/32/30/900153230.db2.gz BSCVMFGVGPSPTA-QFIPXVFZSA-N 2 0 420.601 4.043 20 0 HIADRP COc1cccc(NC(=O)CC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)c1 ZINC000485300781 900578562 /nfs/dbraw/zinc/57/85/62/900578562.db2.gz FRUOGLQTTBBIFU-URXFXBBRSA-N 2 0 407.558 4.010 20 0 HIADRP c1ccc(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)c(C[NH+]2CC[C@@H](C3CCOCC3)C2)c1 ZINC000485509251 900796555 /nfs/dbraw/zinc/79/65/55/900796555.db2.gz YFJGWHHIHGZHSA-CLJLJLNGSA-N 2 0 412.618 4.184 20 0 HIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CCC(=O)Nc3ccccc3C(F)(F)F)C2)CC1 ZINC000485674610 900924342 /nfs/dbraw/zinc/92/43/42/900924342.db2.gz ZGSQHATUKJBIFJ-SFHVURJKSA-N 2 0 411.512 4.478 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H](C)c2ccc3ncsc3c2)CC1 ZINC000485842144 901087074 /nfs/dbraw/zinc/08/70/74/901087074.db2.gz BFDUOPAUOFEZMX-GOSISDBHSA-N 2 0 422.598 4.036 20 0 HIADRP C[NH+](C)CCCN(C(=O)CC1CC[NH+](C)CC1)C(c1ccccc1)c1ccccc1 ZINC000486104629 901291585 /nfs/dbraw/zinc/29/15/85/901291585.db2.gz XCIFXUUQRFSSNU-UHFFFAOYSA-N 2 0 407.602 4.288 20 0 HIADRP C[C@H](NC(=O)N[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000486325041 901502034 /nfs/dbraw/zinc/50/20/34/901502034.db2.gz UEKYQQVXTWGDIO-WIHVIGOGSA-N 2 0 420.601 4.032 20 0 HIADRP COc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(SC)cc1OC ZINC000486504791 901655970 /nfs/dbraw/zinc/65/59/70/901655970.db2.gz KMUISNBSAQDZRC-HKUYNNGSSA-N 2 0 400.588 4.426 20 0 HIADRP C[N@@H+](Cc1cncc(OCc2ccccc2)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000488146766 902640606 /nfs/dbraw/zinc/64/06/06/902640606.db2.gz IKMZSDWOGXNXHV-UHFFFAOYSA-N 2 0 402.542 4.404 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](CC(=O)N2CCCCC[C@H]2c2ccc(OC)cc2)CC1 ZINC000488296791 902758781 /nfs/dbraw/zinc/75/87/81/902758781.db2.gz SDQPUDQGVQLPLH-DEOSSOPVSA-N 2 0 415.622 4.193 20 0 HIADRP O[C@H](COc1ccc(Oc2ccccc2)cc1)C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488423478 902820186 /nfs/dbraw/zinc/82/01/86/902820186.db2.gz XBRFNGUOZBGWLS-QFIPXVFZSA-N 2 0 410.558 4.026 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)cc1)C1CC1 ZINC000488531350 902871568 /nfs/dbraw/zinc/87/15/68/902871568.db2.gz LZGRQNPTOLUEDD-CJFMBICVSA-N 2 0 405.586 4.311 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488580504 902891566 /nfs/dbraw/zinc/89/15/66/902891566.db2.gz KVJCUAYMWPGAEE-OFVILXPXSA-N 2 0 422.617 4.190 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)N[C@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)CC1 ZINC000488606256 902896828 /nfs/dbraw/zinc/89/68/28/902896828.db2.gz CIPZAJTYZLYGPZ-VXKWHMMOSA-N 2 0 422.564 4.052 20 0 HIADRP Clc1ccc(-c2nc(C[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)co2)cc1 ZINC000506023317 914702547 /nfs/dbraw/zinc/70/25/47/914702547.db2.gz WBQSNJIVZUWVPX-UHFFFAOYSA-N 2 0 403.954 4.319 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+][C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000490124002 903780370 /nfs/dbraw/zinc/78/03/70/903780370.db2.gz HRCQHMFKHNDAQP-QFIPXVFZSA-N 2 0 416.407 4.154 20 0 HIADRP C[C@H](NC(=O)[C@H]1CCCC[N@@H+]1Cc1ccccc1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000490810780 904257546 /nfs/dbraw/zinc/25/75/46/904257546.db2.gz HRMKTBYEYQUWQC-FTBPSBKWSA-N 2 0 405.586 4.068 20 0 HIADRP C[C@H](NC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccccc1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000490810783 904257812 /nfs/dbraw/zinc/25/78/12/904257812.db2.gz HRMKTBYEYQUWQC-TUSQITKMSA-N 2 0 405.586 4.068 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000491015706 904369905 /nfs/dbraw/zinc/36/99/05/904369905.db2.gz ALZDWVCRNIOPHD-FDDCHVKYSA-N 2 0 403.973 4.432 20 0 HIADRP COc1ccc([C@@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2ccccc2Cl)cc1 ZINC000491012634 904370384 /nfs/dbraw/zinc/37/03/84/904370384.db2.gz YAPPVYRJTJZLOL-HSZRJFAPSA-N 2 0 401.982 4.055 20 0 HIADRP CSc1cccc([C@H]([NH2+]C[C@@H](C)N2CC[NH+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491025646 904378021 /nfs/dbraw/zinc/37/80/21/904378021.db2.gz WUAZDEKBRSVKIH-ZHRRBRCNSA-N 2 0 405.558 4.002 20 0 HIADRP COc1c(O)cccc1C[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000491056617 904400770 /nfs/dbraw/zinc/40/07/70/904400770.db2.gz BXOMGRBCVYRTON-UHFFFAOYSA-N 2 0 417.553 4.013 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)CC[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491062017 904404990 /nfs/dbraw/zinc/40/49/90/904404990.db2.gz PPNFTAFUVRDYMM-GOSISDBHSA-N 2 0 407.986 4.265 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(Br)c(Cl)c3)cc2)CC1 ZINC000494017481 905355133 /nfs/dbraw/zinc/35/51/33/905355133.db2.gz MWJYMZKRMJRJMN-UHFFFAOYSA-N 2 0 423.782 4.349 20 0 HIADRP Cc1ccc([C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c2ccccc2)cc1 ZINC000494067121 905404545 /nfs/dbraw/zinc/40/45/45/905404545.db2.gz VHMYIHFGTDWYPB-VWLOTQADSA-N 2 0 401.554 4.166 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2ccccc2C[NH+]2CCCCCC2)CC1 ZINC000494551829 905830109 /nfs/dbraw/zinc/83/01/09/905830109.db2.gz FZRFLXVWUJBBED-UHFFFAOYSA-N 2 0 414.638 4.374 20 0 HIADRP COc1cccc([C@@H]2[C@@H]([NH2+][C@H](C)c3cccc(OCC[NH+](C)C)c3)CCN2C2CC2)c1 ZINC000495403368 906428687 /nfs/dbraw/zinc/42/86/87/906428687.db2.gz UZOXRYBGJIVNJM-JSRBVGTNSA-N 2 0 423.601 4.264 20 0 HIADRP CC[C@H]([NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1OCC(=O)N(C)C ZINC000495438306 906452456 /nfs/dbraw/zinc/45/24/56/906452456.db2.gz GWMLXJGCGSXBIB-SFLYRZDNSA-N 2 0 423.601 4.105 20 0 HIADRP Cn1cc(-c2ccccc2C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000512612953 921260942 /nfs/dbraw/zinc/26/09/42/921260942.db2.gz QPVBNRKEBIGQOF-HDYLNDSGSA-N 2 0 400.570 4.477 20 0 HIADRP COc1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1NC(C)=O ZINC000512618011 921263576 /nfs/dbraw/zinc/26/35/76/921263576.db2.gz HKHMVVLBPINYGS-DNVJHFABSA-N 2 0 407.558 4.044 20 0 HIADRP O=C1CCCN1Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000512642219 921271582 /nfs/dbraw/zinc/27/15/82/921271582.db2.gz NGXHIGRSEOHBJQ-TWJOJJKGSA-N 2 0 417.597 4.199 20 0 HIADRP C[C@H](C[NH2+][C@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1)CN1CC[NH+](C)CC1 ZINC000512643543 921271655 /nfs/dbraw/zinc/27/16/55/921271655.db2.gz XLYNNAHCILLIET-VGSWGCGISA-N 2 0 423.498 4.407 20 0 HIADRP CCC(CC)(CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[NH2+][C@@H](C)c1ccccc1 ZINC000497445952 906920646 /nfs/dbraw/zinc/92/06/46/906920646.db2.gz VCHMJNNQNXYPGW-WTBLGDFPSA-N 2 0 400.611 4.163 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NC2CC[NH+](CC3CCCC3)CC2)CC1 ZINC000497569281 907055583 /nfs/dbraw/zinc/05/55/83/907055583.db2.gz HRLRPQVBWODZOY-HXUWFJFHSA-N 2 0 412.622 4.166 20 0 HIADRP C[C@@H](NC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512695295 921290363 /nfs/dbraw/zinc/29/03/63/921290363.db2.gz SUMPUBDXOSEWAV-IFMALSPDSA-N 2 0 412.622 4.490 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@@H](C)[C@H]2CCC[NH+](C3CCC3)C2)CC1)CC1CC1 ZINC000512711711 921294220 /nfs/dbraw/zinc/29/42/20/921294220.db2.gz KVTNDEQAIXHVMQ-REWPJTCUSA-N 2 0 418.670 4.183 20 0 HIADRP C[NH+](C)CCNC(=O)C1CC[NH+](Cc2ccc(-c3cccc(Cl)c3Cl)o2)CC1 ZINC000512714013 921295036 /nfs/dbraw/zinc/29/50/36/921295036.db2.gz KUYJXNAHDFLJKE-UHFFFAOYSA-N 2 0 424.372 4.143 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H]3CC=C(c4ccc(F)cc4)CC3)c2)C1 ZINC000497834976 907317248 /nfs/dbraw/zinc/31/72/48/907317248.db2.gz BHRKFCYOLRMQIJ-ZCYQVOJMSA-N 2 0 421.560 4.249 20 0 HIADRP CCC[C@H]([NH2+]C(C)C)C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000498377843 907867118 /nfs/dbraw/zinc/86/71/18/907867118.db2.gz OFJZBDIASXYSCO-IHPCNDPISA-N 2 0 413.528 4.371 20 0 HIADRP C[C@H](NC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[C@H](c1ccccc1)[NH+](C)C ZINC000498899547 908305074 /nfs/dbraw/zinc/30/50/74/908305074.db2.gz SQVMTETWEHQRHO-WNXIRNOKSA-N 2 0 408.590 4.030 20 0 HIADRP CC(C)C[C@@H](CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[NH2+][C@@H](C)c1ccccc1 ZINC000499196432 908551409 /nfs/dbraw/zinc/55/14/09/908551409.db2.gz VUZRQPTWCMDPEK-GNCJRNFWSA-N 2 0 400.611 4.019 20 0 HIADRP Cc1ccc(-c2ccsc2C(=O)NCCC[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000500028545 909486558 /nfs/dbraw/zinc/48/65/58/909486558.db2.gz XJTDZCYJRCMNOG-UHFFFAOYSA-N 2 0 420.582 4.061 20 0 HIADRP CCC[NH+]1CCC(CNc2nc(CN3CCCC3)nc3sc(C)c(C)c32)CC1 ZINC000500544075 909916227 /nfs/dbraw/zinc/91/62/27/909916227.db2.gz JIKAEBUAOOCLOL-UHFFFAOYSA-N 2 0 401.624 4.438 20 0 HIADRP Brc1csc(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)c1 ZINC000513091775 921541200 /nfs/dbraw/zinc/54/12/00/921541200.db2.gz CQBJVKSDKOQJRM-UHFFFAOYSA-N 2 0 422.436 4.198 20 0 HIADRP c1sc(-c2ccccc2)nc1C[NH2+]CCCC[NH+]1CCN(Cc2ccccc2)CC1 ZINC000513092545 921542235 /nfs/dbraw/zinc/54/22/35/921542235.db2.gz OIEXGFSKUXDZJM-UHFFFAOYSA-N 2 0 420.626 4.498 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000501015835 910235619 /nfs/dbraw/zinc/23/56/19/910235619.db2.gz RMPXVIQSYKAPNZ-DEOSSOPVSA-N 2 0 401.545 4.254 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCC[C@H]2c2nc(-c3cccc(F)c3)c[nH]2)CC1 ZINC000501029843 910246321 /nfs/dbraw/zinc/24/63/21/910246321.db2.gz RXJLGLMLACGTJL-QHCPKHFHSA-N 2 0 413.585 4.159 20 0 HIADRP CC(C)C[C@H](NC(=O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000501043919 910256695 /nfs/dbraw/zinc/25/66/95/910256695.db2.gz DZSYJJAQPWAJTG-DEOSSOPVSA-N 2 0 408.590 4.133 20 0 HIADRP Cc1c(Cl)cccc1NC(=O)[C@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501050914 910260560 /nfs/dbraw/zinc/26/05/60/910260560.db2.gz MELGBJPCLDAVEN-KRWDZBQOSA-N 2 0 400.954 4.219 20 0 HIADRP C[C@H](OC[C@@H](O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000501052592 910263370 /nfs/dbraw/zinc/26/33/70/910263370.db2.gz PCQSYHLDBAUUIK-MBSDFSHPSA-N 2 0 417.981 4.022 20 0 HIADRP C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501090579 910290185 /nfs/dbraw/zinc/29/01/85/910290185.db2.gz SVLVGZUPAHXYMV-ZWKOTPCHSA-N 2 0 414.981 4.149 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000501414157 910547409 /nfs/dbraw/zinc/54/74/09/910547409.db2.gz SGJYTXGKLQQDHE-UHFFFAOYSA-N 2 0 401.545 4.104 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)c2cccs2)CC1 ZINC000501520897 910629810 /nfs/dbraw/zinc/62/98/10/910629810.db2.gz XPSNYYUGRQNFKW-RBUKOAKNSA-N 2 0 420.648 4.185 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2nc(-c3ccc(C)c(F)c3)no2)CC1 ZINC000501786053 910839805 /nfs/dbraw/zinc/83/98/05/910839805.db2.gz ORSLLKNBWYPXOE-SFHVURJKSA-N 2 0 418.557 4.316 20 0 HIADRP Cc1cc([C@H]2CCC[N@H+]2CCCN2CC[NH+](C(C)C)CC2)ccc1Br ZINC000501883616 910902623 /nfs/dbraw/zinc/90/26/23/910902623.db2.gz AUKHECMACNIUOX-OAQYLSRUSA-N 2 0 408.428 4.311 20 0 HIADRP c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+][C@@H]3CCCC34CCOCC4)CC2)cc1 ZINC000502282522 911233276 /nfs/dbraw/zinc/23/32/76/911233276.db2.gz CEFRADXLZIHTBS-AREMUKBSSA-N 2 0 419.613 4.448 20 0 HIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+]C2CCN(c3nccs3)CC2)CC1 ZINC000513234078 921647083 /nfs/dbraw/zinc/64/70/83/921647083.db2.gz RWFATPDDNVOSQN-UHFFFAOYSA-N 2 0 405.011 4.267 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C1 ZINC000502646041 911683430 /nfs/dbraw/zinc/68/34/30/911683430.db2.gz APCYTASFZZKUJN-FGZHOGPDSA-N 2 0 406.659 4.042 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NC[C@H](c2cccc(OC)c2)[NH+]2CCCC2)cc1 ZINC000513287242 921686226 /nfs/dbraw/zinc/68/62/26/921686226.db2.gz OKSUPPFXQMULGN-XMMPIXPASA-N 2 0 409.574 4.104 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)NCc1ccccc1C[NH+]1CCCCC1 ZINC000502877258 911878577 /nfs/dbraw/zinc/87/85/77/911878577.db2.gz USCOULKINVIFAE-NRFANRHFSA-N 2 0 400.611 4.126 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1ccccc1 ZINC000503141509 912102959 /nfs/dbraw/zinc/10/29/59/912102959.db2.gz SKZFVMMJRZEJSK-FPOVZHCZSA-N 2 0 412.578 4.235 20 0 HIADRP COc1ccc2c(c1)C[C@@H]([NH2+]CCCOC1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000513388015 921759981 /nfs/dbraw/zinc/75/99/81/921759981.db2.gz JHHGVMDGMXPZOJ-DEOSSOPVSA-N 2 0 408.586 4.213 20 0 HIADRP COc1ccc(C(=O)Nc2cccc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)c2)cc1 ZINC000506945213 915749516 /nfs/dbraw/zinc/74/95/16/915749516.db2.gz XEMSJPLLKKBYLC-UHFFFAOYSA-N 2 0 407.558 4.255 20 0 HIADRP CCc1ccc([C@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000507471163 916240432 /nfs/dbraw/zinc/24/04/32/916240432.db2.gz BJFQOHIYIDTPHL-QHCPKHFHSA-N 2 0 414.615 4.063 20 0 HIADRP Clc1cccc(-c2noc(CC[NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]34)n2)c1 ZINC000507471361 916241514 /nfs/dbraw/zinc/24/15/14/916241514.db2.gz PAOPTEIEVVJKMF-CEMLEFRQSA-N 2 0 422.960 4.433 20 0 HIADRP Clc1ccc(-c2n[nH]cc2C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)cc1 ZINC000507717282 916510202 /nfs/dbraw/zinc/51/02/02/916510202.db2.gz HCWFJZFIKDSYNP-UHFFFAOYSA-N 2 0 402.970 4.055 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)C[C@H](C)O1 ZINC000507872141 916711325 /nfs/dbraw/zinc/71/13/25/916711325.db2.gz DZOCNDRLJNBNRC-MAODHWIISA-N 2 0 416.606 4.286 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000508317029 917122793 /nfs/dbraw/zinc/12/27/93/917122793.db2.gz ZHAXUUBVVNZZKA-KRWDZBQOSA-N 2 0 415.965 4.451 20 0 HIADRP COc1cccc([C@@H]2[C@H]([NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CCN2C2CC2)c1 ZINC000508696296 917456624 /nfs/dbraw/zinc/45/66/24/917456624.db2.gz JLBLCDKXWHZDNR-CYPYXQILSA-N 2 0 419.613 4.473 20 0 HIADRP Cc1ccccc1[C@@H]([C@@H](C)NC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000508897240 917652409 /nfs/dbraw/zinc/65/24/09/917652409.db2.gz JHKDFMJSBRGDOP-PXDATVDWSA-N 2 0 422.617 4.292 20 0 HIADRP FC(F)(F)CN1CCC([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)CC1 ZINC000509467626 918116156 /nfs/dbraw/zinc/11/61/56/918116156.db2.gz XIASWECJVVDBGL-UHFFFAOYSA-N 2 0 403.920 4.168 20 0 HIADRP Cn1cc(-c2ccc(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)s2)cn1 ZINC000509474287 918121679 /nfs/dbraw/zinc/12/16/79/918121679.db2.gz YNPCCMZVBYTJBH-UHFFFAOYSA-N 2 0 424.614 4.310 20 0 HIADRP C[C@@H]1C[C@H](CCNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)C[N@@H+]1Cc1ccccc1 ZINC000509569327 918219666 /nfs/dbraw/zinc/21/96/66/918219666.db2.gz CMAVPXZVTPSGRR-PUHATCMVSA-N 2 0 424.589 4.016 20 0 HIADRP CC[C@@H](C)[NH2+][C@@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000509576710 918226445 /nfs/dbraw/zinc/22/64/45/918226445.db2.gz HOAZLIAEMCOBNV-KNQAVFIVSA-N 2 0 412.578 4.015 20 0 HIADRP CC[NH+]1CCN(c2ccc(C(=O)Nc3ccc(C[N@@H+]4CCC[C@H](C)C4)cc3)cc2)CC1 ZINC000510390093 918868221 /nfs/dbraw/zinc/86/82/21/918868221.db2.gz VORGSMHNQVOHLZ-NRFANRHFSA-N 2 0 420.601 4.313 20 0 HIADRP CC(C)C[C@@H](CNC(=O)N1CCCC12CC[NH+](C)CC2)[NH2+][C@H](C)c1ccccc1 ZINC000510934712 919456352 /nfs/dbraw/zinc/45/63/52/919456352.db2.gz QYXJCUPPVVXOKY-IRLDBZIGSA-N 2 0 400.611 4.022 20 0 HIADRP O=C(Cc1ccccc1)N1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000511003894 919563230 /nfs/dbraw/zinc/56/32/30/919563230.db2.gz XFHLEPWFLDDBCL-ASDGIDEWSA-N 2 0 417.597 4.005 20 0 HIADRP C[NH+](C)Cc1cccc(CNC(=O)c2cccc(C[N@H+](C)Cc3ccccc3)c2)c1 ZINC000511165444 919786498 /nfs/dbraw/zinc/78/64/98/919786498.db2.gz GXMGWNJPAMDFBF-UHFFFAOYSA-N 2 0 401.554 4.310 20 0 HIADRP COc1cc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc(OC)c1OCc1ccccc1 ZINC000511542158 920166677 /nfs/dbraw/zinc/16/66/77/920166677.db2.gz OCPIEVRKXYWAFW-UHFFFAOYSA-N 2 0 412.574 4.447 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]C2CC(c3ccccc3Cl)C2)cc1 ZINC000512113485 920868506 /nfs/dbraw/zinc/86/85/06/920868506.db2.gz DHSCBYVCUAESJY-UHFFFAOYSA-N 2 0 411.977 4.201 20 0 HIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)C1 ZINC000512129642 920877538 /nfs/dbraw/zinc/87/75/38/920877538.db2.gz LNACRBMNUURKMV-ZIAGYGMSSA-N 2 0 405.892 4.397 20 0 HIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)C1 ZINC000512129639 920877952 /nfs/dbraw/zinc/87/79/52/920877952.db2.gz LNACRBMNUURKMV-KBPBESRZSA-N 2 0 405.892 4.397 20 0 HIADRP CC(C)[NH+](CCN(C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C(C)C ZINC000512196896 920942228 /nfs/dbraw/zinc/94/22/28/920942228.db2.gz OJJRLZRUCZWCMF-QFIPXVFZSA-N 2 0 402.627 4.047 20 0 HIADRP CSc1ccccc1NC(=O)CC[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512260783 921017930 /nfs/dbraw/zinc/01/79/30/921017930.db2.gz LZGTTWMMZADQLO-XMMPIXPASA-N 2 0 409.599 4.335 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512327253 921077404 /nfs/dbraw/zinc/07/74/04/921077404.db2.gz CSOQJPAZSKEBBC-QYZOEREBSA-N 2 0 406.014 4.320 20 0 HIADRP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(-c4ccc(C(F)(F)F)cc4)o3)C2)CC1 ZINC000513460874 921824449 /nfs/dbraw/zinc/82/44/49/921824449.db2.gz IZQOXGQANZPFGI-IBGZPJMESA-N 2 0 407.480 4.177 20 0 HIADRP FC(F)(F)CN1CCC([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000513665842 921987931 /nfs/dbraw/zinc/98/79/31/921987931.db2.gz HSPHEWHCGSNUJW-ILWGZMRPSA-N 2 0 409.540 4.294 20 0 HIADRP FC(F)(F)c1ccccc1OCCCC[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000513818200 922141806 /nfs/dbraw/zinc/14/18/06/922141806.db2.gz XSWGTUPPEPNOGT-UHFFFAOYSA-N 2 0 414.512 4.299 20 0 HIADRP O=C(c1ccccc1)N1CC[C@H](C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)C1 ZINC000514118472 922452405 /nfs/dbraw/zinc/45/24/05/922452405.db2.gz JIQQJHSBYSIGTH-XMMPIXPASA-N 2 0 417.597 4.137 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)C1 ZINC000514237548 922575711 /nfs/dbraw/zinc/57/57/11/922575711.db2.gz JWUKASKSLVBUOY-FQEVSTJZSA-N 2 0 419.352 4.126 20 0 HIADRP COc1ccccc1-c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000514242873 922584965 /nfs/dbraw/zinc/58/49/65/922584965.db2.gz PKJFEEUZQDQHEE-XMMPIXPASA-N 2 0 402.538 4.219 20 0 HIADRP CCc1ccc([C@@H]2CCCCCN2C(=O)NC2CC[NH+](C3CCN(C)CC3)CC2)o1 ZINC000514441487 922629464 /nfs/dbraw/zinc/62/94/64/922629464.db2.gz AMVIOIKLZGHGFS-QFIPXVFZSA-N 2 0 416.610 4.027 20 0 HIADRP C[NH+]1CCN(CCC[NH2+][C@@H](c2sccc2Br)C2CCCCC2)CC1 ZINC000514620052 922725555 /nfs/dbraw/zinc/72/55/55/922725555.db2.gz SXDRKCURANKSKF-GOSISDBHSA-N 2 0 414.457 4.359 20 0 HIADRP COc1cccc(OC)c1OCCCC[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000514689056 922756347 /nfs/dbraw/zinc/75/63/47/922756347.db2.gz SWJMZJAYAMVSSQ-NHCUHLMSSA-N 2 0 404.595 4.449 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]CCc2ccc(F)cc2Cl)c1)C1CCOCC1 ZINC000515100084 922914227 /nfs/dbraw/zinc/91/42/27/922914227.db2.gz XNUIGTRRTCYILT-UHFFFAOYSA-N 2 0 420.956 4.301 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NCc2ccc(C[NH+](C)C)cc2)c2cccs2)CC1 ZINC000515290630 923036531 /nfs/dbraw/zinc/03/65/31/923036531.db2.gz BAHAGOPHTPEWJH-OAQYLSRUSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@H](CC(=O)NCCc1ccccc1)[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000515410011 923087025 /nfs/dbraw/zinc/08/70/25/923087025.db2.gz NJHPPTHENSTJEK-RDGATRHJSA-N 2 0 407.602 4.016 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(=O)Nc1ccc(F)c(F)c1 ZINC000515519020 923150967 /nfs/dbraw/zinc/15/09/67/923150967.db2.gz BMLQTPZNTREJDU-IAGOWNOFSA-N 2 0 401.501 4.456 20 0 HIADRP Fc1cc2cccnc2c(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000516020511 923506057 /nfs/dbraw/zinc/50/60/57/923506057.db2.gz IONHWUWTMXQFID-QHCPKHFHSA-N 2 0 419.544 4.392 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1c(Br)cncc1Br ZINC000517001754 923961710 /nfs/dbraw/zinc/96/17/10/923961710.db2.gz SFNATIBGVWSHJU-CYBMUJFWSA-N 2 0 419.205 4.351 20 0 HIADRP CC(C)[N@@H+]1CCC[C@H](CNC(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)C1 ZINC000517111550 924003791 /nfs/dbraw/zinc/00/37/91/924003791.db2.gz AWZMBRAUJGRWJF-OAQYLSRUSA-N 2 0 414.638 4.371 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H](NC(=O)c1ccc(C[NH+]3CCCC3)cc1)c1ccccc1O2 ZINC000517397225 924155896 /nfs/dbraw/zinc/15/58/96/924155896.db2.gz UFJWMOYMXWENCO-HSZRJFAPSA-N 2 0 419.569 4.000 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000517545189 924256764 /nfs/dbraw/zinc/25/67/64/924256764.db2.gz GUBPASRISBDKTM-UHFFFAOYSA-N 2 0 404.558 4.038 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)c1ccc(C[NH+]2CCSCC2)cc1)c1ccccc1 ZINC000517566339 926683423 /nfs/dbraw/zinc/68/34/23/926683423.db2.gz KQKZZLQFILLDGS-LJQANCHMSA-N 2 0 411.615 4.095 20 0 HIADRP CC[NH+](CC)CCOc1ccc(NC(=O)NC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000517658862 926767070 /nfs/dbraw/zinc/76/70/70/926767070.db2.gz ULWTZGDUQRBVAX-UHFFFAOYSA-N 2 0 424.589 4.193 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CCC[C@@H]2C[NH+]2CCCC2)cc1 ZINC000517911914 926887281 /nfs/dbraw/zinc/88/72/81/926887281.db2.gz GUTAAVGXWFQOBG-XMMPIXPASA-N 2 0 420.601 4.185 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)c2ccccc2)CC1 ZINC000518363461 927222567 /nfs/dbraw/zinc/22/25/67/927222567.db2.gz KNYKLIAPVAUFBV-SFTDATJTSA-N 2 0 414.619 4.123 20 0 HIADRP O=C(NC1CC1)[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccccc1 ZINC000519333846 927886542 /nfs/dbraw/zinc/88/65/42/927886542.db2.gz JEBOKYDJGWVBOZ-QHCPKHFHSA-N 2 0 411.977 4.162 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3cccc(OC(F)(F)F)c3)cc2)CC1 ZINC000520204050 928388546 /nfs/dbraw/zinc/38/85/46/928388546.db2.gz GUTVKWZFMMGWEK-UHFFFAOYSA-N 2 0 407.480 4.013 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCC[C@@H]2C[NH+]2CCCCC2)cc1 ZINC000520613264 928673654 /nfs/dbraw/zinc/67/36/54/928673654.db2.gz YMBOHFVKQZDQRT-ZJSXRUAMSA-N 2 0 412.622 4.221 20 0 HIADRP O=C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000520782642 928815742 /nfs/dbraw/zinc/81/57/42/928815742.db2.gz ZHBGTHMWHIREHN-FGZHOGPDSA-N 2 0 419.013 4.137 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)c1ccsc1 ZINC000520953454 928887294 /nfs/dbraw/zinc/88/72/94/928887294.db2.gz HGJIKVXGAPRCHL-KNQAVFIVSA-N 2 0 417.594 4.299 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3ccccc3OC(F)F)CC2)c1 ZINC000520954686 928888640 /nfs/dbraw/zinc/88/86/40/928888640.db2.gz CQRCHOLMGOHUAN-UHFFFAOYSA-N 2 0 403.517 4.288 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1 ZINC000521070283 928972425 /nfs/dbraw/zinc/97/24/25/928972425.db2.gz NYMPRFLNBKVMQR-LJQANCHMSA-N 2 0 409.018 4.068 20 0 HIADRP CC1(C)CC(NC(=O)NCC2CC[NH+](Cc3ccccc3Cl)CC2)CC(C)(C)[NH2+]1 ZINC000521594636 929316841 /nfs/dbraw/zinc/31/68/41/929316841.db2.gz NUBGYLMTNOWUCH-UHFFFAOYSA-N 2 0 421.029 4.160 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000524737452 929814413 /nfs/dbraw/zinc/81/44/13/929814413.db2.gz XIUPJAHOWZCLMI-IERDGZPVSA-N 2 0 411.571 4.369 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000524886877 929873427 /nfs/dbraw/zinc/87/34/27/929873427.db2.gz SHVXMIVWGCIDPE-DHLKQENFSA-N 2 0 420.601 4.130 20 0 HIADRP O=C(NCC1CC[NH+](Cc2cccs2)CC1)[C@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000525484132 930272850 /nfs/dbraw/zinc/27/28/50/930272850.db2.gz UAZCOPCBDFJFRW-HSZRJFAPSA-N 2 0 411.615 4.131 20 0 HIADRP CC[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Br)cc1Cl ZINC000525858320 930469705 /nfs/dbraw/zinc/46/97/05/930469705.db2.gz BEZZJIZRQUKNRD-GOSISDBHSA-N 2 0 402.808 4.169 20 0 HIADRP COc1ccc([C@H](CCn2cncn2)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc1 ZINC000526107043 930536356 /nfs/dbraw/zinc/53/63/56/930536356.db2.gz KFPFMGFGESWHHT-VWLOTQADSA-N 2 0 419.573 4.194 20 0 HIADRP O=C([C@@H]1CCCC[N@@H+]1Cc1ccccc1)N1CCC([NH+]2CCc3ccccc3C2)CC1 ZINC000530816023 930830389 /nfs/dbraw/zinc/83/03/89/930830389.db2.gz PYFQPWNVEUTMOY-SANMLTNESA-N 2 0 417.597 4.090 20 0 HIADRP COC1CC[NH+](C2(CNCC(C)(C)C[N@H+](C)Cc3ccccc3)CCCC2)CC1 ZINC000531096519 930917839 /nfs/dbraw/zinc/91/78/39/930917839.db2.gz AOGFGGCPAYTDMW-UHFFFAOYSA-N 2 0 401.639 4.158 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccc(Cl)cc1 ZINC000531345332 931024837 /nfs/dbraw/zinc/02/48/37/931024837.db2.gz GDTMBYRCLCADRO-NRFANRHFSA-N 2 0 407.002 4.039 20 0 HIADRP Cc1ccc(OC(F)F)c(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000531596165 931115814 /nfs/dbraw/zinc/11/58/14/931115814.db2.gz WAMFCVOTEKLCDZ-UHFFFAOYSA-N 2 0 403.517 4.417 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2cc(F)cc3cccnc32)c1)C1CCOCC1 ZINC000531612189 931125560 /nfs/dbraw/zinc/12/55/60/931125560.db2.gz KVQNXRLKSMSNFU-UHFFFAOYSA-N 2 0 423.532 4.153 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531682356 931150980 /nfs/dbraw/zinc/15/09/80/931150980.db2.gz MWQGODATWYXEQO-HSALFYBXSA-N 2 0 414.615 4.419 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+]C3CCN(c4ccccc4)CC3)CC2)cc1 ZINC000531737317 931178403 /nfs/dbraw/zinc/17/84/03/931178403.db2.gz XAEIYWWNVNVAHS-UHFFFAOYSA-N 2 0 407.602 4.316 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)CC1 ZINC000531928154 931248178 /nfs/dbraw/zinc/24/81/78/931248178.db2.gz ZDHQVYUGKHRIER-OAQYLSRUSA-N 2 0 412.622 4.110 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2sccc2Br)CC1 ZINC000531937603 931253852 /nfs/dbraw/zinc/25/38/52/931253852.db2.gz DMHLTUSPZNADBH-INIZCTEOSA-N 2 0 422.436 4.499 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1cccc(OCc2ccccc2)c1 ZINC000531941775 931254922 /nfs/dbraw/zinc/25/49/22/931254922.db2.gz UVXBGEVPSWZFOR-OAQYLSRUSA-N 2 0 416.569 4.263 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000531943309 931256239 /nfs/dbraw/zinc/25/62/39/931256239.db2.gz RVVCFFPMMUMKGU-IBGZPJMESA-N 2 0 413.993 4.463 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531945158 931257683 /nfs/dbraw/zinc/25/76/83/931257683.db2.gz CAXSSXCGORGYPT-OTWHNJEPSA-N 2 0 407.558 4.031 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000531990149 931278651 /nfs/dbraw/zinc/27/86/51/931278651.db2.gz ZVHHJPYGHFOPSH-HNNXBMFYSA-N 2 0 404.352 4.018 20 0 HIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)ccc1SC ZINC000531993228 931279625 /nfs/dbraw/zinc/27/96/25/931279625.db2.gz CYUWSLJMLWTJPS-QGZVFWFLSA-N 2 0 400.588 4.225 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000532193085 931342936 /nfs/dbraw/zinc/34/29/36/931342936.db2.gz OBTUIAMRMMMJMX-OAUYIBNBSA-N 2 0 403.876 4.292 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(Br)s2)CC1 ZINC000532296014 931389506 /nfs/dbraw/zinc/38/95/06/931389506.db2.gz QNULJCDQGQGJHG-UHFFFAOYSA-N 2 0 408.409 4.332 20 0 HIADRP CN(c1ccccc1C[NH2+]CCc1ccc(Br)s1)C1CC[NH+](C)CC1 ZINC000532361363 931409359 /nfs/dbraw/zinc/40/93/59/931409359.db2.gz BZBUCTLQFGBWJI-UHFFFAOYSA-N 2 0 422.436 4.373 20 0 HIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000532453765 931441738 /nfs/dbraw/zinc/44/17/38/931441738.db2.gz MWDDHROYTSGHAE-SFHVURJKSA-N 2 0 421.614 4.040 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCCN2CCOCC2)c1)c1ccccc1C(F)(F)F ZINC000532461652 931445940 /nfs/dbraw/zinc/44/59/40/931445940.db2.gz LHHOQHJIKXOFHF-KRWDZBQOSA-N 2 0 408.464 4.267 20 0 HIADRP O=C(c1ccccc1Cl)N1CCC([NH2+]Cc2ccc(-n3ccnc3)c(F)c2)CC1 ZINC000532465015 931446737 /nfs/dbraw/zinc/44/67/37/931446737.db2.gz DDJFTDQDHBOQPO-UHFFFAOYSA-N 2 0 412.896 4.059 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](C(C)(C)C[NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000532478442 931454344 /nfs/dbraw/zinc/45/43/44/931454344.db2.gz BLEWFUFLSMNSGK-ROUUACIJSA-N 2 0 406.014 4.291 20 0 HIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(OCc4ccc(F)cc4)cc3)C2)CC1 ZINC000532565632 931526872 /nfs/dbraw/zinc/52/68/72/931526872.db2.gz IHKZIEUCRQSEHD-XMMPIXPASA-N 2 0 411.565 4.005 20 0 HIADRP COc1cc(C[NH2+]C2CCC(C[NH+](C)C)CC2)ccc1OCc1c(C)noc1C ZINC000532724992 931611259 /nfs/dbraw/zinc/61/12/59/931611259.db2.gz VCDYRKVCBIHEHC-UHFFFAOYSA-N 2 0 401.551 4.089 20 0 HIADRP CCC1(C[NH2+]Cc2cc(OC)c(OC)c(OC)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000532805326 931634650 /nfs/dbraw/zinc/63/46/50/931634650.db2.gz OZWOHXGATIBIGH-UHFFFAOYSA-N 2 0 412.574 4.494 20 0 HIADRP C(CC[NH+]1CCC[C@@H]1CN1CCCCC1)CC[N@@H+]1CCC[C@@H]1CN1CCCCC1 ZINC000532954958 931709651 /nfs/dbraw/zinc/70/96/51/931709651.db2.gz HBXOVYYFJMCVMH-JWQCQUIFSA-N 2 0 404.687 4.057 20 0 HIADRP CC1CC[NH+](CCCC[NH2+][C@@H]2CCCC[C@H](N3C(=O)c4ccccc4C3=O)C2)CC1 ZINC000533090492 931768615 /nfs/dbraw/zinc/76/86/15/931768615.db2.gz MHWJOCNDKPDXML-RTWAWAEBSA-N 2 0 411.590 4.086 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2(CC)CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC000533133566 931778242 /nfs/dbraw/zinc/77/82/42/931778242.db2.gz WXYZCNXBERFGHU-GGAORHGYSA-N 2 0 414.638 4.193 20 0 HIADRP C[C@H](C[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1)CN1CC[NH+](C)CC1 ZINC000533608340 931921663 /nfs/dbraw/zinc/92/16/63/931921663.db2.gz OGKUWLQSQPZANO-CQSZACIVSA-N 2 0 413.418 4.090 20 0 HIADRP c1cc(C[NH+]2CC[C@H](C3CCOCC3)C2)cc(C[N@@H+]2CC[C@H](C3CCOCC3)C2)c1 ZINC000533669625 931960997 /nfs/dbraw/zinc/96/09/97/931960997.db2.gz HTOWSUMJKFKRIV-UIOOFZCWSA-N 2 0 412.618 4.184 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1CN[C@@H](C)c1ncc(Br)s1 ZINC000533783931 932030503 /nfs/dbraw/zinc/03/05/03/932030503.db2.gz QQCBAAOMLLJNAI-AWEZNQCLSA-N 2 0 412.397 4.477 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccc(C[NH+](C)C)c(F)c2)cc1OCc1cccnc1 ZINC000534969304 932867225 /nfs/dbraw/zinc/86/72/25/932867225.db2.gz NYGOJLPMTMDOBA-UHFFFAOYSA-N 2 0 409.505 4.160 20 0 HIADRP CN1CC[C@H](NC(=O)NC2CC[NH+](CC3CCCC3)CC2)[C@@H]1c1ccc(Cl)cc1 ZINC000535018417 932885929 /nfs/dbraw/zinc/88/59/29/932885929.db2.gz XXTKOFTYZFREAW-VXKWHMMOSA-N 2 0 419.013 4.039 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C[C@@H]3CCOC3)c3ccccc3)cc2)CC1 ZINC000535838741 933424509 /nfs/dbraw/zinc/42/45/09/933424509.db2.gz DXWWZIXWECIAIB-AZGAKELHSA-N 2 0 407.602 4.082 20 0 HIADRP CN1CC[C@@H](NC(=O)Nc2cccc(C[NH+](C)C)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000535839377 933424996 /nfs/dbraw/zinc/42/49/96/933424996.db2.gz YGJDJIKXEYFKEB-WOJBJXKFSA-N 2 0 404.917 4.108 20 0 HIADRP CN1CC[C@H](NC(=O)Nc2cccc(C[NH+](C)C)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000535839374 933425151 /nfs/dbraw/zinc/42/51/51/933425151.db2.gz YGJDJIKXEYFKEB-PMACEKPBSA-N 2 0 404.917 4.108 20 0 HIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cc(F)cc(Br)c1 ZINC000537306398 933707969 /nfs/dbraw/zinc/70/79/69/933707969.db2.gz GUIUMSRLNRYFCT-SLFFLAALSA-N 2 0 413.375 4.397 20 0 HIADRP COc1ccc(C[NH+]2CCC(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1OC(F)F ZINC000537660038 938348249 /nfs/dbraw/zinc/34/82/49/938348249.db2.gz UVXXFGJETFRWSB-CALCHBBNSA-N 2 0 412.521 4.008 20 0 HIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3cccc(OCCCc4ccccc4)c3)C2)CC1 ZINC000537658924 938348536 /nfs/dbraw/zinc/34/85/36/938348536.db2.gz HQTQXGMTSZBMCR-AREMUKBSSA-N 2 0 421.629 4.299 20 0 HIADRP CSc1cccc(NC(=O)[C@H](C)[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000537845387 938388692 /nfs/dbraw/zinc/38/86/92/938388692.db2.gz JJUGWLSPTGGJGZ-SFHVURJKSA-N 2 0 412.603 4.369 20 0 HIADRP Cc1cc(C[C@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)n(-c2ccccc2)n1 ZINC000537948514 938428705 /nfs/dbraw/zinc/42/87/05/938428705.db2.gz PWKOBVOIIOCPAN-PZJWPPBQSA-N 2 0 406.574 4.403 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(Cn3cnc4ccccc43)c2)[C@H](C)C1 ZINC000537959288 938433991 /nfs/dbraw/zinc/43/39/91/938433991.db2.gz AKMRVRUJCNXVIY-ZJSXRUAMSA-N 2 0 420.601 4.311 20 0 HIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)cc1 ZINC000537959078 938434430 /nfs/dbraw/zinc/43/44/30/938434430.db2.gz UITOVYJQIUHLOG-KSNOWIBYSA-N 2 0 400.607 4.320 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc2c(c1)CCCC2 ZINC000537968332 938439994 /nfs/dbraw/zinc/43/99/94/938439994.db2.gz BIOJKBIURYLLAW-FQEVSTJZSA-N 2 0 405.586 4.242 20 0 HIADRP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000537969263 938440013 /nfs/dbraw/zinc/44/00/13/938440013.db2.gz RMBOJTPPXKQVRI-KOSHJBKYSA-N 2 0 409.549 4.065 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CCSc3ccc(Br)cc32)C[C@@H](C)O1 ZINC000537973553 938443119 /nfs/dbraw/zinc/44/31/19/938443119.db2.gz PGXRRXMCGGLINY-IIDMSEBBSA-N 2 0 413.425 4.465 20 0 HIADRP CCc1ccc([C@@H](C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)N(C)C)cc1 ZINC000538268841 938579989 /nfs/dbraw/zinc/57/99/89/938579989.db2.gz OBBWBPAHTTYZCN-DNQXCXABSA-N 2 0 407.602 4.430 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@@H](c1ccc3c(c1)OCCO3)C1CC1)c1ccccc1O2 ZINC000538294525 938585429 /nfs/dbraw/zinc/58/54/29/938585429.db2.gz RZZZSNGYVMHRGR-PXDATVDWSA-N 2 0 420.553 4.487 20 0 HIADRP Cc1cc(Br)cc2cc([C@@H]([NH2+][C@@H](C)CN3CC[NH+](C)CC3)C(C)C)oc21 ZINC000538447014 938623676 /nfs/dbraw/zinc/62/36/76/938623676.db2.gz SUIMLDWPDOJNCF-JXFKEZNVSA-N 2 0 422.411 4.426 20 0 HIADRP C[C@@H](Nc1ccc(N2CCC([NH+](C)C)CC2)cn1)c1ncc(Br)s1 ZINC000538591064 938657098 /nfs/dbraw/zinc/65/70/98/938657098.db2.gz XFCBNFMWGMTGRS-GFCCVEGCSA-N 2 0 410.385 4.004 20 0 HIADRP c1cc(C[N@@H+]2CCC[C@H]2C2CCOCC2)ccc1C[NH+]1CCC[C@H]1C1CCOCC1 ZINC000538627229 938666470 /nfs/dbraw/zinc/66/64/70/938666470.db2.gz COCAQABJIAHWGP-UIOOFZCWSA-N 2 0 412.618 4.469 20 0 HIADRP C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1ccccc1N(C)C ZINC000538747067 938700305 /nfs/dbraw/zinc/70/03/05/938700305.db2.gz ZSTWBEKMTHOKJR-KRWDZBQOSA-N 2 0 420.523 4.374 20 0 HIADRP FC(F)(F)c1ccn(-c2ccc(C[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2)n1 ZINC000538795424 938713971 /nfs/dbraw/zinc/71/39/71/938713971.db2.gz AGRXDSFIVWPTDL-YLJYHZDGSA-N 2 0 404.480 4.340 20 0 HIADRP FC(F)(F)c1ccn(-c2ccc(C[N@@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2)n1 ZINC000538795421 938714096 /nfs/dbraw/zinc/71/40/96/938714096.db2.gz AGRXDSFIVWPTDL-FXAWDEMLSA-N 2 0 404.480 4.340 20 0 HIADRP COCCc1nc(C)c([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)s1 ZINC000538867694 938728218 /nfs/dbraw/zinc/72/82/18/938728218.db2.gz OUALCVMLQPNPMV-QGZVFWFLSA-N 2 0 417.619 4.212 20 0 HIADRP C[C@@H](C(=O)N1CCSc2ccccc21)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538945622 938744262 /nfs/dbraw/zinc/74/42/62/938744262.db2.gz RFFPOOWJQMSHTB-IBGZPJMESA-N 2 0 424.614 4.147 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H](O)Cc1ccc(C(F)(F)F)cc1 ZINC000538947065 938744779 /nfs/dbraw/zinc/74/47/79/938744779.db2.gz RLHDBOSISZVNBW-JOCHJYFZSA-N 2 0 421.507 4.242 20 0 HIADRP O=C(Nc1ccc(F)cc1)[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000538951476 938746819 /nfs/dbraw/zinc/74/68/19/938746819.db2.gz UNCYYFIXWSIBKN-DEOSSOPVSA-N 2 0 418.516 4.407 20 0 HIADRP C[C@H]([NH2+][C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000539044064 938780373 /nfs/dbraw/zinc/78/03/73/938780373.db2.gz IKYILMVSHVQYDF-GMWOSMDTSA-N 2 0 403.517 4.001 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)CC(=O)Nc2ccc(Br)cc2)C1 ZINC000539052681 938783918 /nfs/dbraw/zinc/78/39/18/938783918.db2.gz KJIXMIRHPCYUFE-SJORKVTESA-N 2 0 410.400 4.124 20 0 HIADRP C[C@@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1cccc2ccccc21 ZINC000539244373 938824936 /nfs/dbraw/zinc/82/49/36/938824936.db2.gz RWJNQVXYVUAWFQ-HXUWFJFHSA-N 2 0 401.554 4.403 20 0 HIADRP C[C@@H]([NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1cccc(N2CCCC2=O)c1 ZINC000539361944 938848857 /nfs/dbraw/zinc/84/88/57/938848857.db2.gz MELFTMLOQISNAW-AUSIDOKSSA-N 2 0 419.569 4.452 20 0 HIADRP C[C@H](CS(=O)(=O)c1ccccc1)[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000539377229 938851269 /nfs/dbraw/zinc/85/12/69/938851269.db2.gz ONHWGCDZQOXWSX-HXUWFJFHSA-N 2 0 400.588 4.015 20 0 HIADRP CC[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc(F)cc(Br)c1 ZINC000539508452 938870940 /nfs/dbraw/zinc/87/09/40/938870940.db2.gz AGNWGZCWOOJRBS-SFHVURJKSA-N 2 0 410.331 4.165 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(Cl)c1)Nc1ccc(N2CCC([NH+](C)C)CC2)cn1 ZINC000539689624 938902214 /nfs/dbraw/zinc/90/22/14/938902214.db2.gz OQVGIEDPQNTCQG-INIZCTEOSA-N 2 0 415.969 4.095 20 0 HIADRP Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540043723 939047423 /nfs/dbraw/zinc/04/74/23/939047423.db2.gz HBKBZSAEKJVZRL-RTWAWAEBSA-N 2 0 408.590 4.194 20 0 HIADRP COc1cc(-c2noc(C[N@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)n2)ccc1C ZINC000540045514 939048758 /nfs/dbraw/zinc/04/87/58/939048758.db2.gz PVYAOXGXYSUQHU-UHFFFAOYSA-N 2 0 421.545 4.187 20 0 HIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(N2CCOCC2)c1 ZINC000540145708 939090523 /nfs/dbraw/zinc/09/05/23/939090523.db2.gz LKOSUFXSAZKUOH-GPXNEJASSA-N 2 0 407.602 4.475 20 0 HIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cc1 ZINC000540161098 939096729 /nfs/dbraw/zinc/09/67/29/939096729.db2.gz NUHVPBCWTLKSFG-ISJGIBHGSA-N 2 0 412.549 4.086 20 0 HIADRP CC[N@H+](CCC1CC[NH+]([C@@H](C)C(=O)N[C@H]2CCOc3ccccc32)CC1)CC(C)C ZINC000540197865 939122716 /nfs/dbraw/zinc/12/27/16/939122716.db2.gz SSWOMATZIGZZOH-REWPJTCUSA-N 2 0 415.622 4.095 20 0 HIADRP Cc1cc([C@H]([NH2+][C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C2CC2)ccc1F ZINC000540523149 939286727 /nfs/dbraw/zinc/28/67/27/939286727.db2.gz LEFAVKPOYCYDBU-UQBPGWFLSA-N 2 0 423.576 4.344 20 0 HIADRP C[N@H+](CC(=O)NC1CC[NH+](C2CC2)CC1)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000540676705 939336618 /nfs/dbraw/zinc/33/66/18/939336618.db2.gz YIEIDDWMDKSFDB-NHCUHLMSSA-N 2 0 423.523 4.016 20 0 HIADRP CC(C)N1CC[C@H](NC(=O)NCCC2CC[NH+](C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000540718672 939348149 /nfs/dbraw/zinc/34/81/49/939348149.db2.gz URUCWTRGOLYVAY-SFTDATJTSA-N 2 0 424.992 4.034 20 0 HIADRP C[C@@H](Nc1cccc(C[NH+]2CCSCC2)c1)[C@@H](c1ccccc1)N1CCOCC1 ZINC000540787124 939371865 /nfs/dbraw/zinc/37/18/65/939371865.db2.gz CCZIQYUOYYDSPI-YKSBVNFPSA-N 2 0 411.615 4.109 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc(F)c(F)c1 ZINC000540987048 939425256 /nfs/dbraw/zinc/42/52/56/939425256.db2.gz QTMNOZGLUMJTAZ-HSZRJFAPSA-N 2 0 415.528 4.277 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(Br)c(F)c1 ZINC000540990878 939426655 /nfs/dbraw/zinc/42/66/55/939426655.db2.gz XJFMRZBBAMLONX-KXBFYZLASA-N 2 0 421.354 4.396 20 0 HIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)ccc1OC(F)F ZINC000540990653 939426808 /nfs/dbraw/zinc/42/68/08/939426808.db2.gz SMGLPFZMBOVLMN-JXFKEZNVSA-N 2 0 420.500 4.104 20 0 HIADRP Brc1cnc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000541065023 939447044 /nfs/dbraw/zinc/44/70/44/939447044.db2.gz AXKLPILFBIYPOX-UHFFFAOYSA-N 2 0 424.408 4.067 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CNc1ccc(NC(=O)CC[NH+]2CCCCC2)cc1 ZINC000541382753 939502200 /nfs/dbraw/zinc/50/22/00/939502200.db2.gz BQEZYKSBTPGWNC-UHFFFAOYSA-N 2 0 418.545 4.002 20 0 HIADRP C[C@H](CCNC(=O)NC[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1)[NH+]1CCCCC1 ZINC000541480279 939532442 /nfs/dbraw/zinc/53/24/42/939532442.db2.gz MSTABIQVJRMJBO-BLIXFSHQSA-N 2 0 424.992 4.036 20 0 HIADRP CCC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000541537086 939546696 /nfs/dbraw/zinc/54/66/96/939546696.db2.gz HTWPIFCEODPTFN-UHFFFAOYSA-N 2 0 417.557 4.093 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000541550136 939552431 /nfs/dbraw/zinc/55/24/31/939552431.db2.gz XACNAISOJCYXAQ-FQEVSTJZSA-N 2 0 410.558 4.465 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@@H](c2ccc(F)cc2)c2cccnc2)[C@@H](c2ccccc2)C1 ZINC000542480290 939830547 /nfs/dbraw/zinc/83/05/47/939830547.db2.gz BBICUVBTAAWCEC-FTJBHMTQSA-N 2 0 418.560 4.279 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000542480883 939830743 /nfs/dbraw/zinc/83/07/43/939830743.db2.gz RVXFNSACGZTAFZ-RUZDIDTESA-N 2 0 406.549 4.079 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000542480887 939830850 /nfs/dbraw/zinc/83/08/50/939830850.db2.gz RVXFNSACGZTAFZ-VWLOTQADSA-N 2 0 406.549 4.079 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000543072984 939925320 /nfs/dbraw/zinc/92/53/20/939925320.db2.gz UMGLQJITMLUOOO-INIZCTEOSA-N 2 0 422.411 4.410 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)Cc2ccn(C(C)C)n2)CC1 ZINC000543075845 939927498 /nfs/dbraw/zinc/92/74/98/939927498.db2.gz RDWYBDXNGPSBKA-OALUTQOASA-N 2 0 401.574 4.027 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000543405321 940054031 /nfs/dbraw/zinc/05/40/31/940054031.db2.gz XBYQTBGVHZPENE-KBMIEXCESA-N 2 0 406.549 4.079 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000543410511 940056676 /nfs/dbraw/zinc/05/66/76/940056676.db2.gz YTVOBONIHDIJDE-SANMLTNESA-N 2 0 420.576 4.471 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCc2c1cccc2Br ZINC000543777215 940183648 /nfs/dbraw/zinc/18/36/48/940183648.db2.gz PWAMWXGUQJWVOA-GCJKJVERSA-N 2 0 415.375 4.183 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H](C)Cc1cc(Br)ccc1F ZINC000544180536 940346076 /nfs/dbraw/zinc/34/60/76/940346076.db2.gz DGAGBNNPIQUSBZ-ZDUSSCGKSA-N 2 0 403.299 4.198 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000544359817 940401048 /nfs/dbraw/zinc/40/10/48/940401048.db2.gz DQDOESBTAKCQOG-RUZDIDTESA-N 2 0 406.549 4.081 20 0 HIADRP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3ccc(OCC(F)(F)F)c(F)c3)CC2)C[C@H](C)O1 ZINC000544611879 940490124 /nfs/dbraw/zinc/49/01/24/940490124.db2.gz MAMIIKCUVPICHE-IYBDPMFKSA-N 2 0 418.475 4.088 20 0 HIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+][C@H]2CCO[C@@H](c3ccc(F)cc3)C2)CC1 ZINC000544623474 940492847 /nfs/dbraw/zinc/49/28/47/940492847.db2.gz CPRAANKIKLIPGZ-WMZHIEFXSA-N 2 0 417.956 4.241 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)N1CCC2(CCC[N@@H+]2C)CC1)c1cccc(C(F)(F)F)c1 ZINC000544943892 940526872 /nfs/dbraw/zinc/52/68/72/940526872.db2.gz YIJCFMBOAUNZSY-IBGZPJMESA-N 2 0 411.512 4.175 20 0 HIADRP c1cncc(C[N@H+]2CCC[C@@H](c3nc(-c4ccc(C[NH+]5CCCC5)cc4)no3)C2)c1 ZINC000546248761 940748021 /nfs/dbraw/zinc/74/80/21/940748021.db2.gz RKTXEBWJMNLKLI-JOCHJYFZSA-N 2 0 403.530 4.107 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000548186834 941091775 /nfs/dbraw/zinc/09/17/75/941091775.db2.gz OCKKDXIBXWBWTE-QFIPXVFZSA-N 2 0 413.993 4.361 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000549248926 941174104 /nfs/dbraw/zinc/17/41/04/941174104.db2.gz CDQKSYUQABKHLU-UHFFFAOYSA-N 2 0 403.574 4.406 20 0 HIADRP C[C@H]1C[C@H](N(C)C(=O)c2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000549381713 941184492 /nfs/dbraw/zinc/18/44/92/941184492.db2.gz UDWVSOSWFCOMFC-SQJMNOBHSA-N 2 0 405.586 4.408 20 0 HIADRP CC(C)[C@@]1(CO)CCC[NH+](Cc2ccc(C[N@H+]3CCC[C@](CO)(C(C)C)C3)cc2)C1 ZINC000550433606 941327047 /nfs/dbraw/zinc/32/70/47/941327047.db2.gz MQWDTQGKIZUZLF-UIOOFZCWSA-N 2 0 416.650 4.148 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CCC([NH+](C)Cc3ccccc3)CC2)[C@H](C)C1 ZINC000550888030 941379872 /nfs/dbraw/zinc/37/98/72/941379872.db2.gz XITLLLITXRKBOK-MNBFTAMVSA-N 3 0 401.639 4.156 20 0 HIADRP CC(=O)N1CCC[C@H](C[NH2+][C@@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)C1 ZINC000550901426 941380908 /nfs/dbraw/zinc/38/09/08/941380908.db2.gz HRSDRYLPGYZIHT-QPPBQGQZSA-N 2 0 403.586 4.227 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)N1CCN(c2cc[nH+]c3ccccc32)CC1 ZINC000552006847 941567914 /nfs/dbraw/zinc/56/79/14/941567914.db2.gz DDVWFGWSRLBDFT-UHFFFAOYSA-N 2 0 414.509 4.005 20 0 HIADRP FC(F)(F)Cn1cc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000552034835 941571250 /nfs/dbraw/zinc/57/12/50/941571250.db2.gz GQWGNWUDERGHAL-PWRODBHTSA-N 2 0 406.496 4.226 20 0 HIADRP c1ncn(Cc2ccccc2C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000552033822 941571301 /nfs/dbraw/zinc/57/13/01/941571301.db2.gz UHLPNMCNVJLXIZ-KKUQBAQOSA-N 2 0 415.585 4.107 20 0 HIADRP C[N@@H+](CCC(=O)Nc1ccc(Cl)cc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000552439866 941672027 /nfs/dbraw/zinc/67/20/27/941672027.db2.gz BDCSYKYXMRIUMH-UHFFFAOYSA-N 2 0 400.954 4.302 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1nc(-c2cccc(Cl)c2)no1 ZINC000552571910 941709867 /nfs/dbraw/zinc/70/98/67/941709867.db2.gz VOGPWOHTNBAAIQ-UWJYYQICSA-N 2 0 410.949 4.433 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H](C)c2cccc(OC(C)C)c2)CC1 ZINC000552875310 941796007 /nfs/dbraw/zinc/79/60/07/941796007.db2.gz MSMYCNZNDGANPD-NRFANRHFSA-N 2 0 423.601 4.214 20 0 HIADRP Cc1cc(C[NH+]2CCSCC2)ccc1NC(=O)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000553403802 941879861 /nfs/dbraw/zinc/87/98/61/941879861.db2.gz BQENJZOOLZFSLM-QFIPXVFZSA-N 2 0 409.599 4.004 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)C[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000553497727 941896139 /nfs/dbraw/zinc/89/61/39/941896139.db2.gz HGLFZSONWPWYKO-ISKFKSNPSA-N 2 0 416.569 4.302 20 0 HIADRP COc1ccccc1[C@H](CNC(=O)c1ccc(C[NH+]2CCCCC2)cc1)[NH+]1CCCC1 ZINC000553621394 941922569 /nfs/dbraw/zinc/92/25/69/941922569.db2.gz FJPMXKNAIKDJJU-DEOSSOPVSA-N 2 0 421.585 4.248 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000553898523 941994229 /nfs/dbraw/zinc/99/42/29/941994229.db2.gz QNSVVTQYORIJDA-RUZDIDTESA-N 2 0 420.601 4.194 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(NC2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)c1 ZINC000554404458 942128403 /nfs/dbraw/zinc/12/84/03/942128403.db2.gz YTZHBVBZDYWNPV-WMZHIEFXSA-N 2 0 400.611 4.422 20 0 HIADRP CN1CC[NH+](CCCC[NH2+]Cc2ccc(-c3ccccc3Br)cc2)CC1 ZINC000554686284 942198772 /nfs/dbraw/zinc/19/87/72/942198772.db2.gz SIJDPVMIZFSZEG-UHFFFAOYSA-N 2 0 416.407 4.233 20 0 HIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(OC(F)F)c(Br)c3)C2)CC1 ZINC000554881003 942306251 /nfs/dbraw/zinc/30/62/51/942306251.db2.gz UCHZWZHLTHLQCS-HNNXBMFYSA-N 2 0 403.311 4.214 20 0 HIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](CC(c3ccc(F)cc3)c3ccc(F)cc3)C2)CC1 ZINC000555335673 942481819 /nfs/dbraw/zinc/48/18/19/942481819.db2.gz UJFCYOAFTIPZAX-XMMPIXPASA-N 2 0 413.556 4.197 20 0 HIADRP c1c(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)[nH]nc1-c1ccccc1 ZINC000555611774 942670399 /nfs/dbraw/zinc/67/03/99/942670399.db2.gz BZDJTSWXPKKADF-HSZRJFAPSA-N 2 0 416.569 4.095 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)CCN2CCOCC2)c1)c1cccc(C2CC2)c1 ZINC000556058589 942797823 /nfs/dbraw/zinc/79/78/23/942797823.db2.gz MTWMFQLPDYCPPW-LJQANCHMSA-N 2 0 407.558 4.076 20 0 HIADRP CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(C(=O)OC)cc1 ZINC000556076141 942801677 /nfs/dbraw/zinc/80/16/77/942801677.db2.gz KFYQMXLHYUOQJI-VGOFRKELSA-N 2 0 413.537 4.166 20 0 HIADRP Cc1ccc2c(C[NH+]3CCC4(C[C@@H]4N(C)Cc4nccs4)CC3)ccc(O)c2n1 ZINC000558897320 943732442 /nfs/dbraw/zinc/73/24/42/943732442.db2.gz QOAULQXCYSUUBS-FQEVSTJZSA-N 2 0 408.571 4.192 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H]2CCCCc3cc(Br)ccc32)ccn1 ZINC000558973003 943777364 /nfs/dbraw/zinc/77/73/64/943777364.db2.gz WDWPQTMOBFKEQV-FQEVSTJZSA-N 2 0 418.379 4.342 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)c2ccc3c[nH+]cn3c2)cc1)C[C@@H]1CCCCO1 ZINC000559618559 944017782 /nfs/dbraw/zinc/01/77/82/944017782.db2.gz GYHCMJPTNNUXHL-QHCPKHFHSA-N 2 0 406.530 4.366 20 0 HIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1OC ZINC000560266024 944212082 /nfs/dbraw/zinc/21/20/82/944212082.db2.gz UOLZIXMJZNEPDP-RBUKOAKNSA-N 2 0 412.574 4.459 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C3CCC4(CC3)c3ccccc3NC4=O)cc2)CC1 ZINC000560266331 944212372 /nfs/dbraw/zinc/21/23/72/944212372.db2.gz WDQQZURUMUQXBT-UHFFFAOYSA-N 2 0 419.569 4.082 20 0 HIADRP C[C@H]1CN(c2ccc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)cn2)C[C@H](C)O1 ZINC000560531957 944244536 /nfs/dbraw/zinc/24/45/36/944244536.db2.gz OQDFUIATYWWLSB-SKGAXEKPSA-N 2 0 422.617 4.228 20 0 HIADRP CCOc1ccc([C@H](CC)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1OCC ZINC000560921728 944370136 /nfs/dbraw/zinc/37/01/36/944370136.db2.gz ZGSWFPDRSPPLAX-BHDDXSALSA-N 2 0 404.595 4.293 20 0 HIADRP C[NH+](C)[C@H](CNc1cncc(NC[C@H](c2ccsc2)[NH+](C)C)n1)c1ccsc1 ZINC000561143459 944480439 /nfs/dbraw/zinc/48/04/39/944480439.db2.gz TYBKGFNWHQCTST-QZTJIDSGSA-N 2 0 416.620 4.029 20 0 HIADRP Brc1cccc(N2CC[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)c1 ZINC000561541802 944664593 /nfs/dbraw/zinc/66/45/93/944664593.db2.gz OFUKZRDLALMQGQ-LJQANCHMSA-N 2 0 406.412 4.415 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(OC)c(OC)c2C)CC1 ZINC000564247720 945465441 /nfs/dbraw/zinc/46/54/41/945465441.db2.gz HWVYLTUWGJYTGO-SFHVURJKSA-N 2 0 415.553 4.144 20 0 HIADRP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000564387353 945547822 /nfs/dbraw/zinc/54/78/22/945547822.db2.gz JMQAPCBWAOICMF-HBMCJLEFSA-N 2 0 414.638 4.036 20 0 HIADRP CSC1(C[NH2+]Cc2cn(-c3ccc(C)cc3)nc2C(C)(C)C)CC[NH+](C)CC1 ZINC000564419272 945568787 /nfs/dbraw/zinc/56/87/87/945568787.db2.gz LCYLDWADOQSYCU-UHFFFAOYSA-N 2 0 400.636 4.395 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)C1 ZINC000564506204 945634285 /nfs/dbraw/zinc/63/42/85/945634285.db2.gz QRSVTDYQUCOSIJ-LOSJGSFVSA-N 2 0 421.972 4.375 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]CCC(=O)Nc2cc(F)cc(F)c2)cc1 ZINC000566047700 945996484 /nfs/dbraw/zinc/99/64/84/945996484.db2.gz ADLXEEIJZMSFEL-QGZVFWFLSA-N 2 0 401.501 4.458 20 0 HIADRP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](CCCc4nc(-c5ccccc5)no4)C[C@H]3C2)cc1 ZINC000566884555 946153968 /nfs/dbraw/zinc/15/39/68/946153968.db2.gz PBODDNKIIBEISL-GOTSBHOMSA-N 2 0 402.542 4.123 20 0 HIADRP C[C@@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000566996639 946208320 /nfs/dbraw/zinc/20/83/20/946208320.db2.gz JNPCZUGJKNAMIY-CABCVRRESA-N 2 0 412.361 4.274 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H]1CCc2c1cc(Cl)cc2Br ZINC000566996873 946208885 /nfs/dbraw/zinc/20/88/85/946208885.db2.gz NURMZJHKXQHXOC-GOSISDBHSA-N 2 0 424.770 4.215 20 0 HIADRP COCC(=O)Nc1cccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000567495541 946350405 /nfs/dbraw/zinc/35/04/05/946350405.db2.gz LHIQKXZWBBLHMC-ICDZXHCJSA-N 2 0 421.585 4.052 20 0 HIADRP CC(C)Oc1ccc([C@H](CNC(=O)c2oc3ccccc3c2C[NH+](C)C)[NH+](C)C)cc1 ZINC000567641736 946389366 /nfs/dbraw/zinc/38/93/66/946389366.db2.gz DPLXEHXPZJRBPW-QFIPXVFZSA-N 2 0 423.557 4.314 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CC2 ZINC000568420433 946536579 /nfs/dbraw/zinc/53/65/79/946536579.db2.gz ARDXYZQDTQNQKQ-RDGATRHJSA-N 2 0 406.570 4.201 20 0 HIADRP COc1cc(OC)cc(Oc2ccc(C[NH2+]CC3(SC)CC[NH+](C)CC3)cc2)c1 ZINC000569293532 946853252 /nfs/dbraw/zinc/85/32/52/946853252.db2.gz GQNXZBIESXLFCG-UHFFFAOYSA-N 2 0 416.587 4.413 20 0 HIADRP C(CC[NH+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1)CC[N@@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000569746377 946972685 /nfs/dbraw/zinc/97/26/85/946972685.db2.gz LGUHIPURUAEXLH-MESAYYPLSA-N 2 0 402.623 4.224 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)Cc2ccc(F)cc2Br)[C@@H](C)C1 ZINC000570480025 947261381 /nfs/dbraw/zinc/26/13/81/947261381.db2.gz NHBBMNXOTGMGPC-FTRWYGJKSA-N 2 0 415.391 4.246 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(OC(F)F)c1 ZINC000570620006 947317457 /nfs/dbraw/zinc/31/74/57/947317457.db2.gz VEDNEFSIFIXYDK-UHFFFAOYSA-N 2 0 406.473 4.059 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+]C3CCN(c4ccccc4)CC3)C3(C2)CCOCC3)cc1 ZINC000571064953 947459666 /nfs/dbraw/zinc/45/96/66/947459666.db2.gz IWERIIFBZLWTFL-DEOSSOPVSA-N 2 0 419.613 4.174 20 0 HIADRP CCS(=O)(=O)c1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000571174765 947534500 /nfs/dbraw/zinc/53/45/00/947534500.db2.gz VPPGXVLWLAGYEE-UHFFFAOYSA-N 2 0 400.588 4.013 20 0 HIADRP CC[NH+]1CCC(C[NH2+]Cc2c(C)nn(-c3ccc(Br)cc3)c2C)CC1 ZINC000572548991 947941631 /nfs/dbraw/zinc/94/16/31/947941631.db2.gz AKBZKZXDUNYTHS-UHFFFAOYSA-N 2 0 405.384 4.073 20 0 HIADRP CN1CC[NH+](CC2CC[NH+](Cc3ccc(-c4nc5ccccc5s4)o3)CC2)CC1 ZINC000572802621 948014684 /nfs/dbraw/zinc/01/46/84/948014684.db2.gz JPVHENXXXQYJND-UHFFFAOYSA-N 2 0 410.587 4.016 20 0 HIADRP COc1cc(C)c(C[C@@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1OC ZINC000574350179 948420679 /nfs/dbraw/zinc/42/06/79/948420679.db2.gz TTYFBWGLVMIZKS-LJQANCHMSA-N 2 0 412.574 4.206 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+]CC1=Cc2cc(Cl)cc(Cl)c2OC1 ZINC000575157208 948607557 /nfs/dbraw/zinc/60/75/57/948607557.db2.gz RIISGRZSUWQNQR-UHFFFAOYSA-N 2 0 422.356 4.285 20 0 HIADRP c1ccc(C[N@@H+]2CCc3nc(N4CC[C@@]5(C[NH2+]C[C@@H]5c5ccccc5)C4)ccc3C2)cc1 ZINC001164618370 719044880 /nfs/dbraw/zinc/04/48/80/719044880.db2.gz AVVPIFMNMMODOK-LEAFIULHSA-N 2 0 424.592 4.223 20 0 HIADRP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000025507640 846988729 /nfs/dbraw/zinc/98/87/29/846988729.db2.gz OVCNJAJDWAHAER-QFIPXVFZSA-N 2 0 419.613 4.110 20 0 HIADRP CC[NH+]1CCN(c2ccc(NC(=O)C[N@H+](Cc3ccccc3)[C@H](C)C3CC3)cc2)CC1 ZINC000029842808 847630723 /nfs/dbraw/zinc/63/07/23/847630723.db2.gz XOMATJXFTURXBI-OAQYLSRUSA-N 2 0 420.601 4.068 20 0 HIADRP CCOc1c(Br)cc(Br)cc1C[NH2+]CC1CC[NH+](C)CC1 ZINC000044516513 848564402 /nfs/dbraw/zinc/56/44/02/848564402.db2.gz YJDLSJJASMINAR-UHFFFAOYSA-N 2 0 420.189 4.042 20 0 HIADRP C[NH+](C)Cc1cccc(CNC(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)c1 ZINC000060566638 851149373 /nfs/dbraw/zinc/14/93/73/851149373.db2.gz QMKJDMIPGGNMRN-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP Clc1cccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCCC[NH+]2CCOCC2)c1 ZINC000060979289 851265709 /nfs/dbraw/zinc/26/57/09/851265709.db2.gz UGYOEFHRVBLBIL-UHFFFAOYSA-N 2 0 424.976 4.395 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NCc1ccccc1C[NH+]1CCCC1)c1ccccc1 ZINC000061227795 851321838 /nfs/dbraw/zinc/32/18/38/851321838.db2.gz YPKLHTLBRHIDTO-DEOSSOPVSA-N 2 0 408.590 4.165 20 0 HIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)o1 ZINC000062253013 851517615 /nfs/dbraw/zinc/51/76/15/851517615.db2.gz SZLRBAUUYFGHLE-SFTDATJTSA-N 2 0 422.573 4.420 20 0 HIADRP O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)NC1CC[NH+](CC2CCCCC2)CC1 ZINC000062529538 851571787 /nfs/dbraw/zinc/57/17/87/851571787.db2.gz HWKJERLFIMHTGH-QFIPXVFZSA-N 2 0 416.610 4.151 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000063148633 851622140 /nfs/dbraw/zinc/62/21/40/851622140.db2.gz MMIAJGOTQUAEGX-UHFFFAOYSA-N 2 0 424.658 4.156 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc(Br)cc3)CC2)cc1 ZINC000063319618 851658639 /nfs/dbraw/zinc/65/86/39/851658639.db2.gz QXCDIFCVLOIFEH-UHFFFAOYSA-N 2 0 403.364 4.460 20 0 HIADRP Cc1cc[n+](C(C(=O)c2ccc(CC(C)C)cc2)C(=S)NC2CC[NH+](C)CC2)cc1 ZINC000063441774 851691087 /nfs/dbraw/zinc/69/10/87/851691087.db2.gz BWUJDWQRLRHISH-UHFFFAOYSA-O 2 0 424.634 4.104 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NCc1cccc(C[NH+]2CCCCCC2)c1)c1ccsc1 ZINC000064237847 851855530 /nfs/dbraw/zinc/85/55/30/851855530.db2.gz IFRKFGVDHYOSJO-QFIPXVFZSA-N 2 0 414.619 4.226 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000064251172 851856830 /nfs/dbraw/zinc/85/68/30/851856830.db2.gz NJRBZYFOTWZDJU-BGYRXZFFSA-N 2 0 420.667 4.017 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H](c1ccc(C)cc1)[NH+](C)C)c1ccsc1 ZINC000065469520 852145167 /nfs/dbraw/zinc/14/51/67/852145167.db2.gz LENXOCBKIQEKQZ-LEWJYISDSA-N 2 0 402.608 4.042 20 0 HIADRP O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000065518606 852165334 /nfs/dbraw/zinc/16/53/34/852165334.db2.gz WZAMRSGHVNYBQH-XZOQPEGZSA-N 2 0 424.589 4.018 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+]Cc2sc(Sc3ccccc3)nc2Cl)CC1 ZINC000065890869 852306069 /nfs/dbraw/zinc/30/60/69/852306069.db2.gz NOOFZXIEMPQWBX-UHFFFAOYSA-N 2 0 411.040 4.065 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NC[C@@H](c2ccccc2OC)[NH+]2CCCC2)cc1 ZINC000106106382 852754423 /nfs/dbraw/zinc/75/44/23/852754423.db2.gz OXGQJFDGIYQTDO-QHCPKHFHSA-N 2 0 409.574 4.104 20 0 HIADRP Cc1cc(C[NH+]2CCSCC2)ccc1NC(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000109975502 853039716 /nfs/dbraw/zinc/03/97/16/853039716.db2.gz TXBZKMVHDFYOGL-QHCPKHFHSA-N 2 0 423.626 4.395 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccccc2N2CC[NH+](CC)CC2)cc1)C(C)C ZINC000110123143 853062528 /nfs/dbraw/zinc/06/25/28/853062528.db2.gz YGOCATUNGYCNSV-UHFFFAOYSA-N 2 0 408.590 4.311 20 0 HIADRP C[C@H]1C[NH+](CC2CC[NH+](Cc3cccc(C(=O)Nc4ccccc4)c3)CC2)C[C@H](C)O1 ZINC000110736662 853146228 /nfs/dbraw/zinc/14/62/28/853146228.db2.gz IECKHMGJPFUSBS-SFTDATJTSA-N 2 0 421.585 4.260 20 0 HIADRP C[C@@H](C(=O)N(C)Cc1cccc(F)c1)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000110797676 853153969 /nfs/dbraw/zinc/15/39/69/853153969.db2.gz KVIHGZWXDKLBQO-FQEVSTJZSA-N 2 0 411.565 4.017 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2-n2ccnc2)ccc1OCc1ccncc1 ZINC000140462935 853445119 /nfs/dbraw/zinc/44/51/19/853445119.db2.gz ODTUBNIDLKKOSU-UHFFFAOYSA-N 2 0 400.482 4.145 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(NC(=O)CC[NH+](C)C)cc2)cc1)C(C)C ZINC000216575304 853856083 /nfs/dbraw/zinc/85/60/83/853856083.db2.gz LEWPRFHDSSJMTD-UHFFFAOYSA-N 2 0 410.562 4.059 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[NH2+]C[C@@H]4CCC[N@@H+](C(C)C)C4)cc3)nc12 ZINC000236621728 853903963 /nfs/dbraw/zinc/90/39/63/853903963.db2.gz JUQZNQMWZUQMNH-QFIPXVFZSA-N 2 0 406.574 4.432 20 0 HIADRP CC(C)(C)n1cc(C[NH2+]CCCC[N@@H+]2CCC[C@H]2CO)c(-c2ccccc2Cl)n1 ZINC000236781798 853922251 /nfs/dbraw/zinc/92/22/51/853922251.db2.gz HQLVNKZNHZFONW-IBGZPJMESA-N 2 0 419.013 4.285 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc(C(=O)N[C@@H](C)CC)c2)CC1 ZINC000236802955 853924852 /nfs/dbraw/zinc/92/48/52/853924852.db2.gz QEZXFRGEQMUZCR-NRFANRHFSA-N 2 0 422.617 4.037 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]C[C@@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000236813791 853925374 /nfs/dbraw/zinc/92/53/74/853925374.db2.gz KYCYWTLEHUTGJH-AHWVRZQESA-N 2 0 407.602 4.476 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cn(-c3ccccc3)nc2C)CC1 ZINC000236853191 853929049 /nfs/dbraw/zinc/92/90/49/853929049.db2.gz QIHGJAGIIIEOOL-FQEVSTJZSA-N 2 0 421.564 4.313 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000236945415 853941312 /nfs/dbraw/zinc/94/13/12/853941312.db2.gz PUTYDOLXHOYSEI-UHFFFAOYSA-N 2 0 401.982 4.036 20 0 HIADRP CCOc1ccc(C[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000236995966 853948528 /nfs/dbraw/zinc/94/85/28/853948528.db2.gz FXDMHUAQCUZEST-UHFFFAOYSA-N 2 0 407.480 4.146 20 0 HIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C1CCN(C(=O)NC2CCCCC2)CC1 ZINC000237129356 853968466 /nfs/dbraw/zinc/96/84/66/853968466.db2.gz CZRBPGVFOMAITP-UHFFFAOYSA-N 2 0 414.638 4.241 20 0 HIADRP COc1c(Br)cccc1C[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000237294105 854000547 /nfs/dbraw/zinc/00/05/47/854000547.db2.gz RHZMIEGXUWJQIH-UHFFFAOYSA-N 2 0 407.352 4.078 20 0 HIADRP COc1cc(C[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(-c2ccccc2)cc1OC ZINC000237387217 854019743 /nfs/dbraw/zinc/01/97/43/854019743.db2.gz YHAGYKNXPDEUMR-BGYRXZFFSA-N 2 0 412.574 4.350 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cc(Br)ccc2F)C[C@@H](C)O1 ZINC000237411062 854026751 /nfs/dbraw/zinc/02/67/51/854026751.db2.gz DJGAHCLLEYGUJV-HZPDHXFCSA-N 2 0 421.354 4.487 20 0 HIADRP C[C@H](C[NH2+]Cc1cccc(Oc2cccc(C(F)(F)F)c2)c1)N1CC[NH+](C)CC1 ZINC000237586576 854059757 /nfs/dbraw/zinc/05/97/57/854059757.db2.gz CTTZPWRBJOPKDE-QGZVFWFLSA-N 2 0 407.480 4.223 20 0 HIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000237609032 854061559 /nfs/dbraw/zinc/06/15/59/854061559.db2.gz CKMWQFZRULJCCB-CALCHBBNSA-N 2 0 404.986 4.122 20 0 HIADRP Cc1cccc(-c2n[nH]cc2C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)c1 ZINC000237776885 854094880 /nfs/dbraw/zinc/09/48/80/854094880.db2.gz IHBZXTABOVPPBV-PMACEKPBSA-N 2 0 404.558 4.284 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000237977823 854128617 /nfs/dbraw/zinc/12/86/17/854128617.db2.gz JSLWYGJAKIWTSY-XMMPIXPASA-N 2 0 422.548 4.005 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c2cccs2)CC1 ZINC000302977700 854705769 /nfs/dbraw/zinc/70/57/69/854705769.db2.gz ULOOTUYBJVGXNJ-NHCUHLMSSA-N 2 0 414.619 4.123 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000303159103 854792191 /nfs/dbraw/zinc/79/21/91/854792191.db2.gz PAUCCEUKMUTNEB-ZCNNSNEGSA-N 2 0 420.667 4.016 20 0 HIADRP Cc1c(O)ccc2c(C[NH+]3CCC(C[N@@H+](C)Cc4ccccc4)CC3)cc(=O)oc12 ZINC000303214670 854820534 /nfs/dbraw/zinc/82/05/34/854820534.db2.gz SHRFTQRADHLLTR-UHFFFAOYSA-N 2 0 406.526 4.151 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)N3CCC[C@@H]3C[NH+]3CCCCC3)cc2)CC1 ZINC000303241615 854832215 /nfs/dbraw/zinc/83/22/15/854832215.db2.gz KAVPMDUFSAQOIY-XMMPIXPASA-N 2 0 412.622 4.078 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC000303630925 855089436 /nfs/dbraw/zinc/08/94/36/855089436.db2.gz FRVIEDQBCHIMGJ-RTWAWAEBSA-N 2 0 400.611 4.023 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NC2CC[NH+]([C@H](C)c3ccccc3)CC2)c1 ZINC000303704591 855142751 /nfs/dbraw/zinc/14/27/51/855142751.db2.gz XXIKMHAMNWBRDC-HXUWFJFHSA-N 2 0 408.590 4.163 20 0 HIADRP C[C@H]1C[C@H](N(C)C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1Cc1ccccc1 ZINC000303725055 855152381 /nfs/dbraw/zinc/15/23/81/855152381.db2.gz BUVBWRNANKAKGO-SQJMNOBHSA-N 2 0 405.586 4.408 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000303804749 855209449 /nfs/dbraw/zinc/20/94/49/855209449.db2.gz XQLJXQRVRWACML-DNRSQYFGSA-N 2 0 419.613 4.410 20 0 HIADRP COc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc(Br)c1O ZINC000388633292 855448159 /nfs/dbraw/zinc/44/81/59/855448159.db2.gz ILIXMUBFQZOFQF-MAUKXSAKSA-N 2 0 419.363 4.164 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000398045431 855475314 /nfs/dbraw/zinc/47/53/14/855475314.db2.gz VLLTXPSIHNMLNS-FCEUIQTBSA-N 2 0 401.595 4.134 20 0 HIADRP CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]([NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)C[C@H]2C1 ZINC000401122389 855479342 /nfs/dbraw/zinc/47/93/42/855479342.db2.gz KCNNSGYDLNEPNZ-MLCQCVOFSA-N 2 0 413.606 4.134 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)cc1 ZINC000410321788 855927620 /nfs/dbraw/zinc/92/76/20/855927620.db2.gz PPVXKBPNWSFMJL-UHFFFAOYSA-N 2 0 422.617 4.301 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NCc1ccc(C[NH+](C)C)cc1 ZINC000410362129 855950863 /nfs/dbraw/zinc/95/08/63/855950863.db2.gz BUOIMKTYLVHJNT-FQEVSTJZSA-N 2 0 408.590 4.122 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)CC1 ZINC000410362789 855951450 /nfs/dbraw/zinc/95/14/50/855951450.db2.gz VRAGINLQCBWXSO-QFIPXVFZSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)NCCC[NH2+]C3CCCCC3)cc2)C1 ZINC000410365756 855953762 /nfs/dbraw/zinc/95/37/62/855953762.db2.gz KLSVMQGNWHGCMP-FQEVSTJZSA-N 2 0 400.611 4.030 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000426049744 856073093 /nfs/dbraw/zinc/07/30/93/856073093.db2.gz JXVLDVJWQFRXPT-JWQCQUIFSA-N 2 0 421.972 4.375 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000426049748 856073381 /nfs/dbraw/zinc/07/33/81/856073381.db2.gz JXVLDVJWQFRXPT-RPBOFIJWSA-N 2 0 421.972 4.375 20 0 HIADRP O=C(Nc1ccc(OCC[NH+]2CCCCC2)cc1)NC1CC[NH+](C2CCCC2)CC1 ZINC000426132841 856128216 /nfs/dbraw/zinc/12/82/16/856128216.db2.gz CIXNAYRECAZLTJ-UHFFFAOYSA-N 2 0 414.594 4.080 20 0 HIADRP Cn1c2ccccc2cc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1=O ZINC000426317239 856241983 /nfs/dbraw/zinc/24/19/83/856241983.db2.gz LWXUBOLLZRMRJZ-ZKMPZPQNSA-N 2 0 415.581 4.319 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)CCc3ccc(OC)c(O)c3)CC2)cc1 ZINC000426420224 856282736 /nfs/dbraw/zinc/28/27/36/856282736.db2.gz LRKYYXIIBGVPFN-LJQANCHMSA-N 2 0 412.574 4.232 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)(N2CCCCC2)CC1 ZINC000427721480 856922368 /nfs/dbraw/zinc/92/23/68/856922368.db2.gz QDQMAADXESWZKT-FQEVSTJZSA-N 2 0 410.528 4.018 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000428131365 857083523 /nfs/dbraw/zinc/08/35/23/857083523.db2.gz PMFWRCCOIAJZEE-OFVILXPXSA-N 2 0 422.617 4.381 20 0 HIADRP CC(=O)Nc1ccc(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000428229366 857120278 /nfs/dbraw/zinc/12/02/78/857120278.db2.gz OPEJBCOQARVWNK-DMTNHVFBSA-N 2 0 405.586 4.468 20 0 HIADRP C[N@H+](C[C@@H](O)Cc1ccc(C(F)(F)F)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000437582095 862898570 /nfs/dbraw/zinc/89/85/70/862898570.db2.gz UDIONTZHHDFNAX-UNMCSNQZSA-N 2 0 406.492 4.063 20 0 HIADRP Cc1cc(CC(C)(C)[NH2+]CCCN2CC[NH+](C(C)C)CC2)ccc1Br ZINC000429236061 857567607 /nfs/dbraw/zinc/56/76/07/857567607.db2.gz KROZOZDRDXTTSB-UHFFFAOYSA-N 2 0 410.444 4.084 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)cc1)C1CC1 ZINC000430622279 858239976 /nfs/dbraw/zinc/23/99/76/858239976.db2.gz FGMUXCFPKOIOOX-RDPSFJRHSA-N 2 0 405.586 4.454 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000430669726 858260577 /nfs/dbraw/zinc/26/05/77/858260577.db2.gz ULBZCNLQSYJRER-ZODMCCGTSA-N 2 0 405.586 4.068 20 0 HIADRP Cc1ccc(NC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c(OCC[NH+](C)C)c1 ZINC000431196360 858498585 /nfs/dbraw/zinc/49/85/85/858498585.db2.gz LERCVHKVONBRFE-RBBKRZOGSA-N 2 0 424.589 4.110 20 0 HIADRP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000431339181 858571618 /nfs/dbraw/zinc/57/16/18/858571618.db2.gz XKLYWGCHPTVBME-FQEVSTJZSA-N 2 0 422.013 4.078 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000431677855 858733340 /nfs/dbraw/zinc/73/33/40/858733340.db2.gz FPIYIDGZXIACFF-QPPBQGQZSA-N 2 0 414.638 4.193 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000432411605 859151887 /nfs/dbraw/zinc/15/18/87/859151887.db2.gz ZNKURPJFMLUFSI-APDVGNCJSA-N 2 0 407.396 4.053 20 0 HIADRP COCCC[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(Br)cc1 ZINC000432439421 859165232 /nfs/dbraw/zinc/16/52/32/859165232.db2.gz GMWAGWPSGZQEKW-FXAWDEMLSA-N 2 0 413.400 4.007 20 0 HIADRP C[C@H](c1nc(-c2cccnc2)no1)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433074857 859511011 /nfs/dbraw/zinc/51/10/11/859511011.db2.gz JEKWBGLQEPKJLX-LJQANCHMSA-N 2 0 403.530 4.181 20 0 HIADRP C[C@H](C(=O)N1CCc2sccc2C1)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433131793 859533491 /nfs/dbraw/zinc/53/34/91/859533491.db2.gz VZSJATXIJOWOPM-HXUWFJFHSA-N 2 0 423.626 4.009 20 0 HIADRP C[NH+](C)[C@H](CC(=O)NC[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1)c1ccccc1 ZINC000433359483 859659564 /nfs/dbraw/zinc/65/95/64/859659564.db2.gz BYRXRAWPMXZHII-QTGUNEKASA-N 2 0 417.956 4.281 20 0 HIADRP Cc1cc(C[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)ccc1Br ZINC000467777408 881598004 /nfs/dbraw/zinc/59/80/04/881598004.db2.gz WGGYBILFTDADCS-INIZCTEOSA-N 2 0 420.370 4.499 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC(C)C)c(Cl)c1 ZINC000437901178 863273377 /nfs/dbraw/zinc/27/33/77/863273377.db2.gz JXACVRVVFNOTRM-SFHVURJKSA-N 2 0 410.990 4.007 20 0 HIADRP CN1CCC(CNC(=O)Nc2cccc(-c3cccs3)c2)([NH+]2CCCCC2)CC1 ZINC000438191177 863616334 /nfs/dbraw/zinc/61/63/34/863616334.db2.gz WZFJABQQYMKYEA-UHFFFAOYSA-N 2 0 412.603 4.487 20 0 HIADRP Cc1ccccc1CNC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000439600965 864922800 /nfs/dbraw/zinc/92/28/00/864922800.db2.gz YPEQVTPVZPETQP-FQEVSTJZSA-N 2 0 405.542 4.015 20 0 HIADRP Cc1ccc(CNC(=O)[C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)cc1 ZINC000439599341 864924149 /nfs/dbraw/zinc/92/41/49/864924149.db2.gz VNVRCZSZIRKBOO-FQEVSTJZSA-N 2 0 405.542 4.015 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)Nc1cc(F)ccc1F ZINC000439611748 864934617 /nfs/dbraw/zinc/93/46/17/864934617.db2.gz PTSWDAQOGVRPFI-INIZCTEOSA-N 2 0 413.468 4.307 20 0 HIADRP CCC[NH+]1CCC(N(C)C(=O)NC[C@@H](CC(C)C)[NH2+][C@@H](C)c2ccccc2)CC1 ZINC000468015051 881853024 /nfs/dbraw/zinc/85/30/24/881853024.db2.gz AUDMBISQMKKGBM-RBBKRZOGSA-N 2 0 402.627 4.268 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000468022843 881857868 /nfs/dbraw/zinc/85/78/68/881857868.db2.gz RWMQLZZOQGYWMC-QTJGBDASSA-N 2 0 414.638 4.412 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1)c1ccccc1 ZINC000440183458 865408143 /nfs/dbraw/zinc/40/81/43/865408143.db2.gz GGKGDYOSYSAUNC-PMACEKPBSA-N 2 0 423.605 4.036 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc3cc(Br)ccc3[nH]2)[C@H](C)C1 ZINC000468049641 881875072 /nfs/dbraw/zinc/87/50/72/881875072.db2.gz OSNOLZISIKFKBI-DNVCBOLYSA-N 2 0 408.384 4.157 20 0 HIADRP CCC(CC)([NH2+]CC(=O)NC1CC[NH+](C2CC2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000440313068 865579205 /nfs/dbraw/zinc/57/92/05/865579205.db2.gz IDPJURXIVFNUCF-UHFFFAOYSA-N 2 0 412.405 4.341 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000440535720 865807903 /nfs/dbraw/zinc/80/79/03/865807903.db2.gz SLLCICLYNBJYJZ-UIOOFZCWSA-N 2 0 419.613 4.269 20 0 HIADRP O[C@@H](Cn1c2ccccc2c2ccccc21)C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441416127 866489924 /nfs/dbraw/zinc/48/99/24/866489924.db2.gz CHJGRLNCYFEIFT-LEEZEASISA-N 2 0 403.570 4.104 20 0 HIADRP CC[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Br)cc1Cl ZINC000442873756 867708993 /nfs/dbraw/zinc/70/89/93/867708993.db2.gz LIGGTIZBZWWROH-QGZVFWFLSA-N 2 0 402.808 4.169 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1cc2ccccc2o1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000442891471 867723136 /nfs/dbraw/zinc/72/31/36/867723136.db2.gz MVXYLUDATLIVDO-RTBURBONSA-N 2 0 405.542 4.253 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)CC1 ZINC000443973126 868502174 /nfs/dbraw/zinc/50/21/74/868502174.db2.gz OBKTVOMLZCQTLP-UHFFFAOYSA-N 2 0 406.505 4.055 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2ccc(-c3ccsc3)cc2)CC1 ZINC000444648168 868928868 /nfs/dbraw/zinc/92/88/68/868928868.db2.gz GLDNQEMFSBXQOM-UHFFFAOYSA-N 2 0 413.631 4.331 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC(C)C)cc1Cl ZINC000445046818 869191595 /nfs/dbraw/zinc/19/15/95/869191595.db2.gz GOPDRKGMEIXKAU-KRWDZBQOSA-N 2 0 410.990 4.007 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000446575792 870486404 /nfs/dbraw/zinc/48/64/04/870486404.db2.gz LNZKMQPGYPNAQI-GHTZIAJQSA-N 2 0 400.592 4.057 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)[NH+](C)C ZINC000446576789 870487657 /nfs/dbraw/zinc/48/76/57/870487657.db2.gz IGEWZBMZIBWOCZ-FQEVSTJZSA-N 2 0 422.495 4.234 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)CCCS2 ZINC000446915284 870831157 /nfs/dbraw/zinc/83/11/57/870831157.db2.gz UMHGHWBIIAXMGG-REWPJTCUSA-N 2 0 412.599 4.369 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](Cc3ccc(F)cc3)c3ccccc3)cn2)CC1 ZINC000447527844 871392466 /nfs/dbraw/zinc/39/24/66/871392466.db2.gz GDXREFDKKIKSTI-VWLOTQADSA-N 2 0 418.560 4.436 20 0 HIADRP Brc1cccc([C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)C2CCOCC2)c1 ZINC000447567579 871465951 /nfs/dbraw/zinc/46/59/51/871465951.db2.gz CLRDBJMRXNKXJR-OAQYLSRUSA-N 2 0 407.396 4.381 20 0 HIADRP C[NH+](C)CCOCC[NH2+][C@@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000447600050 871507148 /nfs/dbraw/zinc/50/71/48/871507148.db2.gz ZFDPDXBCGBYMDC-MRXNPFEDSA-N 2 0 424.408 4.118 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)[C@@H](C)C1 ZINC000448461395 872418621 /nfs/dbraw/zinc/41/86/21/872418621.db2.gz KWLLCWVEPQZJEV-GBXCKJPGSA-N 2 0 414.638 4.323 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)[C@@H](C)C1 ZINC000448462626 872427184 /nfs/dbraw/zinc/42/71/84/872427184.db2.gz VPJOABIXFURGEH-YOEKFXIASA-N 2 0 414.638 4.036 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](CC(C)C)[NH2+][C@@H](C)c2ccccc2)[C@@H](C)C1 ZINC000448519704 872503922 /nfs/dbraw/zinc/50/39/22/872503922.db2.gz FMJJLBBVIVCNHX-SQOUVECCSA-N 2 0 402.627 4.124 20 0 HIADRP C[NH+](C)CC1(C(=O)NC[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)CCCCC1 ZINC000460110385 872574542 /nfs/dbraw/zinc/57/45/42/872574542.db2.gz DQDLIFQNQCTVMX-YLJYHZDGSA-N 2 0 409.977 4.100 20 0 HIADRP FC(F)c1ccc(C[N@@H+]2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)cc1 ZINC000461394530 874403322 /nfs/dbraw/zinc/40/33/22/874403322.db2.gz LLLNGIDASWOYAZ-FQEVSTJZSA-N 2 0 400.517 4.053 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)N1C[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC000461435175 874485995 /nfs/dbraw/zinc/48/59/95/874485995.db2.gz VXRQFFVTEMANDU-SFTDATJTSA-N 2 0 417.553 4.089 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)cnn1C(C)C ZINC000468777798 882855411 /nfs/dbraw/zinc/85/54/11/882855411.db2.gz BFORKUWIAXWYKQ-IBGZPJMESA-N 2 0 414.594 4.113 20 0 HIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000462801860 875850286 /nfs/dbraw/zinc/85/02/86/875850286.db2.gz DRLDKHQHLBSHDY-LJQANCHMSA-N 2 0 405.590 4.161 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@@H]2CCCc3c(O)cccc32)CC1 ZINC000462823388 875861816 /nfs/dbraw/zinc/86/18/16/875861816.db2.gz UEULYXCZJUQQGY-HXUWFJFHSA-N 2 0 419.491 4.330 20 0 HIADRP Cc1[nH+]c2ccc(Br)cc2c(N2CCC[C@H](C[NH+]3CCOCC3)C2)c1C ZINC000462834848 875869842 /nfs/dbraw/zinc/86/98/42/875869842.db2.gz AWBHOJOLBXGFCH-QGZVFWFLSA-N 2 0 418.379 4.163 20 0 HIADRP C[C@@H]1C[C@@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)CCN1Cc1ccccc1 ZINC000463074211 876106239 /nfs/dbraw/zinc/10/62/39/876106239.db2.gz AWIDDDGQLFGCAO-RSXGOPAZSA-N 2 0 420.645 4.232 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)c1 ZINC000463132480 876179128 /nfs/dbraw/zinc/17/91/28/876179128.db2.gz PETIJKQZDHEOBR-UHFFFAOYSA-N 2 0 401.982 4.035 20 0 HIADRP COc1ccc([C@@H](CNC2CC[NH+](CCc3ccccc3)CC2)[NH+]2CCCC2)cc1 ZINC000463136244 876184898 /nfs/dbraw/zinc/18/48/98/876184898.db2.gz CVYKJZIACVIFSY-AREMUKBSSA-N 2 0 407.602 4.129 20 0 HIADRP Fc1ccc(CC[NH+]2CCC(NC[C@H](c3cccs3)[NH+]3CCCC3)CC2)cc1 ZINC000463146811 876200543 /nfs/dbraw/zinc/20/05/43/876200543.db2.gz UHWKHGGLCJYTNF-JOCHJYFZSA-N 2 0 401.595 4.321 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[C@@H]1CCCC[N@@H+]1C/C=C/C[NH+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000463190371 876248865 /nfs/dbraw/zinc/24/88/65/876248865.db2.gz CUDPAKWBTVRFOH-IXPDEYFPSA-N 2 0 418.666 4.354 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[C@@H]1CCCC[NH+]1CCC[N@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000463196947 876257205 /nfs/dbraw/zinc/25/72/05/876257205.db2.gz NOXXRQKJIXAVLP-MBJZRRMBSA-N 2 0 406.655 4.188 20 0 HIADRP C[N@H+](C[C@H](O)COc1cccc2ccccc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464843173 878115088 /nfs/dbraw/zinc/11/50/88/878115088.db2.gz QWVSMVVRDPIBSS-UPVQGACJSA-N 2 0 404.554 4.033 20 0 HIADRP C[C@@H]1CC[N@H+](CCOc2ccc(NC(=O)c3cccc(C[NH+]4CCCC4)c3)cc2)C1 ZINC000465197004 878600510 /nfs/dbraw/zinc/60/05/10/878600510.db2.gz QGRAMTWWPUKROV-HXUWFJFHSA-N 2 0 407.558 4.255 20 0 HIADRP C[C@@H]1CCN(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000465398073 878835064 /nfs/dbraw/zinc/83/50/64/878835064.db2.gz AZVYXGZTMBZECG-GGAORHGYSA-N 2 0 424.589 4.113 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](CC)CC)C1 ZINC000465421379 878850815 /nfs/dbraw/zinc/85/08/15/878850815.db2.gz KRKPBSUOYYEBLX-NQIIRXRSSA-N 2 0 409.018 4.096 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000465428206 878859602 /nfs/dbraw/zinc/85/96/02/878859602.db2.gz ZHODTKCVGHXTEU-NOZRDPDXSA-N 2 0 422.617 4.233 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)c1 ZINC000465511133 878951364 /nfs/dbraw/zinc/95/13/64/878951364.db2.gz DMDMEPNGLSVNPD-QFIPXVFZSA-N 2 0 422.617 4.334 20 0 HIADRP CC(C)[C@@H](CNC(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[NH+]1CCC(C)CC1 ZINC000465547850 879010232 /nfs/dbraw/zinc/01/02/32/879010232.db2.gz QKYUICIXSJGYQK-SJBKTWHCSA-N 2 0 420.667 4.187 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CC[C@H](C)[NH+](Cc3ccccc3)CC2)C1 ZINC000465606027 879098050 /nfs/dbraw/zinc/09/80/50/879098050.db2.gz QMFDQFMVHDMQJG-ZRBLBEILSA-N 2 0 414.638 4.051 20 0 HIADRP CN(C)[C@H](CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccccc1Cl ZINC000503437328 912445147 /nfs/dbraw/zinc/44/51/47/912445147.db2.gz PVASSMBMBXKZES-SIKLNZKXSA-N 2 0 421.029 4.240 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccco1 ZINC000465804654 879417710 /nfs/dbraw/zinc/41/77/10/879417710.db2.gz DXXLDEJYCGHXJW-WAOWUJCRSA-N 2 0 418.607 4.106 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCc1cccc(C[NH+](C)CC)c1 ZINC000465821495 879450009 /nfs/dbraw/zinc/45/00/09/879450009.db2.gz YEDKJLXBBNTOHC-VWLOTQADSA-N 2 0 422.617 4.192 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCC1([NH2+][C@@H](C)c3ccccc3)CCCC1)CC2 ZINC000465934876 879599041 /nfs/dbraw/zinc/59/90/41/879599041.db2.gz YUTWOPNXZSPZQI-WWNPGLIZSA-N 2 0 412.622 4.307 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)N2CC[NH+](CC3CCCCC3)CC2)[C@@H]1c1cccs1 ZINC000466077478 879790491 /nfs/dbraw/zinc/79/04/91/879790491.db2.gz MAWZYKSWXCDPAT-RBBKRZOGSA-N 2 0 418.651 4.039 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NCc3ccc(CC[NH+](C)C)cc3)cc2)CC1 ZINC000466971918 880772559 /nfs/dbraw/zinc/77/25/59/880772559.db2.gz AZHIVDCSUVDVSR-UHFFFAOYSA-N 2 0 422.617 4.022 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2c(-c3ccccc3)nc3ccccn32)CC1 ZINC000467159071 880891733 /nfs/dbraw/zinc/89/17/33/880891733.db2.gz AVPIQJGXCKNPCM-UHFFFAOYSA-N 2 0 406.574 4.324 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CCS2 ZINC000467422235 881210729 /nfs/dbraw/zinc/21/07/29/881210729.db2.gz ZJOVUSCPFSVAAN-HRAATJIYSA-N 2 0 415.578 4.474 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2C)CC1 ZINC000469240499 883339694 /nfs/dbraw/zinc/33/96/94/883339694.db2.gz PTQIYXKLGWMHOT-ZWKOTPCHSA-N 2 0 401.574 4.465 20 0 HIADRP C[C@H](CCCOc1ccccc1C(N)=O)[NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000469263604 883361066 /nfs/dbraw/zinc/36/10/66/883361066.db2.gz NPSDKLLCWHMCMU-PCCBWWKXSA-N 2 0 423.601 4.079 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCCc1nc(-c2cccs2)no1 ZINC000469764465 883934543 /nfs/dbraw/zinc/93/45/43/883934543.db2.gz PGTUKIDNRJOOLO-OEWRPIJISA-N 2 0 410.587 4.477 20 0 HIADRP C[C@H]1C[C@@H](N(C)C(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000469843786 884026746 /nfs/dbraw/zinc/02/67/46/884026746.db2.gz VWRSPTGYXMSIKV-CPJSRVTESA-N 2 0 414.553 4.372 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC(CC[NH+](C)C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000503691172 912794529 /nfs/dbraw/zinc/79/45/29/912794529.db2.gz VYWZVTWJLZZFGZ-HXUWFJFHSA-N 2 0 402.627 4.269 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)N2CCC(CC[NH+](C)C)CC2)CCCC1)c1ccccc1 ZINC000503740233 912813745 /nfs/dbraw/zinc/81/37/45/912813745.db2.gz UOBUODDTZRNUNU-FQEVSTJZSA-N 2 0 400.611 4.023 20 0 HIADRP CC[NH+](CC)C[C@@H]1CCN(C(=O)[C@@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)C1 ZINC000470544964 884951983 /nfs/dbraw/zinc/95/19/83/884951983.db2.gz BESLBWCUSVXTCM-FXAWDEMLSA-N 2 0 413.528 4.279 20 0 HIADRP CC[NH+](CC)C[C@H]1CCN(C(=O)[C@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)C1 ZINC000470545055 884953921 /nfs/dbraw/zinc/95/39/21/884953921.db2.gz BESLBWCUSVXTCM-XLIONFOSSA-N 2 0 413.528 4.279 20 0 HIADRP CN(C(=O)NCc1ccc(C[NH+]2CCCC2)cc1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470752297 885218899 /nfs/dbraw/zinc/21/88/99/885218899.db2.gz WWDQYWVTAATXDX-VWLOTQADSA-N 2 0 420.601 4.088 20 0 HIADRP CCN(CCC[NH+](CC)CC)C(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000471858192 886630894 /nfs/dbraw/zinc/63/08/94/886630894.db2.gz QVPNDXYWOXPPIO-UHFFFAOYSA-N 2 0 409.018 4.068 20 0 HIADRP CCN(CCC[NH+]1CCCC1)C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000472092729 886888358 /nfs/dbraw/zinc/88/83/58/886888358.db2.gz HVWPSRCCSMNUAM-NRFANRHFSA-N 2 0 400.611 4.078 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(OCc2c(F)cccc2Cl)cc1 ZINC000472123484 886911740 /nfs/dbraw/zinc/91/17/40/886911740.db2.gz CRFRVHMNUGPLLQ-SFHVURJKSA-N 2 0 419.972 4.174 20 0 HIADRP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1 ZINC000472140211 886934652 /nfs/dbraw/zinc/93/46/52/886934652.db2.gz MMMUFIPPUIEUKL-UHFFFAOYSA-N 2 0 409.496 4.471 20 0 HIADRP C[NH+](C)CC1CCN(c2ccccc2NC(=O)[C@@H]2CC[N@@H+](C3CCCCC3)C2)CC1 ZINC000473275167 888031809 /nfs/dbraw/zinc/03/18/09/888031809.db2.gz HKJMQIJGKQCKGV-OAQYLSRUSA-N 2 0 412.622 4.058 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000473734899 888513053 /nfs/dbraw/zinc/51/30/53/888513053.db2.gz PEJPEVOASAUKPB-DEOSSOPVSA-N 2 0 414.638 4.469 20 0 HIADRP CCN(C(=O)NC1CC[NH+](C(C)(C)C)CC1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473937240 888815795 /nfs/dbraw/zinc/81/57/95/888815795.db2.gz BCNOENKDIGLUNR-UGKGYDQZSA-N 2 0 400.611 4.116 20 0 HIADRP CC(C)n1nccc1C[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000474456730 889322692 /nfs/dbraw/zinc/32/26/92/889322692.db2.gz FRYPJRSPDJPUSG-UHFFFAOYSA-N 2 0 403.574 4.076 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000475109691 889958477 /nfs/dbraw/zinc/95/84/77/889958477.db2.gz AARHCMFOWTVDJU-BWKNWUBXSA-N 2 0 420.601 4.128 20 0 HIADRP COc1cc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OCC(F)(F)F ZINC000475275218 890171495 /nfs/dbraw/zinc/17/14/95/890171495.db2.gz ALMRLFDGLNJCRK-IBGZPJMESA-N 2 0 408.464 4.248 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475279150 890175874 /nfs/dbraw/zinc/17/58/74/890175874.db2.gz KZAWCZRQOACHBG-IEBWSBKVSA-N 2 0 415.965 4.177 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475297562 890203364 /nfs/dbraw/zinc/20/33/64/890203364.db2.gz NPPGOHCJNFTQFM-UGKGYDQZSA-N 2 0 413.993 4.189 20 0 HIADRP CN(C(=O)NC1CC[NH+](C2CCCCC2)CC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000476004466 890931731 /nfs/dbraw/zinc/93/17/31/890931731.db2.gz JIWJTAKDGZGRAY-UHFFFAOYSA-N 2 0 412.622 4.090 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000476008137 890936835 /nfs/dbraw/zinc/93/68/35/890936835.db2.gz PWXSNRNZPSOWRR-NHCUHLMSSA-N 2 0 404.643 4.080 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)c1ccco1 ZINC000476847438 891820329 /nfs/dbraw/zinc/82/03/29/891820329.db2.gz RLZYIMOTNCGFER-SIKLNZKXSA-N 2 0 412.578 4.194 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cc(F)ccc1F ZINC000479063771 894324668 /nfs/dbraw/zinc/32/46/68/894324668.db2.gz PIVLSUMINWWNMD-CVDCTZTESA-N 2 0 415.528 4.149 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(Br)cc1C(F)(F)F ZINC000479273603 894549165 /nfs/dbraw/zinc/54/91/65/894549165.db2.gz FJTQNXPMCUBPND-KBPBESRZSA-N 2 0 422.333 4.145 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000479535751 894841281 /nfs/dbraw/zinc/84/12/81/894841281.db2.gz APBFXUFPGPMKFK-NRFANRHFSA-N 2 0 418.670 4.470 20 0 HIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000479748944 895047558 /nfs/dbraw/zinc/04/75/58/895047558.db2.gz TWKKPCUYKINGIU-UXHICEINSA-N 2 0 409.640 4.022 20 0 HIADRP COc1ccccc1[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)[NH+]1CCCC1 ZINC000479877652 895221767 /nfs/dbraw/zinc/22/17/67/895221767.db2.gz YTKKRCFLCMKOHE-SDUSCBPUSA-N 2 0 407.602 4.332 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc2c(c1)OCCO2 ZINC000480244159 895654697 /nfs/dbraw/zinc/65/46/97/895654697.db2.gz XEZWAXSSHBMMHQ-SELNLUPBSA-N 2 0 410.558 4.308 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480442343 895831949 /nfs/dbraw/zinc/83/19/49/895831949.db2.gz WULQVJKVLVDRSA-KRWDZBQOSA-N 2 0 404.551 4.066 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H]1CCCOc2c(Cl)c(Cl)ccc21)N1CC[NH+](C)CC1 ZINC000480520714 895884347 /nfs/dbraw/zinc/88/43/47/895884347.db2.gz CIKBTMPCVUKHTO-ROUUACIJSA-N 2 0 400.394 4.069 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480599259 895962769 /nfs/dbraw/zinc/96/27/69/895962769.db2.gz DCKMBEJKVYEQLU-ZWKOTPCHSA-N 2 0 418.578 4.312 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cccc(NS(C)(=O)=O)c1 ZINC000480613910 895980294 /nfs/dbraw/zinc/98/02/94/895980294.db2.gz NFPGHHQGECKHQM-OALUTQOASA-N 2 0 415.603 4.283 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC[C@H]3C)cc2)[C@H](C)C1 ZINC000480630956 896001281 /nfs/dbraw/zinc/00/12/81/896001281.db2.gz MCOMCYQFSAPTTF-RQTOMXEWSA-N 3 0 401.639 4.288 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCSc4ccc(Cl)cc43)cn2)CC1 ZINC000480692979 896053912 /nfs/dbraw/zinc/05/39/12/896053912.db2.gz HOMLDNFWBCUTGJ-IBGZPJMESA-N 2 0 402.995 4.204 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H]3CCCc4nc(-c5ccccc5)sc43)ccn2)CC1 ZINC000480691471 896054535 /nfs/dbraw/zinc/05/45/35/896054535.db2.gz BTIANDFJWLXRPN-FQEVSTJZSA-N 2 0 419.598 4.124 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C[NH2+]C3CCN(Cc4ccccn4)CC3)cc2)C1 ZINC000480706033 896069213 /nfs/dbraw/zinc/06/92/13/896069213.db2.gz NWLJSNDPRVBPRO-VXKWHMMOSA-N 2 0 406.618 4.314 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCN(c3ccccc3C(F)(F)F)C2)[C@H](C)C1 ZINC000480722063 896082952 /nfs/dbraw/zinc/08/29/52/896082952.db2.gz ADFNZAZLNDZGDF-GGPKGHCWSA-N 2 0 413.528 4.011 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)CC1 ZINC000480723454 896084896 /nfs/dbraw/zinc/08/48/96/896084896.db2.gz ZCTIOCUOYMMQGI-QGZVFWFLSA-N 2 0 421.507 4.415 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3ccc(F)cc3OC(F)F)cc2)CC1 ZINC000480727797 896088843 /nfs/dbraw/zinc/08/88/43/896088843.db2.gz JYQULIBJZYFIJF-QGZVFWFLSA-N 2 0 421.507 4.415 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(NC(=O)NC(C)C)cc2)[C@@H](C)C1 ZINC000480739818 896100589 /nfs/dbraw/zinc/10/05/89/896100589.db2.gz KCMUBYOGAAKFGZ-JQVVWYNYSA-N 2 0 404.599 4.004 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cc(OC)c(OC)cc2C)CC1 ZINC000480740501 896103011 /nfs/dbraw/zinc/10/30/11/896103011.db2.gz WQAXHUSLDYGFDZ-HXUWFJFHSA-N 2 0 411.590 4.001 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccccc1OC(F)F ZINC000480909963 896266398 /nfs/dbraw/zinc/26/63/98/896266398.db2.gz LMMXINBEFIBNLT-NRFANRHFSA-N 2 0 403.517 4.276 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)c1 ZINC000481149736 896479327 /nfs/dbraw/zinc/47/93/27/896479327.db2.gz BTBUFFPAFNXHRX-VWNXMTODSA-N 2 0 406.574 4.267 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1OCCN1CCOCC1)c1cccc(OC(F)(F)F)c1 ZINC000481203401 896556598 /nfs/dbraw/zinc/55/65/98/896556598.db2.gz MYCDVAGQYALZLD-QGZVFWFLSA-N 2 0 424.463 4.147 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000481315119 896665046 /nfs/dbraw/zinc/66/50/46/896665046.db2.gz YHRMULWDAALASI-HXUWFJFHSA-N 2 0 407.327 4.306 20 0 HIADRP COc1ccc(C2(C[NH2+][C@H](C)c3ccc(OCC[NH+](C)C)cc3)CCOCC2)cc1 ZINC000481549569 896915240 /nfs/dbraw/zinc/91/52/40/896915240.db2.gz SIGXDCCLFVSRSP-HXUWFJFHSA-N 2 0 412.574 4.035 20 0 HIADRP Cc1c([C@@H](C)NCc2ccccc2OCC[NH+](C)C)nnn1-c1cccc(Cl)c1 ZINC000481718247 897112243 /nfs/dbraw/zinc/11/22/43/897112243.db2.gz AHEYNYYSMASSRC-MRXNPFEDSA-N 2 0 413.953 4.020 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3nnn(-c4ccccc4)c3C)CC2)cc1 ZINC000481720582 897113730 /nfs/dbraw/zinc/11/37/30/897113730.db2.gz VQPUHAAOSVAWFW-LJQANCHMSA-N 2 0 419.573 4.147 20 0 HIADRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)nnn1-c1ccc(F)cc1 ZINC000481727016 897121534 /nfs/dbraw/zinc/12/15/34/897121534.db2.gz SVCVWOGFWPARGV-INIZCTEOSA-N 2 0 413.566 4.339 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)[C@H](C)C1 ZINC000481727179 897121917 /nfs/dbraw/zinc/12/19/17/897121917.db2.gz PGVVRCSEDPNYQT-RDGATRHJSA-N 3 0 401.639 4.289 20 0 HIADRP C[C@H](C[NH2+][C@H]1CCC(C)(C)c2ccc(Br)cc21)CN1CC[NH+](C)CC1 ZINC000481925937 897308739 /nfs/dbraw/zinc/30/87/39/897308739.db2.gz NKDDQRRYSXQVLI-UZLBHIALSA-N 2 0 408.428 4.035 20 0 HIADRP CC1(C)CC[C@@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c2ccccc21 ZINC000481931465 897316216 /nfs/dbraw/zinc/31/62/16/897316216.db2.gz JIAQJZWEXHASME-ZJSXRUAMSA-N 2 0 405.586 4.286 20 0 HIADRP Cc1c(Cl)cccc1NC(=O)CC[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000482013191 897412404 /nfs/dbraw/zinc/41/24/04/897412404.db2.gz USZBUMGBGVYFDR-KRWDZBQOSA-N 2 0 403.954 4.268 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000482117418 897568870 /nfs/dbraw/zinc/56/88/70/897568870.db2.gz CYJYYAHZPXKLDC-LJQANCHMSA-N 2 0 418.541 4.125 20 0 HIADRP COc1ccc2oc([C@@H](C)[NH2+]CCCN3CCN(c4cc[nH+]cc4)CC3)c(C)c2c1 ZINC000482117142 897569296 /nfs/dbraw/zinc/56/92/96/897569296.db2.gz BOAYOIFNQKDPIE-LJQANCHMSA-N 2 0 408.546 4.008 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(Br)cc3cccnc32)[C@H](C)C1 ZINC000482140729 897599872 /nfs/dbraw/zinc/59/98/72/897599872.db2.gz SUXFGXAJDHNECU-OXQOHEQNSA-N 2 0 420.395 4.224 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1 ZINC000482141096 897600580 /nfs/dbraw/zinc/60/05/80/897600580.db2.gz YAOXZHJPGMCTDK-CJFMBICVSA-N 2 0 414.553 4.334 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)c1 ZINC000482237689 897718764 /nfs/dbraw/zinc/71/87/64/897718764.db2.gz XDCUVTTZIDXNOY-LJQANCHMSA-N 2 0 406.357 4.062 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@H]2CCCOc3c(C)cc(C)cc32)c1 ZINC000482247229 897729504 /nfs/dbraw/zinc/72/95/04/897729504.db2.gz VDLYAMVCKTXMEZ-DEOSSOPVSA-N 2 0 412.574 4.264 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CCCc3sccc32)c1)C1CCOCC1 ZINC000482255040 897736312 /nfs/dbraw/zinc/73/63/12/897736312.db2.gz CXZUQWXQNLRAOP-QFIPXVFZSA-N 2 0 400.588 4.405 20 0 HIADRP Cc1nc(C)c([C@@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)s1 ZINC000482274447 897761592 /nfs/dbraw/zinc/76/15/92/897761592.db2.gz WRHXRZHJXFFVHZ-MRXNPFEDSA-N 2 0 403.592 4.100 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000482444666 898006718 /nfs/dbraw/zinc/00/67/18/898006718.db2.gz IINGLDYJJODHBJ-RBBKRZOGSA-N 2 0 408.590 4.432 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)[C@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000482504036 898086964 /nfs/dbraw/zinc/08/69/64/898086964.db2.gz MPDTWFVNUOSLHL-IKGGRYGDSA-N 2 0 402.410 4.012 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2ccc(SCC(F)(F)F)cc2)CC1 ZINC000482511135 898095560 /nfs/dbraw/zinc/09/55/60/898095560.db2.gz PFRZLHZMDQUNCM-IAGOWNOFSA-N 2 0 403.558 4.265 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000482543420 898131548 /nfs/dbraw/zinc/13/15/48/898131548.db2.gz MQJJAMMXQHFJOP-QHCPKHFHSA-N 2 0 403.973 4.380 20 0 HIADRP Cc1c([C@H](C)[NH2+]CCCN2CCC[N@H+](C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000482553570 898143254 /nfs/dbraw/zinc/14/32/54/898143254.db2.gz NQAMAJFGCFRQBS-INIZCTEOSA-N 2 0 424.420 4.166 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CCCN2CCC[N@H+](C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000482553574 898143698 /nfs/dbraw/zinc/14/36/98/898143698.db2.gz NQAMAJFGCFRQBS-MRXNPFEDSA-N 2 0 424.420 4.166 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCCO3)CC1 ZINC000482558133 898148837 /nfs/dbraw/zinc/14/88/37/898148837.db2.gz MSCAHIYKILRZCT-QZTJIDSGSA-N 2 0 413.537 4.151 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCc4cc(Br)ccc43)cc2)CC1 ZINC000482557697 898149233 /nfs/dbraw/zinc/14/92/33/898149233.db2.gz SDIVFHHPTLOULD-JOCHJYFZSA-N 2 0 415.375 4.183 20 0 HIADRP COCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000482564872 898158346 /nfs/dbraw/zinc/15/83/46/898158346.db2.gz LXHJNKWRSACURB-RTBURBONSA-N 2 0 415.553 4.015 20 0 HIADRP COC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cccc(C(F)(F)F)c1 ZINC000482567755 898162214 /nfs/dbraw/zinc/16/22/14/898162214.db2.gz SPARTDOPUTZDEG-JOCHJYFZSA-N 2 0 422.491 4.139 20 0 HIADRP C[C@@H](C[NH2+][C@@H](CCSc1ccc(F)cc1)c1ccc(F)cc1)N1CC[NH+](C)CC1 ZINC000482569725 898163959 /nfs/dbraw/zinc/16/39/59/898163959.db2.gz PVHJBPPTTDWGEK-MBSDFSHPSA-N 2 0 419.585 4.414 20 0 HIADRP C[C@H](C[NH2+][C@H](CCSc1ccc(F)cc1)c1ccc(F)cc1)N1CC[NH+](C)CC1 ZINC000482569726 898164201 /nfs/dbraw/zinc/16/42/01/898164201.db2.gz PVHJBPPTTDWGEK-WZONZLPQSA-N 2 0 419.585 4.414 20 0 HIADRP Cc1cc2c(cc1C)[C@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c1)CCCO2 ZINC000482620267 898223075 /nfs/dbraw/zinc/22/30/75/898223075.db2.gz ONQNPFSNZAYGIQ-LADGPHEKSA-N 2 0 421.585 4.004 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)[C@@H](C)C1 ZINC000482632053 898234933 /nfs/dbraw/zinc/23/49/33/898234933.db2.gz PJPRWLZJIUYGNY-GBXCKJPGSA-N 3 0 422.057 4.279 20 0 HIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CCCC[N@@H+]3CCC[C@H]3CO)s2)cc1 ZINC000482874106 898486784 /nfs/dbraw/zinc/48/67/84/898486784.db2.gz HITUWKBGVZEEQG-LPHOPBHVSA-N 2 0 403.592 4.015 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000482886229 898501005 /nfs/dbraw/zinc/50/10/05/898501005.db2.gz IMRUZZFKVFVFCI-XUZZJYLKSA-N 2 0 405.586 4.240 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(-c3nc4ccccc4[nH]3)cc2)[C@@H](C)C1 ZINC000482949973 898577870 /nfs/dbraw/zinc/57/78/70/898577870.db2.gz WOQREZSGNAVTEP-UGKGYDQZSA-N 2 0 406.574 4.457 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000482956091 898584878 /nfs/dbraw/zinc/58/48/78/898584878.db2.gz ZVEOTVMIIWZKJN-ATIYNZHBSA-N 2 0 406.618 4.458 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3cccc(Br)c3)CC2)[C@H](C)C1 ZINC000483121798 898808788 /nfs/dbraw/zinc/80/87/88/898808788.db2.gz RAGGAVYVXGVTFR-YLJYHZDGSA-N 2 0 409.412 4.207 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000483198827 898854723 /nfs/dbraw/zinc/85/47/23/898854723.db2.gz MBMMEDKDZVYCJW-PKOBYXMFSA-N 2 0 419.516 4.158 20 0 HIADRP COc1ccc(C[C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c2ccc(OC)cc2)cc1 ZINC000483214477 898863207 /nfs/dbraw/zinc/86/32/07/898863207.db2.gz NYCFWQMNECSKCV-HFZDXXHNSA-N 2 0 424.585 4.078 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+]([C@@H](C)c2cccc(Br)c2)CC1 ZINC000483408065 899038008 /nfs/dbraw/zinc/03/80/08/899038008.db2.gz NSURBUZMFINCEX-KRWDZBQOSA-N 2 0 424.427 4.070 20 0 HIADRP CCOc1ccc([C@@H](CC)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1OCC ZINC000483530603 899192698 /nfs/dbraw/zinc/19/26/98/899192698.db2.gz KDUTUEAFIMWCEE-JOCHJYFZSA-N 2 0 417.638 4.475 20 0 HIADRP O=C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)NC1CC[NH+](C2CCCC2)CC1 ZINC000483705724 899361761 /nfs/dbraw/zinc/36/17/61/899361761.db2.gz ADLYWUAKTZDPEY-QFIPXVFZSA-N 2 0 419.013 4.183 20 0 HIADRP C[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)COC2 ZINC000483728169 899386556 /nfs/dbraw/zinc/38/65/56/899386556.db2.gz HVJWCUKLCLGEIS-MRXNPFEDSA-N 2 0 419.491 4.338 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)C[C@@H]1C ZINC000483739531 899401593 /nfs/dbraw/zinc/40/15/93/899401593.db2.gz GRECDSLJLFVUFU-REWPJTCUSA-N 2 0 400.611 4.077 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)C[C@@H]1C ZINC000483800323 899475210 /nfs/dbraw/zinc/47/52/10/899475210.db2.gz OLCGXVKJKHOGDV-VWPQPMDRSA-N 2 0 400.611 4.164 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)NC1CC[NH+](C2CCCC2)CC1 ZINC000483824278 899502711 /nfs/dbraw/zinc/50/27/11/899502711.db2.gz TVWVVLATGCGIGY-UHFFFAOYSA-N 2 0 412.622 4.269 20 0 HIADRP CC[C@@H]1Oc2cc([C@@H](C)[NH2+][C@@H](C)c3ccc(OCC[NH+](C)C)cc3)ccc2NC1=O ZINC000483846973 899527773 /nfs/dbraw/zinc/52/77/73/899527773.db2.gz CTNQWZZSRITOMC-JKSBSHDWSA-N 2 0 411.546 4.148 20 0 HIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H]1CCCc2nc(-c3ccc(OC)cc3)sc21 ZINC000484283101 899850888 /nfs/dbraw/zinc/85/08/88/899850888.db2.gz PMHUXSNPIYDSME-RBUKOAKNSA-N 2 0 403.592 4.143 20 0 HIADRP CC[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(Cl)ccc1OC ZINC000484289399 899854122 /nfs/dbraw/zinc/85/41/22/899854122.db2.gz JKUSQLWBNLECET-LJQANCHMSA-N 2 0 410.002 4.016 20 0 HIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)c2ccccc12 ZINC000484313096 899872810 /nfs/dbraw/zinc/87/28/10/899872810.db2.gz UAQSUQLPEJAWJR-SFHVURJKSA-N 2 0 411.590 4.126 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CCN1CCC([NH+](C)C)CC1 ZINC000484472583 899966654 /nfs/dbraw/zinc/96/66/54/899966654.db2.gz KWJWRHLSOOFHGC-HNNXBMFYSA-N 2 0 407.027 4.449 20 0 HIADRP COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C)C2)c1 ZINC000484509816 900001677 /nfs/dbraw/zinc/00/16/77/900001677.db2.gz UOHLPSDWOCFCCZ-RQNQAMLKSA-N 2 0 423.601 4.030 20 0 HIADRP CCC[NH+]1CCC([N@H+](C)C[C@@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)CC1 ZINC000484911344 900287783 /nfs/dbraw/zinc/28/77/83/900287783.db2.gz QPUOCUHEVWAIOE-RSXGOPAZSA-N 2 0 410.602 4.268 20 0 HIADRP CCOc1ccccc1NC(=O)CC[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000485106498 900414453 /nfs/dbraw/zinc/41/44/53/900414453.db2.gz LGTIVQKVCRDWCG-UHFFFAOYSA-N 2 0 409.574 4.258 20 0 HIADRP C[N@H+](CCC(=O)Nc1ccccc1C(F)(F)F)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000485432911 900729663 /nfs/dbraw/zinc/72/96/63/900729663.db2.gz DSFILUULWKNPAY-IBGZPJMESA-N 2 0 419.491 4.488 20 0 HIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCC(=O)Nc2ccc(OCc3ccccc3)cc2)[C@H](C)C1 ZINC000485678180 900929787 /nfs/dbraw/zinc/92/97/87/900929787.db2.gz INBOEFQCGHHXFR-HYBUGGRVSA-N 2 0 409.574 4.256 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000486188318 901373639 /nfs/dbraw/zinc/37/36/39/901373639.db2.gz GKXKOERLLWUVHW-PXDATVDWSA-N 2 0 405.586 4.313 20 0 HIADRP C[C@@H]([NH2+]Cc1cnc2ccc(Br)cn12)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486505721 901657383 /nfs/dbraw/zinc/65/73/83/901657383.db2.gz MOPLPIFBCGTQOX-SJLPKXTDSA-N 2 0 413.363 4.097 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1 ZINC000505931075 914583019 /nfs/dbraw/zinc/58/30/19/914583019.db2.gz WERUGXSTAQEVCS-FGZHOGPDSA-N 2 0 415.622 4.134 20 0 HIADRP CCOc1c(Cl)cccc1C[NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1 ZINC000486969637 901996019 /nfs/dbraw/zinc/99/60/19/901996019.db2.gz PYXYUZZXMPMBTB-UHFFFAOYSA-N 2 0 401.982 4.166 20 0 HIADRP C[NH+](Cc1ccccc1C[N@@H+](C)[C@H](CO)c1ccccc1)[C@H](CO)c1ccccc1 ZINC000487441865 902212296 /nfs/dbraw/zinc/21/22/96/902212296.db2.gz FZLPFCKDFXKFKT-CLJLJLNGSA-N 2 0 404.554 4.017 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](CCc2ccc3ccccc3c2)CC1 ZINC000487753888 902343390 /nfs/dbraw/zinc/34/33/90/902343390.db2.gz FZDVJOUEVMYASC-UHFFFAOYSA-N 2 0 407.602 4.087 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](CC(=O)N(C)Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000488327604 902766900 /nfs/dbraw/zinc/76/69/00/902766900.db2.gz UCNKVRAPTPKJDR-UHFFFAOYSA-N 2 0 400.394 4.006 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488580506 902891459 /nfs/dbraw/zinc/89/14/59/902891459.db2.gz KVJCUAYMWPGAEE-SQJMNOBHSA-N 2 0 422.617 4.190 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)[NH+]2CCCC2)o1 ZINC000489131361 903220823 /nfs/dbraw/zinc/22/08/23/903220823.db2.gz DOEJTGKVQOIJPG-HSZRJFAPSA-N 2 0 424.589 4.031 20 0 HIADRP COc1cccc(-c2nc(C[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)cs2)c1 ZINC000506026359 914708122 /nfs/dbraw/zinc/70/81/22/914708122.db2.gz GIFYVSSHSXVMFM-UHFFFAOYSA-N 2 0 415.603 4.143 20 0 HIADRP c1ccc(C[NH+]2CCC(OCC3CC3)CC2)c(C[NH+]2CCC(OCC3CC3)CC2)c1 ZINC000489425036 903376721 /nfs/dbraw/zinc/37/67/21/903376721.db2.gz TXGMUMVEVBDRJO-UHFFFAOYSA-N 2 0 412.618 4.469 20 0 HIADRP C[C@H](CCNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[N@H+](C)Cc1ccccc1 ZINC000489533782 903443333 /nfs/dbraw/zinc/44/33/33/903443333.db2.gz ZTGPGHIWZJHGKC-JOCHJYFZSA-N 2 0 422.617 4.203 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCOc4ccc(C(C)C)cc43)cn2)CC1 ZINC000489596077 903486706 /nfs/dbraw/zinc/48/67/06/903486706.db2.gz BNEMUKBTPCDUFH-HSZRJFAPSA-N 2 0 408.590 4.350 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1 ZINC000489821352 903615101 /nfs/dbraw/zinc/61/51/01/903615101.db2.gz QQZCKTSTCMKBLZ-NQHRYMMQSA-N 2 0 420.601 4.033 20 0 HIADRP Fc1ccccc1-c1nc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)cs1 ZINC000506050379 914748948 /nfs/dbraw/zinc/74/89/48/914748948.db2.gz AYUUYWMPETXREH-UHFFFAOYSA-N 2 0 403.567 4.274 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000490138599 903786011 /nfs/dbraw/zinc/78/60/11/903786011.db2.gz VYBJEAQLAJBHGJ-DEOSSOPVSA-N 2 0 416.009 4.445 20 0 HIADRP C[C@H](NC(=O)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000490828624 904272323 /nfs/dbraw/zinc/27/23/23/904272323.db2.gz QKCCSFCKMWUQHF-ZTCOLXNVSA-N 2 0 423.576 4.065 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000491020939 904372954 /nfs/dbraw/zinc/37/29/54/904372954.db2.gz NRERTWWCSADTFP-WMZHIEFXSA-N 2 0 417.544 4.241 20 0 HIADRP Cc1ccc([C@@H]([NH2+]CCC2CC[NH+](C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491020190 904373648 /nfs/dbraw/zinc/37/36/48/904373648.db2.gz LZAJDYWZRHFQQD-DEOSSOPVSA-N 2 0 414.615 4.118 20 0 HIADRP CSc1cccc([C@H]([NH2+]CC2CC[NH+](CCO)CC2)c2ccc(F)c(F)c2)c1 ZINC000491034526 904388051 /nfs/dbraw/zinc/38/80/51/904388051.db2.gz HCTCCJKIFDEUPK-QFIPXVFZSA-N 2 0 406.542 4.070 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@H](O)COCc2ccccc2Cl)CC1 ZINC000491075422 904412240 /nfs/dbraw/zinc/41/22/40/904412240.db2.gz MIHAJBLMDKYXHG-QHCPKHFHSA-N 2 0 416.993 4.062 20 0 HIADRP CSc1cccc([C@@H]([NH2+]CCCN2CC[NH+](C)CC2)c2cc(F)ccc2F)c1 ZINC000491343587 904546654 /nfs/dbraw/zinc/54/66/54/904546654.db2.gz PHMSSBBGHAETLE-JOCHJYFZSA-N 2 0 405.558 4.003 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cc(Br)cs1 ZINC000493734921 905206864 /nfs/dbraw/zinc/20/68/64/905206864.db2.gz GSPIIGYSMKHOOR-HNNXBMFYSA-N 2 0 408.409 4.109 20 0 HIADRP COC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1)c1ccc(Cl)cc1 ZINC000493738512 905207942 /nfs/dbraw/zinc/20/79/42/905207942.db2.gz PQDODLKAAQOQGC-BSRJHKFKSA-N 2 0 402.966 4.427 20 0 HIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1cc(Br)cs1 ZINC000493883372 905243135 /nfs/dbraw/zinc/24/31/35/905243135.db2.gz OGNSALRVXYMBRW-HNNXBMFYSA-N 2 0 400.430 4.112 20 0 HIADRP Cc1ccc(C)c([C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c2ccccc2)c1 ZINC000494055785 905393871 /nfs/dbraw/zinc/39/38/71/905393871.db2.gz JSMVUEFWILSLRO-AREMUKBSSA-N 2 0 415.581 4.474 20 0 HIADRP C[NH+]1CCN(CCCCCN2CC[N@@H+](C)CC23CCCCC3)C2(CCCCC2)C1 ZINC000494884349 906061663 /nfs/dbraw/zinc/06/16/63/906061663.db2.gz XSACHUFQMVXIIT-UHFFFAOYSA-N 2 0 404.687 4.057 20 0 HIADRP FC(F)(F)c1ccc(-c2n[nH]cc2C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000494981286 906146135 /nfs/dbraw/zinc/14/61/35/906146135.db2.gz SNAWEGIEMSKNTR-UHFFFAOYSA-N 2 0 422.495 4.172 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cnc(-c4ccco4)s3)CC2)CC1 ZINC000494982137 906146232 /nfs/dbraw/zinc/14/62/32/906146232.db2.gz WKGUPXKHWRZPIR-UHFFFAOYSA-N 2 0 402.608 4.031 20 0 HIADRP COc1cccc([C@@H]2[C@H]([NH2+][C@@H](C)c3cccc(OCC[NH+](C)C)c3)CCN2C2CC2)c1 ZINC000495403367 906428851 /nfs/dbraw/zinc/42/88/51/906428851.db2.gz UZOXRYBGJIVNJM-AFWDCEBSSA-N 2 0 423.601 4.264 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(C(F)(F)F)cc1 ZINC000495465761 906466926 /nfs/dbraw/zinc/46/69/26/906466926.db2.gz SFAIZHBPZSEBQI-UZLBHIALSA-N 2 0 419.491 4.254 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc2ccccc2c1 ZINC000495466308 906468927 /nfs/dbraw/zinc/46/89/27/906468927.db2.gz XLYCPLWJNDYCMP-UQBPGWFLSA-N 2 0 401.554 4.388 20 0 HIADRP Cc1nc(NC(=O)[C@H](C)NCc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)sc1C ZINC000495548234 906501461 /nfs/dbraw/zinc/50/14/61/906501461.db2.gz PGGOUYGGYJRNDX-BQFCYCMXSA-N 2 0 414.619 4.355 20 0 HIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC(C(=O)Nc2ccc(O)cc2)CC1 ZINC000512628729 921267585 /nfs/dbraw/zinc/26/75/85/921267585.db2.gz NHLZUIGTJSQSKD-UHFFFAOYSA-N 2 0 409.574 4.201 20 0 HIADRP CCC(CC)C(=O)N1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000512653444 921275768 /nfs/dbraw/zinc/27/57/68/921275768.db2.gz FJDUPPAUMPTTFY-QLBJFCOMSA-N 2 0 411.634 4.304 20 0 HIADRP O=C(C1CCCCC1)N1CC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000512654810 921276302 /nfs/dbraw/zinc/27/63/02/921276302.db2.gz OXEGQLFZVHLCMI-CXSMSNRLSA-N 2 0 409.618 4.058 20 0 HIADRP O=C(C1CCCCC1)N1CC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000512654811 921276606 /nfs/dbraw/zinc/27/66/06/921276606.db2.gz OXEGQLFZVHLCMI-OJJQZRKESA-N 2 0 409.618 4.058 20 0 HIADRP O=C(CCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)N1Cc2ccccc2C1 ZINC000512659661 921278410 /nfs/dbraw/zinc/27/84/10/921278410.db2.gz JCCZEDNEZFJQCL-JIMJEQGWSA-N 2 0 417.597 4.199 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@@H]21)[NH2+][C@H](C)c1ccccc1 ZINC000497686768 907192343 /nfs/dbraw/zinc/19/23/43/907192343.db2.gz KSOZSADMWZAHQK-FCEUIQTBSA-N 2 0 400.611 4.022 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@H](c2ccco2)c2ccc(Br)cc2)CC1 ZINC000497816686 907301205 /nfs/dbraw/zinc/30/12/05/907301205.db2.gz IOZBHVDDJAKXEN-NRFANRHFSA-N 2 0 420.395 4.139 20 0 HIADRP Cc1cccc([C@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N2CCOCC2)c1 ZINC000499148391 908507741 /nfs/dbraw/zinc/50/77/41/908507741.db2.gz SULNXTWLNBLLMD-NFGXINMFSA-N 2 0 419.613 4.154 20 0 HIADRP COc1ccc([C@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N(C)C)cc1OC ZINC000499153224 908510925 /nfs/dbraw/zinc/51/09/25/908510925.db2.gz RHRNQUKPOQUSSP-XQUALCHDSA-N 2 0 423.601 4.092 20 0 HIADRP Cc1ccc(C(=O)N2CCC([NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)CC2)cc1 ZINC000499165150 908518405 /nfs/dbraw/zinc/51/84/05/908518405.db2.gz TXGAVRKDWZMURV-OOSCYNTBSA-N 2 0 417.597 4.385 20 0 HIADRP Cc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(N2CCOCC2)c1 ZINC000499197381 908552480 /nfs/dbraw/zinc/55/24/80/908552480.db2.gz ZCIXQSNEFJTTTP-QEIWAGNOSA-N 2 0 405.586 4.117 20 0 HIADRP O=C(c1ccccc1)N1CCC(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499255764 908632486 /nfs/dbraw/zinc/63/24/86/908632486.db2.gz NVXPWZUQRTUGEK-OOSCYNTBSA-N 2 0 417.597 4.324 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000500443083 909862181 /nfs/dbraw/zinc/86/21/81/909862181.db2.gz XHZDHXLZWPIEJK-VWLOTQADSA-N 2 0 422.519 4.453 20 0 HIADRP CCC[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1ccccn1 ZINC000500645283 909988650 /nfs/dbraw/zinc/98/86/50/909988650.db2.gz CKBRNZOCJQUURG-IBGZPJMESA-N 2 0 406.496 4.483 20 0 HIADRP CC[NH+]1CCN(c2ccccc2C[NH+]2CCC(OCc3ccccc3OC)CC2)CC1 ZINC000500729150 910045755 /nfs/dbraw/zinc/04/57/55/910045755.db2.gz YGRVSRILWJSPJJ-UHFFFAOYSA-N 2 0 423.601 4.018 20 0 HIADRP CC1(C)CC(NC(=O)NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)CC(C)(C)[NH2+]1 ZINC000501006819 910228234 /nfs/dbraw/zinc/22/82/34/910228234.db2.gz KOQUIOFVQILXAT-LJQANCHMSA-N 2 0 407.002 4.085 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](c2ccc(Br)cc2)C2CCC2)CC1 ZINC000501019351 910237432 /nfs/dbraw/zinc/23/74/32/910237432.db2.gz CICBVDPXTSIWRO-NRFANRHFSA-N 2 0 408.428 4.296 20 0 HIADRP C[C@@H](c1nc(Cc2ccc(F)cc2)no1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501078483 910279188 /nfs/dbraw/zinc/27/91/88/910279188.db2.gz JRJLTHNFOOMZCM-KRWDZBQOSA-N 2 0 409.509 4.104 20 0 HIADRP Brc1cc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cs1 ZINC000513125982 921570601 /nfs/dbraw/zinc/57/06/01/921570601.db2.gz MIXVHNWCXRGBDO-UHFFFAOYSA-N 2 0 408.409 4.203 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)c1)C1CCOCC1 ZINC000501482781 910597157 /nfs/dbraw/zinc/59/71/57/910597157.db2.gz UPIMCPVSAKDFAE-VWNXMTODSA-N 2 0 423.601 4.387 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2nc(-c3ccc(C)c(F)c3)no2)CC1 ZINC000501786052 910839274 /nfs/dbraw/zinc/83/92/74/910839274.db2.gz ORSLLKNBWYPXOE-GOSISDBHSA-N 2 0 418.557 4.316 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2nnc(-c3ccc(C)cc3)o2)CC1 ZINC000501819448 910867339 /nfs/dbraw/zinc/86/73/39/910867339.db2.gz XCNSQHVIESHJRJ-IBGZPJMESA-N 2 0 400.567 4.176 20 0 HIADRP O=C(N[C@@H](C[NH+]1CCCC1)c1ccccc1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000502651498 911692872 /nfs/dbraw/zinc/69/28/72/911692872.db2.gz QRROOTAGHFAWCP-DEOSSOPVSA-N 2 0 412.622 4.121 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)NC[C@@H](c3ccco3)[NH+]3CCCCC3)CC2)CC1 ZINC000502792405 911814763 /nfs/dbraw/zinc/81/47/63/911814763.db2.gz QUQVZSHARZWLII-HRTMPFAESA-N 2 0 416.610 4.149 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)NCc2ccccc2C[NH+]2CCCCC2)C1 ZINC000502864165 911870897 /nfs/dbraw/zinc/87/08/97/911870897.db2.gz SOUICMPDZCGKCP-FGZHOGPDSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000503086834 912057228 /nfs/dbraw/zinc/05/72/28/912057228.db2.gz JLJKXASWARVZML-QPPBQGQZSA-N 2 0 420.601 4.128 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000503129673 912092386 /nfs/dbraw/zinc/09/23/86/912092386.db2.gz CWHXNGUXEUAPEZ-VWLOTQADSA-N 2 0 422.617 4.376 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)c1ccccc1 ZINC000503140914 912103230 /nfs/dbraw/zinc/10/32/30/912103230.db2.gz NFYHCPYIBRWOHP-NZQKXSOJSA-N 2 0 408.590 4.252 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](Cc3ccccn3)c3cccnc3)CC2)cc1 ZINC000513378349 921753934 /nfs/dbraw/zinc/75/39/34/921753934.db2.gz QUVRPVQLKXQYFI-SANMLTNESA-N 2 0 416.569 4.271 20 0 HIADRP c1ccc(C[C@H]([NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c2cccnc2)nc1 ZINC000513404935 921773312 /nfs/dbraw/zinc/77/33/12/921773312.db2.gz PVBYMQZOOBOENN-VWLOTQADSA-N 2 0 402.542 4.025 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1)c1ccccc1 ZINC000506800747 915541789 /nfs/dbraw/zinc/54/17/89/915541789.db2.gz KKMKSJJJXIXWAA-FDFHNCONSA-N 2 0 414.638 4.412 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)C1 ZINC000506919378 915718307 /nfs/dbraw/zinc/71/83/07/915718307.db2.gz SSGHZGQCHLEZOT-AKFKNWHVSA-N 2 0 412.622 4.120 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1 ZINC000506934407 915736747 /nfs/dbraw/zinc/73/67/47/915736747.db2.gz RDOXDGKBZKUMLD-XUZZJYLKSA-N 2 0 414.638 4.324 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC000506948603 915754686 /nfs/dbraw/zinc/75/46/86/915754686.db2.gz GUNKOSXDFWFSKB-URXFXBBRSA-N 2 0 414.638 4.324 20 0 HIADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 ZINC000507447515 916216209 /nfs/dbraw/zinc/21/62/09/916216209.db2.gz IJLCERHIGUMVPF-IBGZPJMESA-N 2 0 421.651 4.070 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)[C@@H]1CCCOC1 ZINC000507459676 916227940 /nfs/dbraw/zinc/22/79/40/916227940.db2.gz GKZOUDJKAQBXLL-RTBURBONSA-N 2 0 413.528 4.012 20 0 HIADRP CCOc1cccc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)c1OC(F)F ZINC000507725081 916519094 /nfs/dbraw/zinc/51/90/94/916519094.db2.gz ZJODJDNEJJHMGI-UHFFFAOYSA-N 2 0 412.521 4.011 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)c1ccc(C[NH+]2CCSCC2)cc1)c1ccccc1 ZINC000508477296 917261538 /nfs/dbraw/zinc/26/15/38/917261538.db2.gz NSSGPVYMBIKGJE-QHCPKHFHSA-N 2 0 411.615 4.048 20 0 HIADRP CC(C)[C@H](N[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1nc(-c2ccncc2)no1 ZINC000508696355 917456945 /nfs/dbraw/zinc/45/69/45/917456945.db2.gz HRVQYTGCRFDTQP-COPCDDAFSA-N 2 0 405.546 4.329 20 0 HIADRP COc1ccccc1[C@H](CN[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCCC1 ZINC000508719493 917480329 /nfs/dbraw/zinc/48/03/29/917480329.db2.gz PYTOVLVQSFMWQS-PWWKTKHKSA-N 2 0 407.602 4.332 20 0 HIADRP C[C@@H]([NH2+]CCc1nc(-c2cccc(Cl)c2)no1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508718487 917480560 /nfs/dbraw/zinc/48/05/60/917480560.db2.gz NULGHKQIEUSAQF-YLJYHZDGSA-N 2 0 410.949 4.433 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@@H](C)[C@@H](c2ccccc2)[NH+](C)C)CC1)CC1CC1 ZINC000508869827 917623693 /nfs/dbraw/zinc/62/36/93/917623693.db2.gz JDBCTVKIKHBRRP-RDPSFJRHSA-N 2 0 414.638 4.221 20 0 HIADRP CC[N@H+](CCC(=O)c1ccc(OC)cc1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000509348103 918012821 /nfs/dbraw/zinc/01/28/21/918012821.db2.gz KEORSPJAYMHMPM-UHFFFAOYSA-N 2 0 424.589 4.481 20 0 HIADRP CC[NH+]1CCN(c2ccccc2C[NH+]2CCC(c3c[nH]c4ncccc34)CC2)CC1 ZINC000509564364 918214319 /nfs/dbraw/zinc/21/43/19/918214319.db2.gz MYGZHIGQSODVEX-UHFFFAOYSA-N 2 0 403.574 4.084 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000509576711 918227070 /nfs/dbraw/zinc/22/70/70/918227070.db2.gz HOAZLIAEMCOBNV-SIKLNZKXSA-N 2 0 412.578 4.015 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)c1oc2ccccc2c1C[NH+](C)C)Cc1ccccc1 ZINC000510375892 918861732 /nfs/dbraw/zinc/86/17/32/918861732.db2.gz HQTQSKQBTTWFPO-FQEVSTJZSA-N 2 0 407.558 4.177 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCc2ccccc2C[NH+]2CCCCC2)[NH+]2CCCC2)o1 ZINC000510463539 918920052 /nfs/dbraw/zinc/92/00/52/918920052.db2.gz SNJDGHWRAFKXSH-QHCPKHFHSA-N 2 0 424.589 4.210 20 0 HIADRP C[C@@H](NC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000510492967 918940643 /nfs/dbraw/zinc/94/06/43/918940643.db2.gz SPARTXZMUMXBDH-NFBKMPQASA-N 2 0 412.622 4.125 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccsc1 ZINC000510535607 918980454 /nfs/dbraw/zinc/98/04/54/918980454.db2.gz FDBAJZRRXPMROX-WAOWUJCRSA-N 2 0 406.640 4.083 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCc2ccc(Br)cc21 ZINC000510943028 919471083 /nfs/dbraw/zinc/47/10/83/919471083.db2.gz HLUDRSNQIYJEQI-IRLDBZIGSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)C(=O)N1CCc2sccc2C1 ZINC000511027590 919601303 /nfs/dbraw/zinc/60/13/03/919601303.db2.gz IMSYJVZVFFLOCC-IBGZPJMESA-N 2 0 411.615 4.043 20 0 HIADRP C[C@H](NC(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000511449128 920058927 /nfs/dbraw/zinc/05/89/27/920058927.db2.gz MZAWBMKKXXFKTF-OZIGNCPNSA-N 2 0 418.651 4.083 20 0 HIADRP C[NH+](C)CCC1CC[NH+](Cc2cn(Cc3ccccc3)nc2-c2cccnc2)CC1 ZINC000511541564 920165557 /nfs/dbraw/zinc/16/55/57/920165557.db2.gz LWLJEIGODNYQEM-UHFFFAOYSA-N 2 0 403.574 4.157 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H](c2cccc(OC)c2)[NH+]2CCCC2)cc1)C1CC1 ZINC000511548919 920178747 /nfs/dbraw/zinc/17/87/47/920178747.db2.gz ZJLILVUKWZPZCE-RUZDIDTESA-N 2 0 421.585 4.246 20 0 HIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)sc1Br ZINC000511926037 920673102 /nfs/dbraw/zinc/67/31/02/920673102.db2.gz JNPUOXPUJJVIFD-RHSMWYFYSA-N 2 0 409.393 4.236 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2cnn(-c3ccc(C(F)(F)F)cc3)c2)cc1 ZINC000512086756 920850224 /nfs/dbraw/zinc/85/02/24/920850224.db2.gz GCMWALDPGVYXOV-UHFFFAOYSA-N 2 0 418.463 4.121 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)c2ccc(C[NH+]3CCSCC3)cc2)[NH+]2CCCC2)cc1 ZINC000512091322 920854532 /nfs/dbraw/zinc/85/45/32/920854532.db2.gz KWWJTGWXBLERFS-XMMPIXPASA-N 2 0 423.626 4.111 20 0 HIADRP CCc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)cn1 ZINC000512123270 920873781 /nfs/dbraw/zinc/87/37/81/920873781.db2.gz NSKIXZOQINKHEP-UHFFFAOYSA-N 2 0 400.570 4.256 20 0 HIADRP C[C@@H]1C[NH+](CC2CC[NH+](Cc3c[nH]nc3-c3cccc(Cl)c3)CC2)C[C@@H](C)O1 ZINC000512178295 920916818 /nfs/dbraw/zinc/91/68/18/920916818.db2.gz IUQWNDSNQDBYRA-IAGOWNOFSA-N 2 0 402.970 4.051 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)c2ccc(C[NH+]3CCSCC3)cc2)c1 ZINC000512267307 921025499 /nfs/dbraw/zinc/02/54/99/921025499.db2.gz OYQRKZKZFMEJLD-UHFFFAOYSA-N 2 0 411.615 4.007 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@H](Cc3ccccn3)c3cccnc3)cc2)C[C@@H](C)O1 ZINC000513500350 921849817 /nfs/dbraw/zinc/84/98/17/921849817.db2.gz MCNMPNBCFVRFCV-IPVFLDMMSA-N 2 0 416.569 4.159 20 0 HIADRP COc1ccc(-c2n[nH]cc2C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513544987 921883867 /nfs/dbraw/zinc/88/38/67/921883867.db2.gz NNYZFZZXMQQLCO-TZIWHRDSSA-N 2 0 404.558 4.476 20 0 HIADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000513545338 921883940 /nfs/dbraw/zinc/88/39/40/921883940.db2.gz PTDLBKYSKGYGJO-JMOSNPTESA-N 2 0 411.977 4.230 20 0 HIADRP C(CN1CCC[N@H+](CC2CCCCC2)CC1)N1CCC[NH+](CC2CCCCC2)CC1 ZINC000514225606 922562804 /nfs/dbraw/zinc/56/28/04/922562804.db2.gz DBMNGQIWOCFZGT-UHFFFAOYSA-N 2 0 418.714 4.162 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)C1 ZINC000514237549 922576854 /nfs/dbraw/zinc/57/68/54/922576854.db2.gz JWUKASKSLVBUOY-HXUWFJFHSA-N 2 0 419.352 4.126 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(=O)NCCc1ccc(F)cc1 ZINC000515518116 923149796 /nfs/dbraw/zinc/14/97/96/923149796.db2.gz QLVCCTUHATWMHQ-VQTJNVASSA-N 2 0 411.565 4.037 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(=O)N1CCc2sccc2C1 ZINC000515757888 923330852 /nfs/dbraw/zinc/33/08/52/923330852.db2.gz VLLRMSFOGIUKAK-RTBURBONSA-N 2 0 411.615 4.043 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCC(C)CC2)CC1 ZINC000516155002 923579210 /nfs/dbraw/zinc/57/92/10/923579210.db2.gz NTNIPPRMTOBRGH-XMMPIXPASA-N 2 0 414.638 4.223 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)N[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)CC1 ZINC000516579887 923800276 /nfs/dbraw/zinc/80/02/76/923800276.db2.gz ZVOWGYPHOBBMDM-OFVILXPXSA-N 2 0 420.601 4.094 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)c1 ZINC000518403097 927243092 /nfs/dbraw/zinc/24/30/92/927243092.db2.gz FNJOGLOWUVPKQC-GBXCKJPGSA-N 2 0 408.590 4.163 20 0 HIADRP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000518591497 927367937 /nfs/dbraw/zinc/36/79/37/927367937.db2.gz KQQIEWWEKBIVPA-FPHQKMJTSA-N 2 0 419.613 4.061 20 0 HIADRP O=C([C@H]1CCC[N@@H+]1Cc1ccccc1)N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000518763632 927481694 /nfs/dbraw/zinc/48/16/94/927481694.db2.gz GKLYMKVQYUDWMP-HSZRJFAPSA-N 2 0 411.977 4.039 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)cc1 ZINC000518771669 927484315 /nfs/dbraw/zinc/48/43/15/927484315.db2.gz KEMJBIQFWPAZMK-UHFFFAOYSA-N 2 0 407.341 4.499 20 0 HIADRP C[C@@H](NC(=O)N(CC[NH+](C)C)CC[NH+](C)C)c1ccccc1-c1ccc(Cl)cc1 ZINC000524922208 929891029 /nfs/dbraw/zinc/89/10/29/929891029.db2.gz YLDIQOVEERGMSU-GOSISDBHSA-N 2 0 416.997 4.203 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccccc2)CC1 ZINC000525311566 930150104 /nfs/dbraw/zinc/15/01/04/930150104.db2.gz MNHISDMXARNQJB-OFVILXPXSA-N 2 0 405.586 4.383 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000525373104 930203219 /nfs/dbraw/zinc/20/32/19/930203219.db2.gz SSKNCQYXAAEDNQ-QHCPKHFHSA-N 2 0 408.590 4.157 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000525383897 930209921 /nfs/dbraw/zinc/20/99/21/930209921.db2.gz FXDJRSQXHIGHSN-DHLKQENFSA-N 2 0 405.586 4.022 20 0 HIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC1 ZINC000525636183 930375945 /nfs/dbraw/zinc/37/59/45/930375945.db2.gz JHJICCRXXMXYJE-INIZCTEOSA-N 2 0 413.528 4.182 20 0 HIADRP Cc1cc(SC2CCCCC2)ccc1NC(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000525884935 930476610 /nfs/dbraw/zinc/47/66/10/930476610.db2.gz DUKBALKXSQQDAF-UHFFFAOYSA-N 2 0 406.640 4.377 20 0 HIADRP COc1ccc([C@@H](CCn2cncn2)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc1 ZINC000526107042 930535828 /nfs/dbraw/zinc/53/58/28/930535828.db2.gz KFPFMGFGESWHHT-RUZDIDTESA-N 2 0 419.573 4.194 20 0 HIADRP Cn1c2ccc(C[NH2+]Cc3ccccc3C[N@H+](C)Cc3ccco3)cc2sc1=O ZINC000527529008 930674324 /nfs/dbraw/zinc/67/43/24/930674324.db2.gz WWNJITKFNIXZJT-UHFFFAOYSA-N 2 0 407.539 4.115 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+]Cc2ccc(-c3cccc(Br)c3)s2)CC1 ZINC000530664696 930790620 /nfs/dbraw/zinc/79/06/20/930790620.db2.gz QKUPYLZLPDWIMT-UHFFFAOYSA-N 2 0 422.436 4.293 20 0 HIADRP COC(=O)c1cc2c(o1)c(OC)ccc2C[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000530664537 930790929 /nfs/dbraw/zinc/79/09/29/930790929.db2.gz BFOQRVBBRVHSTN-UHFFFAOYSA-N 2 0 410.514 4.358 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)Nc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)CC1 ZINC000530727051 930808989 /nfs/dbraw/zinc/80/89/89/930808989.db2.gz QIPQPQPKNVTWSA-LJQANCHMSA-N 2 0 406.574 4.477 20 0 HIADRP COC(=O)c1cc2c(o1)c(OC)ccc2C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000530903154 930854177 /nfs/dbraw/zinc/85/41/77/930854177.db2.gz SKIHTZDNBIBOAJ-UHFFFAOYSA-N 2 0 408.498 4.114 20 0 HIADRP Cc1c(F)cccc1-c1ccc(C[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)o1 ZINC000530953032 930866787 /nfs/dbraw/zinc/86/67/87/930866787.db2.gz WZNXTRPWMQHDBK-UHFFFAOYSA-N 2 0 415.553 4.110 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+]Cc3cnc(-c4ccccc4)nc3)CC2)cc1 ZINC000531142147 930943106 /nfs/dbraw/zinc/94/31/06/930943106.db2.gz SBQRXYNOCWLDER-UHFFFAOYSA-N 2 0 416.569 4.305 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)CC1 ZINC000531442278 931058273 /nfs/dbraw/zinc/05/82/73/931058273.db2.gz COSRVKOQQYQRSN-HXUWFJFHSA-N 2 0 420.601 4.155 20 0 HIADRP Brc1cccc(OCCSCC[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000531715224 931171820 /nfs/dbraw/zinc/17/18/20/931171820.db2.gz CQEJMNKLPVONQL-UHFFFAOYSA-N 2 0 413.425 4.025 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccccc1C[NH+]1CCCCC1)C1CC[NH+](C)CC1 ZINC000531851109 931221064 /nfs/dbraw/zinc/22/10/64/931221064.db2.gz ZCXFAZOJSMHIHE-UHFFFAOYSA-N 3 0 420.645 4.493 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]Cc1cccc(Cn2ccnc2)c1 ZINC000531940176 931255349 /nfs/dbraw/zinc/25/53/49/931255349.db2.gz ORGADIKZLFZOJV-GOSISDBHSA-N 2 0 410.949 4.112 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+]C2CCN(Cc3c(F)cccc3Cl)CC2)c1 ZINC000531955338 931263255 /nfs/dbraw/zinc/26/32/55/931263255.db2.gz KPJKRRGIACSLTN-UHFFFAOYSA-N 2 0 419.972 4.174 20 0 HIADRP C[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000531958751 931264283 /nfs/dbraw/zinc/26/42/83/931264283.db2.gz WWQBFNWPRUFLDK-XMSQKQJNSA-N 2 0 421.507 4.267 20 0 HIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)C1 ZINC000531958626 931264307 /nfs/dbraw/zinc/26/43/07/931264307.db2.gz QRUFTPQHSHRQFI-JKSUJKDBSA-N 2 0 401.473 4.012 20 0 HIADRP CCOc1ccc([C@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1OCC ZINC000531965222 931268412 /nfs/dbraw/zinc/26/84/12/931268412.db2.gz YQAUSEAASKQFDS-REWPJTCUSA-N 2 0 411.590 4.123 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000531993722 931278985 /nfs/dbraw/zinc/27/89/85/931278985.db2.gz CNMAATDNOAHERB-SFHVURJKSA-N 2 0 406.014 4.464 20 0 HIADRP O[C@H]1CCC[C@H]1[NH+]1CCC([NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000532016106 931285682 /nfs/dbraw/zinc/28/56/82/931285682.db2.gz QHFBIUMEIHLIGW-RPWUZVMVSA-N 2 0 414.977 4.386 20 0 HIADRP CN(c1ccccc1C[NH2+]CCc1coc(-c2ccc(F)cc2)n1)C1CC[NH+](C)CC1 ZINC000532104649 931313215 /nfs/dbraw/zinc/31/32/15/931313215.db2.gz MMHXELCRFRHDTO-UHFFFAOYSA-N 2 0 422.548 4.343 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(Br)cc1 ZINC000532194110 931344124 /nfs/dbraw/zinc/34/41/24/931344124.db2.gz AJHCPOZWVUGEQY-QGZVFWFLSA-N 2 0 402.380 4.047 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@H](c1ccco1)N1CCCCC1)C1CC[NH+](C)CC1 ZINC000532361651 931409471 /nfs/dbraw/zinc/40/94/71/931409471.db2.gz IENKXAUYSVAZEG-XMMPIXPASA-N 2 0 410.606 4.127 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](Cc3cccc(F)c3)c3cccc(F)c3)cn2)CC1 ZINC000532452111 931440829 /nfs/dbraw/zinc/44/08/29/931440829.db2.gz SIQVGCVPCMWJHA-DEOSSOPVSA-N 2 0 422.523 4.185 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)C[NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000532478441 931454479 /nfs/dbraw/zinc/45/44/79/931454479.db2.gz BLEWFUFLSMNSGK-QZTJIDSGSA-N 2 0 406.014 4.291 20 0 HIADRP C[NH+](C)CCC1CC[NH+](CC(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)CC1 ZINC000532486447 931457484 /nfs/dbraw/zinc/45/74/84/931457484.db2.gz UMUKOOQVHCJJEK-XMMPIXPASA-N 2 0 413.993 4.209 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccnc2)C1 ZINC000532566855 931528792 /nfs/dbraw/zinc/52/87/92/931528792.db2.gz TZOIRPIHQSZDFO-OAQYLSRUSA-N 2 0 403.574 4.392 20 0 HIADRP COc1ccc2cc(CN(C)C(=O)[C@H](C)N3CCC[C@@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000532586055 931542375 /nfs/dbraw/zinc/54/23/75/931542375.db2.gz UDGBYEBMNUELKC-GBXCKJPGSA-N 2 0 423.601 4.146 20 0 HIADRP Cc1ccc(COc2ccc(C[NH2+]C3CC[NH+]([C@H]4CCCC[C@H]4O)CC3)cc2)cc1 ZINC000532628284 931560468 /nfs/dbraw/zinc/56/04/68/931560468.db2.gz FJMJODCVSYMLRQ-IZZNHLLZSA-N 2 0 408.586 4.432 20 0 HIADRP NC(=O)c1csc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000532680434 931580706 /nfs/dbraw/zinc/58/07/06/931580706.db2.gz GKQGKPSHEQRRSC-UHFFFAOYSA-N 2 0 405.567 4.400 20 0 HIADRP COC(=O)c1ccc(-c2nc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)cs2)cc1 ZINC000532950345 931708613 /nfs/dbraw/zinc/70/86/13/931708613.db2.gz YNSQNHVJBJNNNO-UHFFFAOYSA-N 2 0 401.576 4.149 20 0 HIADRP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000533435485 931867732 /nfs/dbraw/zinc/86/77/32/931867732.db2.gz FDKRURJTLLULCF-DPLHUUCSSA-N 2 0 405.586 4.034 20 0 HIADRP C[C@H]([NH2+][C@@H](c1ccccc1)C1CCC1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000533505606 931887415 /nfs/dbraw/zinc/88/74/15/931887415.db2.gz RAXYRQYRCGTWKN-CPJSRVTESA-N 2 0 405.586 4.287 20 0 HIADRP CC(C)[C@H](NC(=O)N(C)[C@H]1CCCC[C@H]1[N@H+](C)C1CCN(C)CC1)c1ccccc1 ZINC000533663239 931956125 /nfs/dbraw/zinc/95/61/25/931956125.db2.gz WKWAYJVJJZFCLD-SGNDLWITSA-N 2 0 414.638 4.362 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N2CC[C@H](C3CC[NH+](C)CC3)C2)c1 ZINC000533780581 932029682 /nfs/dbraw/zinc/02/96/82/932029682.db2.gz HMNQVQNRTGAUTI-DEOSSOPVSA-N 2 0 414.638 4.182 20 0 HIADRP C[C@@H](C(=O)N1CCc2sccc2C1)[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534232747 932353421 /nfs/dbraw/zinc/35/34/21/932353421.db2.gz OKPBXOSPCOJGTD-FQEVSTJZSA-N 2 0 423.626 4.009 20 0 HIADRP Cc1ccc(-n2cc(C[NH2+]Cc3ccnc(OCC[NH+](C)C)c3)c(C(C)(C)C)n2)cc1 ZINC000534240206 932359077 /nfs/dbraw/zinc/35/90/77/932359077.db2.gz QRIQLMPCSVSYPY-UHFFFAOYSA-N 2 0 421.589 4.103 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)NC[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000534243186 932362001 /nfs/dbraw/zinc/36/20/01/932362001.db2.gz VVCNJHKMYDZIGZ-UTKZUKDTSA-N 2 0 418.944 4.355 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000535088115 932902104 /nfs/dbraw/zinc/90/21/04/932902104.db2.gz LKMDICAXOAVKIA-ATIYNZHBSA-N 2 0 407.602 4.082 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)NC[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000535683633 933337349 /nfs/dbraw/zinc/33/73/49/933337349.db2.gz LANITUWAVVHCAH-UWJYYQICSA-N 2 0 424.992 4.036 20 0 HIADRP Cn1nccc1[C@H]1CCC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000562617680 945109028 /nfs/dbraw/zinc/10/90/28/945109028.db2.gz RXEIXVROQPOISE-XZOQPEGZSA-N 2 0 410.606 4.107 20 0 HIADRP Cc1nn(-c2ccccc2)c(C)c1C[N@@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000537621617 938336883 /nfs/dbraw/zinc/33/68/83/938336883.db2.gz ASVNUOWRUBDRGW-UHFFFAOYSA-N 2 0 423.649 4.117 20 0 HIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]C[C@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000537737122 938366244 /nfs/dbraw/zinc/36/62/44/938366244.db2.gz QPDUMBZWLGVKPI-HYBUGGRVSA-N 2 0 413.993 4.349 20 0 HIADRP C[C@@H](C(=O)Nc1cc(Cl)ccc1F)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537840727 938387126 /nfs/dbraw/zinc/38/71/26/938387126.db2.gz FPHGXBXXJITISE-INIZCTEOSA-N 2 0 418.944 4.440 20 0 HIADRP CCOc1cc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)ccc1OCC(F)(F)F ZINC000537870139 938395468 /nfs/dbraw/zinc/39/54/68/938395468.db2.gz QLUPHXQHTRVTRC-UHFFFAOYSA-N 2 0 423.479 4.428 20 0 HIADRP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)C[N@@H+]1Cc1ccccc1 ZINC000537940331 938425425 /nfs/dbraw/zinc/42/54/25/938425425.db2.gz FMLUBHJBJKFMRS-IDKQNPPTSA-N 2 0 406.618 4.182 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc2c(c1)CCCC2 ZINC000537968333 938439625 /nfs/dbraw/zinc/43/96/25/938439625.db2.gz BIOJKBIURYLLAW-HXUWFJFHSA-N 2 0 405.586 4.242 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H]2CCSc3ccc(Br)cc32)C[C@H](C)O1 ZINC000537973555 938442568 /nfs/dbraw/zinc/44/25/68/938442568.db2.gz PGXRRXMCGGLINY-RVKKMQEKSA-N 2 0 413.425 4.465 20 0 HIADRP CCc1ccc([C@@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)C(C)C)cc1 ZINC000538101203 938502379 /nfs/dbraw/zinc/50/23/79/938502379.db2.gz NEIQNFMGMXRAIP-DQEYMECFSA-N 2 0 407.602 4.433 20 0 HIADRP COc1ccc(C[C@H](C)C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1OC ZINC000538308473 938589277 /nfs/dbraw/zinc/58/92/77/938589277.db2.gz UYICYLIYDWSYEW-UGKGYDQZSA-N 2 0 424.585 4.460 20 0 HIADRP CCc1c2ccccc2oc1[C@H](C)[NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1 ZINC000538394194 938609920 /nfs/dbraw/zinc/60/99/20/938609920.db2.gz RHRIGHWOBUEWOX-IBGZPJMESA-N 2 0 407.562 4.038 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H](CC3CCC3)c3ccccc3)c2)C1 ZINC000538396287 938610741 /nfs/dbraw/zinc/61/07/41/938610741.db2.gz YKCSVOUOSNJIMV-LOSJGSFVSA-N 2 0 405.586 4.405 20 0 HIADRP Cc1cc(Br)cc2cc([C@@H]([NH2+]C[C@@H](C)N3CC[NH+](C)CC3)C(C)C)oc21 ZINC000538445438 938623905 /nfs/dbraw/zinc/62/39/05/938623905.db2.gz LKBXJKGBVLDQIT-UZLBHIALSA-N 2 0 422.411 4.426 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccn1 ZINC000538610685 938661072 /nfs/dbraw/zinc/66/10/72/938661072.db2.gz NMAGIADIIBYNLO-UHFFFAOYSA-N 2 0 421.385 4.349 20 0 HIADRP CCn1c2ccccc2c2cc(C[N@@H+]3CC[C@@H](N4CC[NH+](C)CC4)[C@@H](C)C3)ccc21 ZINC000538724190 938692166 /nfs/dbraw/zinc/69/21/66/938692166.db2.gz XDNXJWQEHCYYBS-GBXCKJPGSA-N 2 0 404.602 4.272 20 0 HIADRP C/C(=C/c1ccccc1)C[NH+]1CCC(C(=O)NCC[N@@H+](C)Cc2ccccc2)CC1 ZINC000538734839 938696673 /nfs/dbraw/zinc/69/66/73/938696673.db2.gz GCXWVZOCFWBNLL-QOCHGBHMSA-N 2 0 405.586 4.050 20 0 HIADRP C[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1ccccc1N(C)C ZINC000538747068 938700417 /nfs/dbraw/zinc/70/04/17/938700417.db2.gz ZSTWBEKMTHOKJR-QGZVFWFLSA-N 2 0 420.523 4.374 20 0 HIADRP COc1ccccc1-c1ccc(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC000538761678 938704401 /nfs/dbraw/zinc/70/44/01/938704401.db2.gz TWPVQSISXLLFFA-UHFFFAOYSA-N 2 0 407.602 4.353 20 0 HIADRP COCCc1nc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)s1 ZINC000538867697 938728149 /nfs/dbraw/zinc/72/81/49/938728149.db2.gz PFXTXNFIXDWDED-BZSNNMDCSA-N 2 0 417.619 4.100 20 0 HIADRP COc1ccccc1NC(=O)C[C@H](C)[NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000539045982 938781154 /nfs/dbraw/zinc/78/11/54/938781154.db2.gz DTXHHRTUGMPMBE-ONTIZHBOSA-N 2 0 409.574 4.303 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCc3c2cccc3Br)CC1 ZINC000539217189 938820148 /nfs/dbraw/zinc/82/01/48/938820148.db2.gz KYJUUAAZOWRKBM-QFIPXVFZSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@H]1C[N@H+](CCOc2ccc(CC[NH2+]C3CC[NH+](C4CCCC4)CC3)cc2)C[C@H]1C ZINC000539296034 938835643 /nfs/dbraw/zinc/83/56/43/938835643.db2.gz WKCUQMGNXVISJD-SZPZYZBQSA-N 3 0 413.650 4.192 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccccc2OC(F)F)CC1 ZINC000539309865 938838585 /nfs/dbraw/zinc/83/85/85/938838585.db2.gz BNRRPYIXZKMAQD-INIZCTEOSA-N 2 0 407.480 4.420 20 0 HIADRP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000539497367 938868837 /nfs/dbraw/zinc/86/88/37/938868837.db2.gz YUWZYSIPUSWTNT-GOSISDBHSA-N 2 0 407.558 4.446 20 0 HIADRP CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)cc1 ZINC000539609426 938887603 /nfs/dbraw/zinc/88/76/03/938887603.db2.gz GXDZGKACNAGTGV-LOSJGSFVSA-N 2 0 423.601 4.191 20 0 HIADRP COCCOCc1ccc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000563564202 945216615 /nfs/dbraw/zinc/21/66/15/945216615.db2.gz HYMZEPATNBSPIU-KKUQBAQOSA-N 2 0 408.586 4.240 20 0 HIADRP COCCc1nc(C)c([C@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000539969966 938982568 /nfs/dbraw/zinc/98/25/68/938982568.db2.gz YIBSXNMBGHPVHP-WCIYBSDLSA-N 2 0 401.620 4.448 20 0 HIADRP COCCc1nc(C)c([C@H](C)[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)s1 ZINC000539969962 938982641 /nfs/dbraw/zinc/98/26/41/938982641.db2.gz YIBSXNMBGHPVHP-LMMKCTJWSA-N 2 0 401.620 4.448 20 0 HIADRP C[N@H+](CCCc1nc(-c2cccs2)no1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540045531 939048545 /nfs/dbraw/zinc/04/85/45/939048545.db2.gz QJZHZKVXGSUUOV-UHFFFAOYSA-N 2 0 411.575 4.364 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cnn1-c1cccc(Cl)c1 ZINC000540158110 939095033 /nfs/dbraw/zinc/09/50/33/939095033.db2.gz JAPDIKFBCIQRKR-INIZCTEOSA-N 2 0 413.953 4.020 20 0 HIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1nc2ccc(Cl)cc2n1C ZINC000540301329 939187065 /nfs/dbraw/zinc/18/70/65/939187065.db2.gz VRQFRFIXVWSZHG-MRXNPFEDSA-N 2 0 400.954 4.060 20 0 HIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000540476193 939267298 /nfs/dbraw/zinc/26/72/98/939267298.db2.gz YQKONADDKTWQRM-XMMPIXPASA-N 3 0 423.601 4.095 20 0 HIADRP c1ccc(C[N@@H+]2CCC[C@H]2C2CCOCC2)c(C[NH+]2CCC[C@@H]2C2CCOCC2)c1 ZINC000540826857 939386344 /nfs/dbraw/zinc/38/63/44/939386344.db2.gz FLKYNEWMAHQREJ-WMPKNSHKSA-N 2 0 412.618 4.469 20 0 HIADRP COc1cccc(C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccccc2)c1 ZINC000540990387 939426400 /nfs/dbraw/zinc/42/64/00/939426400.db2.gz JWQFXNYTDIMRRE-AHKZPQOWSA-N 2 0 416.565 4.335 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@@H](c2ccc(F)cc2)c2ccccn2)[C@@H](c2ccccc2)C1 ZINC000541548453 939551866 /nfs/dbraw/zinc/55/18/66/939551866.db2.gz DYCPSSGCZPPZII-FTJBHMTQSA-N 2 0 418.560 4.279 20 0 HIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCCc3nc(-c4ccc(F)cc4)no3)CC2)C1 ZINC000541553730 939553523 /nfs/dbraw/zinc/55/35/23/939553523.db2.gz MFWSHWHCJJKNQD-UWJYYQICSA-N 2 0 400.542 4.441 20 0 HIADRP C[C@@H]1CCN(C(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000541572521 939558154 /nfs/dbraw/zinc/55/81/54/939558154.db2.gz PYPFSGHCHRVZAR-HSZRJFAPSA-N 2 0 419.613 4.412 20 0 HIADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)N(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000541573549 939558378 /nfs/dbraw/zinc/55/83/78/939558378.db2.gz NCKHXQGVBGINTF-PKOBYXMFSA-N 2 0 413.528 4.066 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](c3ccccc3)c3ccc(Cl)cc3)cn2)CC1 ZINC000541844437 939646518 /nfs/dbraw/zinc/64/65/18/939646518.db2.gz MZMQZLBAWXKKQW-DEOSSOPVSA-N 2 0 406.961 4.366 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(F)c(Br)c1 ZINC000541913973 939652353 /nfs/dbraw/zinc/65/23/53/939652353.db2.gz FTCBWAREEFCMNT-BEFAXECRSA-N 2 0 421.354 4.396 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)c1 ZINC000541933164 939657258 /nfs/dbraw/zinc/65/72/58/939657258.db2.gz YLRAPOBTBKXAOI-UHFFFAOYSA-N 3 0 412.666 4.284 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CN1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000542466498 939828003 /nfs/dbraw/zinc/82/80/03/939828003.db2.gz MIVRIGXEZPMGKZ-RUZDIDTESA-N 2 0 401.558 4.064 20 0 HIADRP CC1(C(=O)N2CCC[N@H+](CC3CCCCC3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000542504198 939833907 /nfs/dbraw/zinc/83/39/07/939833907.db2.gz YDFSSYSIEUGPPA-UHFFFAOYSA-N 2 0 411.634 4.403 20 0 HIADRP CC1(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC[NH+](Cc2ccccc2)CC1 ZINC000542512245 939835096 /nfs/dbraw/zinc/83/50/96/939835096.db2.gz XKOGQKQXRGTSNP-UHFFFAOYSA-N 2 0 405.586 4.201 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(Br)cc1 ZINC000542852108 939863288 /nfs/dbraw/zinc/86/32/88/939863288.db2.gz QOPMHNBWZZXDDJ-IERDGZPVSA-N 2 0 403.364 4.257 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NC[C@@H](c2ccc(C)o2)[NH+]2CCCC2)CC1 ZINC000542978337 939890209 /nfs/dbraw/zinc/89/02/09/939890209.db2.gz DFZZBMQOSWNELA-QFIPXVFZSA-N 2 0 418.626 4.269 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)Cc2ccn(C(C)C)n2)CC1 ZINC000543075846 939927778 /nfs/dbraw/zinc/92/77/78/939927778.db2.gz RDWYBDXNGPSBKA-RBUKOAKNSA-N 2 0 401.574 4.027 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]C2CC(c3cccc(F)c3)C2)c1)C1CCOCC1 ZINC000543102838 939945597 /nfs/dbraw/zinc/94/55/97/939945597.db2.gz BEVOFWKXOSGJAB-UHFFFAOYSA-N 2 0 412.549 4.351 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)c1 ZINC000543431440 940062159 /nfs/dbraw/zinc/06/21/59/940062159.db2.gz HSJWLDALSIZTKV-UHFFFAOYSA-N 2 0 407.602 4.447 20 0 HIADRP CSC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(C(F)(F)F)cc1 ZINC000543777276 940183740 /nfs/dbraw/zinc/18/37/40/940183740.db2.gz SUMUXYKUMDZXMQ-LEWJYISDSA-N 2 0 424.532 4.466 20 0 HIADRP CC1(C(=O)N2CCC[N@H+](Cc3ccccc3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000544374033 940405130 /nfs/dbraw/zinc/40/51/30/940405130.db2.gz QPDUYJFZUBORKV-UHFFFAOYSA-N 2 0 405.586 4.023 20 0 HIADRP Cc1ccc(-c2noc(CCC[NH2+][C@@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)n2)cc1F ZINC000544421240 940420236 /nfs/dbraw/zinc/42/02/36/940420236.db2.gz KDOREKWDHMLNQR-PKOBYXMFSA-N 2 0 400.542 4.359 20 0 HIADRP Cc1ccc(S(=O)(=O)C[C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000544604857 940489044 /nfs/dbraw/zinc/48/90/44/940489044.db2.gz JQVFPWJEMWEQFM-FUDKSRODSA-N 2 0 414.615 4.048 20 0 HIADRP CCN(C(=O)c1ccc(C[NH+](CC)C2CC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000546183368 940723241 /nfs/dbraw/zinc/72/32/41/940723241.db2.gz CLGZVXAAXWVWHI-VWLOTQADSA-N 2 0 405.586 4.408 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(N2CCOCC2)c1 ZINC000564007636 945346413 /nfs/dbraw/zinc/34/64/13/945346413.db2.gz KDGOFWWBGFDPBM-LADGPHEKSA-N 2 0 407.602 4.476 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(c2nc(-c3cccc(C[NH+]4CCCC4)c3)no2)CC1 ZINC000547092679 940992012 /nfs/dbraw/zinc/99/20/12/940992012.db2.gz WNOYWOCXZBCGDU-UHFFFAOYSA-N 2 0 403.530 4.420 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@H]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000547363107 941058620 /nfs/dbraw/zinc/05/86/20/941058620.db2.gz PEXLMQWPYMLLCS-RPWUZVMVSA-N 2 0 409.549 4.077 20 0 HIADRP COc1ccc(CC[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC(F)F ZINC000547504555 941066130 /nfs/dbraw/zinc/06/61/30/941066130.db2.gz OPCBJSLIOAKIJF-XLIONFOSSA-N 2 0 404.501 4.339 20 0 HIADRP C[C@@H](NCC1([NH2+][C@@H](C)c2ccccc2)CCOCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547503075 941066202 /nfs/dbraw/zinc/06/62/02/941066202.db2.gz CADBTYNOXCSKBC-MVERNJQCSA-N 2 0 421.629 4.387 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1cccc(Cl)c1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547827710 941077425 /nfs/dbraw/zinc/07/74/25/941077425.db2.gz XCGNEORNQOMSFL-UHOSZYNNSA-N 2 0 423.384 4.233 20 0 HIADRP Cc1cc(NC(=O)CC[N@@H+](C)C2CCCCC2)n([C@@H]2CC[NH+](Cc3ccccc3)C2)n1 ZINC000548392580 941099392 /nfs/dbraw/zinc/09/93/92/941099392.db2.gz IJYJFUHIOBEVKP-HSZRJFAPSA-N 2 0 423.605 4.232 20 0 HIADRP c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+][C@@H]3CCC34CCOCC4)CC2)cc1 ZINC000548794467 941124242 /nfs/dbraw/zinc/12/42/42/941124242.db2.gz GHZDRIGUVOESRP-RUZDIDTESA-N 2 0 405.586 4.058 20 0 HIADRP Cc1ccc(C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(-c2cnn(C)c2)c1 ZINC000549401650 941186432 /nfs/dbraw/zinc/18/64/32/941186432.db2.gz RMIOSQUBVDHWJN-OYRHEFFESA-N 2 0 410.606 4.107 20 0 HIADRP Cc1ccc(Nc2nc(CN3CCC(CC[NH+]4CCOCC4)CC3)cs2)cc1 ZINC000549582362 941200350 /nfs/dbraw/zinc/20/03/50/941200350.db2.gz IMKOYABRMAIFBW-UHFFFAOYSA-N 2 0 400.592 4.129 20 0 HIADRP CC(C)Cc1ncc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)s1 ZINC000549867703 941220924 /nfs/dbraw/zinc/22/09/24/941220924.db2.gz BDCOJKALDCXFKC-NRFANRHFSA-N 2 0 413.631 4.360 20 0 HIADRP COc1ccccc1C[C@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550885983 941379116 /nfs/dbraw/zinc/37/91/16/941379116.db2.gz LSSPVCCWZRKLKO-XUZZJYLKSA-N 2 0 408.586 4.145 20 0 HIADRP COc1ccccc1C[C@@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550885981 941379367 /nfs/dbraw/zinc/37/93/67/941379367.db2.gz LSSPVCCWZRKLKO-QPPBQGQZSA-N 2 0 408.586 4.145 20 0 HIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551264485 941438659 /nfs/dbraw/zinc/43/86/59/941438659.db2.gz ZVFYMHYDLCRNKA-TUSQITKMSA-N 2 0 408.586 4.281 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+][C@H]3CCC[C@@H]3c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000551787873 941545395 /nfs/dbraw/zinc/54/53/95/941545395.db2.gz NSIOVEGMQVEVDK-YADHBBJMSA-N 2 0 409.540 4.490 20 0 HIADRP FC(F)(F)Cn1cc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000552034834 941571096 /nfs/dbraw/zinc/57/10/96/941571096.db2.gz GQWGNWUDERGHAL-PCCBWWKXSA-N 2 0 406.496 4.226 20 0 HIADRP CC[C@H]([NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)c1ccc(Cl)cc1 ZINC000553231276 941853396 /nfs/dbraw/zinc/85/33/96/941853396.db2.gz BEPYRFKQSHJJJQ-QHCPKHFHSA-N 2 0 413.993 4.470 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)C[C@H](c1ncc[nH]1)c1ccccc1 ZINC000553497733 941896060 /nfs/dbraw/zinc/89/60/60/941896060.db2.gz HGLFZSONWPWYKO-VWNXMTODSA-N 2 0 416.569 4.302 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(NC2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)c1 ZINC000554392359 942124410 /nfs/dbraw/zinc/12/44/10/942124410.db2.gz MUAWPPYFXQOQPV-AUSIDOKSSA-N 2 0 400.611 4.422 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1c(Cl)cccc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554537828 942165002 /nfs/dbraw/zinc/16/50/02/942165002.db2.gz QEKQCYMCAGZHRB-YTQUADARSA-N 2 0 423.384 4.233 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000554738025 942215385 /nfs/dbraw/zinc/21/53/85/942215385.db2.gz IXPWYMIGPGEDEM-QFIPXVFZSA-N 2 0 410.606 4.070 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H](c1ccc(Br)cc1)C1CC1 ZINC000554743216 942217807 /nfs/dbraw/zinc/21/78/07/942217807.db2.gz YWNMXNPLIAYKOS-NRFANRHFSA-N 2 0 418.379 4.416 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(Cc2ccc(F)cc2Cl)CCOCC1 ZINC000555638232 942683950 /nfs/dbraw/zinc/68/39/50/942683950.db2.gz RHQHXYJUPRATHV-UHFFFAOYSA-N 2 0 414.912 4.250 20 0 HIADRP Cc1ccccc1[C@H](OC[C@@H](O)C[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccccc1 ZINC000555889362 942767576 /nfs/dbraw/zinc/76/75/76/942767576.db2.gz RMOXWMKMSOWOIQ-LADGPHEKSA-N 2 0 410.602 4.361 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccccc3N3CCO[C@@H](C)C3)cc2)C1 ZINC000555908777 942771163 /nfs/dbraw/zinc/77/11/63/942771163.db2.gz OSDPKTSVJSNSBX-VXKWHMMOSA-N 2 0 407.602 4.433 20 0 HIADRP CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(C(=O)OC)cc1 ZINC000556076138 942801523 /nfs/dbraw/zinc/80/15/23/942801523.db2.gz KFYQMXLHYUOQJI-HTAPYJJXSA-N 2 0 413.537 4.166 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCc4sc(Br)cc43)cc2)CC1 ZINC000556075685 942801617 /nfs/dbraw/zinc/80/16/17/942801617.db2.gz CRZDIDIUYFFVOA-SFHVURJKSA-N 2 0 421.404 4.244 20 0 HIADRP C[C@H]([NH2+]C1(CN[C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCOCC1)c1ccccc1 ZINC000556093674 942804600 /nfs/dbraw/zinc/80/46/00/942804600.db2.gz LFDMRBDOLWAGOB-TUSQITKMSA-N 2 0 407.602 4.312 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000556169808 942813454 /nfs/dbraw/zinc/81/34/54/942813454.db2.gz FVQIRPVQUNYBMU-AEFFLSMTSA-N 2 0 421.404 4.244 20 0 HIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1F ZINC000556234191 942824460 /nfs/dbraw/zinc/82/44/60/942824460.db2.gz VMOGMJHNHNLPGY-UGKGYDQZSA-N 2 0 412.549 4.414 20 0 HIADRP C[C@@H](C[NH2+][C@H](c1sccc1Br)C1CCCCC1)N1CC[NH+](C)CC1 ZINC000556584296 942907149 /nfs/dbraw/zinc/90/71/49/942907149.db2.gz UCCUCUJVQDBUKU-YJBOKZPZSA-N 2 0 414.457 4.358 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H]3CCC[C@@H]3c3cccc(C(F)(F)F)c3)ccn2)CC1 ZINC000556587145 942907354 /nfs/dbraw/zinc/90/73/54/942907354.db2.gz OKXXYLYXAJFJDH-RTWAWAEBSA-N 2 0 418.507 4.278 20 0 HIADRP COc1cc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)ccc1OC(F)F ZINC000556731365 942930927 /nfs/dbraw/zinc/93/09/27/942930927.db2.gz IGHKZSUMSYOBPJ-GOSISDBHSA-N 2 0 418.484 4.374 20 0 HIADRP COc1cc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)ccc1OC(F)F ZINC000556731369 942931370 /nfs/dbraw/zinc/93/13/70/942931370.db2.gz IGHKZSUMSYOBPJ-SFHVURJKSA-N 2 0 418.484 4.374 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]CCCOCC4CCOCC4)[C@H]3C2)cc1 ZINC000556870755 942945556 /nfs/dbraw/zinc/94/55/56/942945556.db2.gz JAYFZMMRIYHJMI-CCDWMCETSA-N 2 0 400.607 4.100 20 0 HIADRP COC(=O)[C@@H](C)Oc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000556882374 942950071 /nfs/dbraw/zinc/95/00/71/942950071.db2.gz FPBRRHDKZHVKAZ-OAQYLSRUSA-N 2 0 422.569 4.115 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+](Cc2cc3cc(F)ccc3o2)CC1)Cc1ccccc1 ZINC000556887682 942951908 /nfs/dbraw/zinc/95/19/08/942951908.db2.gz BHLWGYAMXPUSCJ-UHFFFAOYSA-N 2 0 423.532 4.032 20 0 HIADRP CC(C)(C)[C@@H]([NH2+]CC(=O)NC1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000557522240 943190071 /nfs/dbraw/zinc/19/00/71/943190071.db2.gz RXKGRRMXNYWARZ-FQEVSTJZSA-N 2 0 411.512 4.125 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1ccc(Cl)cc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000558482671 943571078 /nfs/dbraw/zinc/57/10/78/943571078.db2.gz ZMOLJYHXGDIOJT-HQRMLTQVSA-N 2 0 423.384 4.233 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1ccc2ccccc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000558482499 943571167 /nfs/dbraw/zinc/57/11/67/943571167.db2.gz DFLBOAAGCNZDRL-BUUDZMLXSA-N 2 0 404.554 4.080 20 0 HIADRP Cc1cc(N2CCC(CC[NH+]3CCOCC3)CC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000558525244 943588574 /nfs/dbraw/zinc/58/85/74/943588574.db2.gz YVOURIQACWISDP-UHFFFAOYSA-N 2 0 405.489 4.083 20 0 HIADRP Brc1ccc2c(c1)CCCC[C@H]2[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000558972620 943777082 /nfs/dbraw/zinc/77/70/82/943777082.db2.gz WYIYEMGLSZZHHR-IIBYNOLFSA-N 2 0 407.396 4.307 20 0 HIADRP Cc1c2cccc(Cl)c2sc1C[NH2+]C1C[C@H]2CC[C@@H](C1)N2CC(=O)N(C)C ZINC000559303284 943893228 /nfs/dbraw/zinc/89/32/28/943893228.db2.gz OKESAHSKXLCRJB-MQVJKMGUSA-N 2 0 405.995 4.036 20 0 HIADRP COCCC1(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)CCCCC1 ZINC000559330067 943897001 /nfs/dbraw/zinc/89/70/01/943897001.db2.gz JBISYLMYJWDQNP-XMMPIXPASA-N 2 0 414.634 4.492 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c(OC)c1 ZINC000559892165 944077983 /nfs/dbraw/zinc/07/79/83/944077983.db2.gz WOLOIPYKMNQNRP-IFMALSPDSA-N 2 0 424.585 4.283 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3cnc(OC)c(Cl)c3)CC2)cc1 ZINC000560244090 944206247 /nfs/dbraw/zinc/20/62/47/944206247.db2.gz VQAPNIJMJGDPKY-MRXNPFEDSA-N 2 0 403.954 4.315 20 0 HIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c2ccccc21 ZINC000560266727 944212451 /nfs/dbraw/zinc/21/24/51/944212451.db2.gz PUKYZIUFDYUZAN-RPBOFIJWSA-N 2 0 422.569 4.431 20 0 HIADRP COCC[C@@H](Cc1cccc(F)c1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000560268351 944213277 /nfs/dbraw/zinc/21/32/77/944213277.db2.gz LKOVKFWLNNKGRK-QFIPXVFZSA-N 2 0 400.538 4.036 20 0 HIADRP Cc1cccc(NC(=O)C[C@@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c1C ZINC000560269326 944214280 /nfs/dbraw/zinc/21/42/80/944214280.db2.gz VIPNWJUZBFQJGV-LJQANCHMSA-N 2 0 409.574 4.283 20 0 HIADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(C)c1OC ZINC000560528592 944244096 /nfs/dbraw/zinc/24/40/96/944244096.db2.gz JEEAAROPGJRKMS-MSOLQXFVSA-N 2 0 415.553 4.315 20 0 HIADRP Cc1ccc([C@@H]([NH2+]C2CCC([NH+](C)C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000560543239 944248712 /nfs/dbraw/zinc/24/87/12/944248712.db2.gz BLNQFARLUUNQEQ-VUNKPPBISA-N 2 0 414.615 4.259 20 0 HIADRP C[S@](=O)Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000560558444 944254273 /nfs/dbraw/zinc/25/42/73/944254273.db2.gz QNVLAYIGXPPGLC-ZTVFFDQVSA-N 2 0 410.627 4.346 20 0 HIADRP CCOc1ccc([C@H](CC)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1OCC ZINC000560921731 944370156 /nfs/dbraw/zinc/37/01/56/944370156.db2.gz ZGSWFPDRSPPLAX-FDFHNCONSA-N 2 0 404.595 4.293 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)C[C@H](c2ncc[nH]2)c2ccccc2)C1 ZINC000561155227 944485171 /nfs/dbraw/zinc/48/51/71/944485171.db2.gz GUQODTSWVOJLDT-RDPSFJRHSA-N 2 0 416.569 4.480 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H](c2ccc(F)c(C)c2)C2CC2)CC1 ZINC000561371099 944564915 /nfs/dbraw/zinc/56/49/15/944564915.db2.gz FIJXVRZMOWTOLQ-AREMUKBSSA-N 2 0 423.576 4.264 20 0 HIADRP C[C@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000561502688 944639916 /nfs/dbraw/zinc/63/99/16/944639916.db2.gz SORSEMMPOMZLPR-GBXCKJPGSA-N 2 0 412.622 4.219 20 0 HIADRP CCC[NH+](C)[C@H](CNC(=O)N1CC[C@@H](C[N@@H+](C)CCC)C1)c1ccc(Cl)cc1 ZINC000561872220 944829922 /nfs/dbraw/zinc/82/99/22/944829922.db2.gz ZPEDLAYDJAOEHD-GHTZIAJQSA-N 2 0 409.018 4.096 20 0 HIADRP C[C@@H]1CCCC[NH+]1CCC(=O)Nc1cccc(NC(=O)CC[N@H+]2CCCC[C@H]2C)c1 ZINC000562025717 944900473 /nfs/dbraw/zinc/90/04/73/944900473.db2.gz YPTFZRLRYMHIIG-WOJBJXKFSA-N 2 0 414.594 4.093 20 0 HIADRP CSC1(C[NH2+][C@H](C)c2cccc(OCc3cn4ccccc4n3)c2)CC[NH+](C)CC1 ZINC000562104046 944939943 /nfs/dbraw/zinc/93/99/43/944939943.db2.gz OZTJBWFUNQXCTG-LJQANCHMSA-N 2 0 424.614 4.391 20 0 HIADRP Ic1cccc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1 ZINC000565260058 945794942 /nfs/dbraw/zinc/79/49/42/945794942.db2.gz ULOZUZUCPDAOQI-UHFFFAOYSA-N 2 0 406.311 4.177 20 0 HIADRP CC[N@H+](Cc1nc(-c2ccco2)no1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000565276419 945801690 /nfs/dbraw/zinc/80/16/90/945801690.db2.gz OMDFYLCGMSFYAL-UHFFFAOYSA-N 2 0 410.522 4.042 20 0 HIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000565379154 945819491 /nfs/dbraw/zinc/81/94/91/945819491.db2.gz WTEXCWAUGYJPQH-SLFFLAALSA-N 2 0 400.485 4.394 20 0 HIADRP c1[nH]c2ncccc2c1C1CC[NH+](C[C@H]2CN(Cc3ccccc3)CCCO2)CC1 ZINC000565495953 945838665 /nfs/dbraw/zinc/83/86/65/945838665.db2.gz DEFBSCQNCQYURD-QFIPXVFZSA-N 2 0 404.558 4.033 20 0 HIADRP C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000565902771 945908738 /nfs/dbraw/zinc/90/87/38/945908738.db2.gz BINMQIKTSREGRY-JWFIMMEFSA-N 2 0 403.998 4.243 20 0 HIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](CCCc4nc(-c5ccccc5)no4)C[C@@H]3C2)cc1 ZINC000566884546 946154146 /nfs/dbraw/zinc/15/41/46/946154146.db2.gz PBODDNKIIBEISL-DHIUTWEWSA-N 2 0 402.542 4.123 20 0 HIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000568132258 946473951 /nfs/dbraw/zinc/47/39/51/946473951.db2.gz RPVPSJIICVPVLL-ATVHPVEESA-N 2 0 419.491 4.190 20 0 HIADRP C[C@H]([NH2+]CC(=O)NC1CC[NH+](C2CC2)CC1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000570149179 947117934 /nfs/dbraw/zinc/11/79/34/947117934.db2.gz HYUMOGHVEAPALH-KRWDZBQOSA-N 2 0 411.521 4.012 20 0 HIADRP C[C@@H]1CN(CCOC2CC[NH+](Cc3cnc(C4CCCCC4)s3)CC2)C[C@H](C)O1 ZINC000570551706 947289796 /nfs/dbraw/zinc/28/97/96/947289796.db2.gz NGKOLKOEHOJCJT-KDURUIRLSA-N 2 0 421.651 4.281 20 0 HIADRP C[C@H]1C[N@H+](CC(Cc2ccccc2)Cc2ccccc2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000570559602 947299578 /nfs/dbraw/zinc/29/95/78/947299578.db2.gz IZCYHWLTJZPRIA-HOFKKMOUSA-N 2 0 405.630 4.046 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000570690026 947326390 /nfs/dbraw/zinc/32/63/90/947326390.db2.gz JFZZAAVWFRYXNQ-QHCPKHFHSA-N 2 0 408.590 4.213 20 0 HIADRP Fc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1Cl ZINC000570937454 947393730 /nfs/dbraw/zinc/39/37/30/947393730.db2.gz WXIGNEFPUMVBKO-FQEVSTJZSA-N 2 0 402.941 4.498 20 0 HIADRP CSC1(C[NH2+]Cc2cc(Br)cc(C(F)(F)F)c2)CC[NH+](C)CC1 ZINC000571010297 947433848 /nfs/dbraw/zinc/43/38/48/947433848.db2.gz YZZDXDPDWOBPDT-UHFFFAOYSA-N 2 0 411.331 4.385 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H](CO)Cc2cc(F)c(F)c(F)c2)CC1 ZINC000571174516 947534462 /nfs/dbraw/zinc/53/44/62/947534462.db2.gz BFJIQCRHRCZJGB-MWXLCCTBSA-N 2 0 420.519 4.288 20 0 HIADRP COc1ccc2c(c1F)CC[C@@H]2[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000572439757 947905848 /nfs/dbraw/zinc/90/58/48/947905848.db2.gz FPNCDTAMDALSAH-YWZLYKJASA-N 2 0 401.501 4.063 20 0 HIADRP Cc1cccn2cc(Cc3noc([C@@]45CCC[C@@H]4C[N@H+](Cc4ccccc4)C5)n3)nc12 ZINC000573101002 948077715 /nfs/dbraw/zinc/07/77/15/948077715.db2.gz LYQGFGCJOGIPFT-CJFMBICVSA-N 2 0 413.525 4.170 20 0 HIADRP Cc1nc(-c2ccccc2Br)sc1[C@H](C)[NH2+]CCOCC[NH+](C)C ZINC000574956326 948564713 /nfs/dbraw/zinc/56/47/13/948564713.db2.gz HTBXENQBQIRTAC-ZDUSSCGKSA-N 2 0 412.397 4.110 20 0 HIADRP CSC1(C[NH2+]Cc2cc(Br)cc(C)c2OC(F)F)CC[NH+](C)CC1 ZINC000575167412 948616355 /nfs/dbraw/zinc/61/63/55/948616355.db2.gz CTWLBMNJMDHUNT-UHFFFAOYSA-N 2 0 423.367 4.276 20 0 HIADRP CC[N@@H+]1CCCC[C@H]1c1ccc(N([C@@H]2COC3(C2)CC[NH2+]CC3)C(C)(C)C)nc1 ZINC001164736044 720547185 /nfs/dbraw/zinc/54/71/85/720547185.db2.gz URNXJFRCMHJGKM-SFTDATJTSA-N 2 0 400.611 4.145 20 0 HIADRP CC[C@@H]([NH2+]CC(=O)Nc1ccc(N2CC[NH+](CC)CC2)cc1)c1ccc(Cl)cc1 ZINC000024254647 846806558 /nfs/dbraw/zinc/80/65/58/846806558.db2.gz HQKVMRSTSAVMMC-JOCHJYFZSA-N 2 0 414.981 4.161 20 0 HIADRP CC[NH+]1CCN(c2ccc(NC(=O)C[N@H+](Cc3ccccc3)[C@@H](C)C3CC3)cc2)CC1 ZINC000029842802 847630737 /nfs/dbraw/zinc/63/07/37/847630737.db2.gz XOMATJXFTURXBI-NRFANRHFSA-N 2 0 420.601 4.068 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000047950872 849144003 /nfs/dbraw/zinc/14/40/03/849144003.db2.gz OVGANPUXWCQQDF-OAQYLSRUSA-N 2 0 414.619 4.225 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)c1ccsc1 ZINC000056764257 850471970 /nfs/dbraw/zinc/47/19/70/850471970.db2.gz HCEONPRKKPHWKW-OAQYLSRUSA-N 2 0 400.592 4.201 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1)c1cccs1 ZINC000058216771 850783593 /nfs/dbraw/zinc/78/35/93/850783593.db2.gz HWLWZAURKYEBHR-NRFANRHFSA-N 2 0 414.619 4.226 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc2)CC1 ZINC000060630800 851172932 /nfs/dbraw/zinc/17/29/32/851172932.db2.gz GZEJBNNBBVTRIE-NRFANRHFSA-N 2 0 400.611 4.068 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(F)c(Br)c3)cc2)CC1 ZINC000061070076 851287684 /nfs/dbraw/zinc/28/76/84/851287684.db2.gz SZJXMUURZYEGPE-UHFFFAOYSA-N 2 0 420.370 4.016 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)C1 ZINC000061112550 851295822 /nfs/dbraw/zinc/29/58/22/851295822.db2.gz LMQVXZOZNRNIJV-NQIIRXRSSA-N 2 0 414.619 4.082 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=S)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000063149611 851623474 /nfs/dbraw/zinc/62/34/74/851623474.db2.gz DFLNVOOGJPXTPT-UHFFFAOYSA-N 2 0 424.658 4.157 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000063333561 851664896 /nfs/dbraw/zinc/66/48/96/851664896.db2.gz BPSLRUQOXVOMTN-UHFFFAOYSA-N 2 0 412.622 4.126 20 0 HIADRP COC(=O)COc1c(C)cc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1C ZINC000063903615 851789675 /nfs/dbraw/zinc/78/96/75/851789675.db2.gz OXMIYTCFSACUFO-UHFFFAOYSA-N 2 0 410.558 4.131 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NCc1cccc(C[NH+]2CCCCCC2)c1)c1ccccc1 ZINC000064237962 851855478 /nfs/dbraw/zinc/85/54/78/851855478.db2.gz WCNQIBQXAMWLNG-DEOSSOPVSA-N 2 0 408.590 4.165 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000065522108 852166855 /nfs/dbraw/zinc/16/68/55/852166855.db2.gz NQTHNQLNTZMTDH-GIVPXCGWSA-N 2 0 412.603 4.020 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(Oc4cc(F)cc(F)c4)cc3)cn2)CC1 ZINC000065890118 852304630 /nfs/dbraw/zinc/30/46/30/852304630.db2.gz RPJASCGLMBBCNR-UHFFFAOYSA-N 2 0 424.495 4.194 20 0 HIADRP C[C@H](C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000071997651 852456859 /nfs/dbraw/zinc/45/68/59/852456859.db2.gz DTKADZOJEFFOOF-CYBMUJFWSA-N 2 0 405.892 4.350 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)cc1)C(C)C ZINC000110173656 853069096 /nfs/dbraw/zinc/06/90/96/853069096.db2.gz PLJACEZGOBQVMC-UHFFFAOYSA-N 2 0 411.565 4.450 20 0 HIADRP COc1c(Br)cc(C[NH2+]CCC2CC[NH+](C)CC2)cc1Br ZINC000134403790 853371943 /nfs/dbraw/zinc/37/19/43/853371943.db2.gz PSJYIXJBCUIWRE-UHFFFAOYSA-N 2 0 420.189 4.042 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)[NH+]2CCCC2)cc1 ZINC000143026176 853506014 /nfs/dbraw/zinc/50/60/14/853506014.db2.gz BXMLRFMRXUZUPV-RUZDIDTESA-N 2 0 405.586 4.160 20 0 HIADRP Brc1ccccc1N1CC[C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000236580352 853899608 /nfs/dbraw/zinc/89/96/08/853899608.db2.gz MLVLNRGFGBKDPK-GOSISDBHSA-N 2 0 406.412 4.415 20 0 HIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000236613011 853902899 /nfs/dbraw/zinc/90/28/99/853902899.db2.gz JHRLQSKBHBPZTA-VWLOTQADSA-N 2 0 408.542 4.173 20 0 HIADRP CCCOc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1OC ZINC000236949085 853941229 /nfs/dbraw/zinc/94/12/29/853941229.db2.gz SXTVEVFYOVVMBL-BGYRXZFFSA-N 2 0 412.574 4.383 20 0 HIADRP COC(=O)COc1c(C)cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1C ZINC000237194827 853979435 /nfs/dbraw/zinc/97/94/35/853979435.db2.gz QEIFTESFXXGTKK-CWAQXLGLSA-N 2 0 422.569 4.140 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2csc(COc3ccc(Cl)cc3)n2)C[C@@H](C)O1 ZINC000237404951 854025852 /nfs/dbraw/zinc/02/58/52/854025852.db2.gz RMSQHTBEERCLFY-IAGOWNOFSA-N 2 0 424.010 4.355 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1OC(F)F ZINC000237441309 854033529 /nfs/dbraw/zinc/03/35/29/854033529.db2.gz BBQBUJPHUMUTCE-CALCHBBNSA-N 2 0 420.500 4.196 20 0 HIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000237572705 854056591 /nfs/dbraw/zinc/05/65/91/854056591.db2.gz GOHLYCFKTSNCAY-WOJBJXKFSA-N 2 0 404.558 4.284 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+]Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 ZINC000237664418 854070913 /nfs/dbraw/zinc/07/09/13/854070913.db2.gz WVYZTFLUSVRVBR-QGZVFWFLSA-N 2 0 422.400 4.298 20 0 HIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000237672965 854072827 /nfs/dbraw/zinc/07/28/27/854072827.db2.gz MEPRDACGDFWPID-UHFFFAOYSA-N 2 0 408.546 4.139 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+]Cc1ccc(-c2cccc(Br)c2)o1 ZINC000237977341 854128315 /nfs/dbraw/zinc/12/83/15/854128315.db2.gz POEHDFKHWXVRPT-GOSISDBHSA-N 2 0 407.352 4.036 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2cccc(OC3CCCC3)c2)cc1 ZINC000238076405 854141678 /nfs/dbraw/zinc/14/16/78/854141678.db2.gz BYMQRYDOBKQCND-UHFFFAOYSA-N 2 0 421.585 4.123 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000302938757 854687970 /nfs/dbraw/zinc/68/79/70/854687970.db2.gz ADKKHDKUKBTIRB-XMMPIXPASA-N 2 0 423.576 4.340 20 0 HIADRP Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000303152175 854787283 /nfs/dbraw/zinc/78/72/83/854787283.db2.gz FOLRURBWZVHRPO-YADHBBJMSA-N 2 0 407.602 4.405 20 0 HIADRP Cc1ccccc1[C@H](C)NC(=O)[C@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000303152171 854787563 /nfs/dbraw/zinc/78/75/63/854787563.db2.gz FOLRURBWZVHRPO-VXKWHMMOSA-N 2 0 407.602 4.405 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000303522679 855009679 /nfs/dbraw/zinc/00/96/79/855009679.db2.gz ZKRZMBQKZINWOK-VRBKOIECSA-N 2 0 412.622 4.136 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000303544396 855030985 /nfs/dbraw/zinc/03/09/85/855030985.db2.gz KNQHJLXTYBMQBA-SEJPIABJSA-N 2 0 417.553 4.420 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2ccccc2Br)C1 ZINC000303582785 855056624 /nfs/dbraw/zinc/05/66/24/855056624.db2.gz KSKJMKVHHKIYFX-QZTJIDSGSA-N 2 0 422.411 4.364 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCC(=O)Nc2ccccc2Br)C1 ZINC000303582783 855056954 /nfs/dbraw/zinc/05/69/54/855056954.db2.gz KSKJMKVHHKIYFX-MSOLQXFVSA-N 2 0 422.411 4.364 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCC[NH+]2Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303767637 855185572 /nfs/dbraw/zinc/18/55/72/855185572.db2.gz QBLJLAMIMFVEIG-ZODMCCGTSA-N 2 0 405.586 4.163 20 0 HIADRP CC(C)(C)OC(=O)N[C@H]1CCC[C@H]([NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC000309674714 855363280 /nfs/dbraw/zinc/36/32/80/855363280.db2.gz VUBHEALTJFETLG-AWRGLXIESA-N 2 0 401.595 4.324 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc(Br)cs1 ZINC000390846812 855457437 /nfs/dbraw/zinc/45/74/37/855457437.db2.gz FRLRWUIAYKWQHE-MAUKXSAKSA-N 2 0 409.393 4.452 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)c1ccccc1 ZINC000410327619 855930384 /nfs/dbraw/zinc/93/03/84/855930384.db2.gz KQZDPUKIUHOCLK-VWLOTQADSA-N 2 0 422.617 4.342 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)Nc2cccc(OCC[NH+](C)C)c2)C1 ZINC000410363990 855951879 /nfs/dbraw/zinc/95/18/79/855951879.db2.gz LCXIFQDBSUZOPC-FQEVSTJZSA-N 2 0 424.589 4.181 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)C1 ZINC000410371128 855957355 /nfs/dbraw/zinc/95/73/55/855957355.db2.gz YZGTWVGYYIPQIX-SFHVURJKSA-N 2 0 400.611 4.027 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)C1 ZINC000410371122 855957375 /nfs/dbraw/zinc/95/73/75/855957375.db2.gz YZGTWVGYYIPQIX-GOSISDBHSA-N 2 0 400.611 4.027 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccccc2C[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000410373191 855958568 /nfs/dbraw/zinc/95/85/68/855958568.db2.gz KACZASRKQDIKND-NRFANRHFSA-N 2 0 414.638 4.324 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)Nc1ccc(OCC[NH+]2CCCCC2)cc1)c1cccs1 ZINC000426162472 856147628 /nfs/dbraw/zinc/14/76/28/856147628.db2.gz RVDBTJSZJLFEKX-FQEVSTJZSA-N 2 0 416.591 4.037 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)CCc3ccc(OC)c(O)c3)CC2)cc1 ZINC000426420223 856282579 /nfs/dbraw/zinc/28/25/79/856282579.db2.gz LRKYYXIIBGVPFN-IBGZPJMESA-N 2 0 412.574 4.232 20 0 HIADRP C[C@@H]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000437461969 862825793 /nfs/dbraw/zinc/82/57/93/862825793.db2.gz MFRQAUSGUFOXBS-ZJSXRUAMSA-N 2 0 423.576 4.161 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCc2ncc(C(F)(F)F)cc21 ZINC000427847281 856979776 /nfs/dbraw/zinc/97/97/76/856979776.db2.gz JVJAQBKNVNBYFJ-PZJWPPBQSA-N 2 0 419.491 4.224 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000428131361 857083466 /nfs/dbraw/zinc/08/34/66/857083466.db2.gz PMFWRCCOIAJZEE-BWKNWUBXSA-N 2 0 422.617 4.381 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000428131368 857083617 /nfs/dbraw/zinc/08/36/17/857083617.db2.gz PMFWRCCOIAJZEE-SQJMNOBHSA-N 2 0 422.617 4.381 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000428277480 857137003 /nfs/dbraw/zinc/13/70/03/857137003.db2.gz RBWGZAXTEYJSJE-ZODMCCGTSA-N 2 0 420.601 4.176 20 0 HIADRP CC1CCN(Cc2csc(NC(=O)C[NH2+][C@H](c3cccs3)C3CC3)n2)CC1 ZINC000428291925 857143525 /nfs/dbraw/zinc/14/35/25/857143525.db2.gz VRKXMYGDOIBQDW-IBGZPJMESA-N 2 0 404.605 4.116 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[NH+]2CCCC2)o1 ZINC000428688191 857297576 /nfs/dbraw/zinc/29/75/76/857297576.db2.gz ZJOPVQDGEWNJDL-PTUXOGIPSA-N 2 0 424.589 4.077 20 0 HIADRP C[NH+](C)CCCOc1cccc(NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)c1 ZINC000428705012 857303291 /nfs/dbraw/zinc/30/32/91/857303291.db2.gz BOSKEIOBULFZBD-UHFFFAOYSA-N 2 0 409.574 4.258 20 0 HIADRP C[C@@H]([NH2+]C/C=C/C[NH2+][C@@H](C)[C@@H]1OCCc2sccc21)[C@@H]1OCCc2sccc21 ZINC000429124958 857522178 /nfs/dbraw/zinc/52/21/78/857522178.db2.gz XQOWHFFXKUUUQA-CJHJECMLSA-N 2 0 418.628 4.250 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H]2c3cccc(Br)c3CC2(C)C)CC1 ZINC000429402763 857646163 /nfs/dbraw/zinc/64/61/63/857646163.db2.gz HQZUSYNJDVNZLN-FQEVSTJZSA-N 2 0 408.428 4.078 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)c1 ZINC000429542356 857734086 /nfs/dbraw/zinc/73/40/86/857734086.db2.gz XXOHFNYPGXQVAY-VWLOTQADSA-N 2 0 419.544 4.191 20 0 HIADRP CC[NH+](CC)CCO[C@@H]1CCN([C@H](c2nc(-c3ccccc3)no2)c2ccccc2)C1 ZINC000430000436 857990311 /nfs/dbraw/zinc/99/03/11/857990311.db2.gz PKGSUSRHGKYDCV-PKTZIBPZSA-N 2 0 420.557 4.259 20 0 HIADRP O=C(NC[C@H]1CCC[N@@H+]1C1CCCCC1)NC[C@@H]1CCC[NH+](Cc2cccs2)C1 ZINC000437664544 863004397 /nfs/dbraw/zinc/00/43/97/863004397.db2.gz DOSBZDOIHQVKRT-PZJWPPBQSA-N 2 0 418.651 4.056 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000437695192 863031360 /nfs/dbraw/zinc/03/13/60/863031360.db2.gz OPRVBSQWSBLTSF-QHCPKHFHSA-N 2 0 424.589 4.145 20 0 HIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1 ZINC000431333414 858570186 /nfs/dbraw/zinc/57/01/86/858570186.db2.gz OKVCPVSBJSSWIE-HSZRJFAPSA-N 2 0 423.605 4.006 20 0 HIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000431354279 858576502 /nfs/dbraw/zinc/57/65/02/858576502.db2.gz WSFMACYUQHKFLJ-QHCPKHFHSA-N 2 0 409.574 4.105 20 0 HIADRP COc1ccc([C@H](CNC(=O)C[C@@H](c2ccccc2)[NH+](C)C)[NH+]2CCCCC2)cc1 ZINC000431570954 858673299 /nfs/dbraw/zinc/67/32/99/858673299.db2.gz OZJISBPVJHUQPT-ZEQRLZLVSA-N 2 0 409.574 4.031 20 0 HIADRP O=C(NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC000431629027 858699485 /nfs/dbraw/zinc/69/94/85/858699485.db2.gz VCHNVCQKAPJOOJ-JOCHJYFZSA-N 2 0 403.998 4.218 20 0 HIADRP C[C@H]1C[N@H+](CCC[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CCCO1 ZINC000432361132 859121801 /nfs/dbraw/zinc/12/18/01/859121801.db2.gz YAOOTQGVRIMGAU-FQEVSTJZSA-N 2 0 422.548 4.269 20 0 HIADRP COCC1(C)CC[NH+](Cc2cc(C[NH+]3CCC(C)(COC)CC3)cc(OC)c2)CC1 ZINC000432780440 859356880 /nfs/dbraw/zinc/35/68/80/859356880.db2.gz KLTJOJPNUCVUEP-UHFFFAOYSA-N 2 0 418.622 4.192 20 0 HIADRP CC[N@H+](CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)Cc1c[nH]c2ccccc12 ZINC000432793772 859363839 /nfs/dbraw/zinc/36/38/39/859363839.db2.gz RTLLQQWWQIKAKO-UHFFFAOYSA-N 2 0 418.585 4.079 20 0 HIADRP COc1ccccc1NC(=O)[C@@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433177465 859555498 /nfs/dbraw/zinc/55/54/98/859555498.db2.gz QRXYCJLPMHGXQI-HXUWFJFHSA-N 2 0 407.558 4.010 20 0 HIADRP C[NH+](Cc1cc(Br)ccc1C[N@@H+](C)[C@H]1CCSC1)[C@@H]1CCSC1 ZINC000433261821 859599994 /nfs/dbraw/zinc/59/99/94/859599994.db2.gz XMJILSSAHAARGX-ZWKOTPCHSA-N 2 0 415.466 4.324 20 0 HIADRP C[C@H]([NH2+]CCCN1CC[NH+](Cc2ccccc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000467736589 881539070 /nfs/dbraw/zinc/53/90/70/881539070.db2.gz DSXHHFHBPYDGJH-INIZCTEOSA-N 2 0 412.525 4.020 20 0 HIADRP CN(c1ccccc1C[NH+]1CCC(c2ncc3n2CCCC3)CC1)C1CC[NH+](C)CC1 ZINC000435058339 860619863 /nfs/dbraw/zinc/61/98/63/860619863.db2.gz MPZQSZOSSWWUOY-UHFFFAOYSA-N 2 0 421.633 4.129 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(-c2ccccc2OC)c1 ZINC000438081295 863475758 /nfs/dbraw/zinc/47/57/58/863475758.db2.gz YSHUWMCVFNOHPA-JOCHJYFZSA-N 2 0 424.589 4.242 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NC[C@@H]2CCC[NH+]2C2CCCCC2)[C@@H]1c1cccs1 ZINC000438159577 863580902 /nfs/dbraw/zinc/58/09/02/863580902.db2.gz YITBVEIFQPXJSJ-KAGYGMCKSA-N 2 0 418.651 4.227 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(-c2cccs2)c1 ZINC000438182127 863606857 /nfs/dbraw/zinc/60/68/57/863606857.db2.gz SRLIVARAAXEDBM-HXUWFJFHSA-N 2 0 400.592 4.295 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000439138123 864571061 /nfs/dbraw/zinc/57/10/61/864571061.db2.gz JSVBRGPUIMJVCI-GPMSIDNRSA-N 2 0 413.425 4.319 20 0 HIADRP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000439192956 864619318 /nfs/dbraw/zinc/61/93/18/864619318.db2.gz QIMBTGIHKKAGMU-RPWUZVMVSA-N 2 0 420.601 4.183 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCC([NH+]2CCCC2)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000468031376 881863690 /nfs/dbraw/zinc/86/36/90/881863690.db2.gz VRQPCGSAKGPIFN-RBBKRZOGSA-N 2 0 400.611 4.022 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cnc(-c4ccncc4)s3)cc2)C[C@@H](C)O1 ZINC000440340414 865618043 /nfs/dbraw/zinc/61/80/43/865618043.db2.gz KYWDHRXOHXJQCE-QZTJIDSGSA-N 2 0 408.571 4.104 20 0 HIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]Cc3cnc(-c4ccncc4)s3)cc2)C[C@H](C)O1 ZINC000440340415 865619045 /nfs/dbraw/zinc/61/90/45/865619045.db2.gz KYWDHRXOHXJQCE-ROUUACIJSA-N 2 0 408.571 4.104 20 0 HIADRP Cc1ccccc1[C@H](OC[C@@H](O)C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1)c1ccccc1 ZINC000441455369 866532292 /nfs/dbraw/zinc/53/22/92/866532292.db2.gz YPBGUXFOZDBQLG-NRRYGQPISA-N 2 0 422.613 4.270 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)NC2CCC(C[NH+](C)C)CC2)CCCC1)c1ccccc1 ZINC000441512796 866591769 /nfs/dbraw/zinc/59/17/69/866591769.db2.gz PRODNMJCWIWMOE-VRKFHHGPSA-N 2 0 400.611 4.070 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3Cc4[nH]c5ccccc5c4C3)CC2)cc1 ZINC000442778097 867672386 /nfs/dbraw/zinc/67/23/86/867672386.db2.gz FMGOBZBPCDBJFT-NRFANRHFSA-N 2 0 403.570 4.296 20 0 HIADRP CC[NH+](CC)CCOC1CCN([C@@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)CC1 ZINC000468281574 882203124 /nfs/dbraw/zinc/20/31/24/882203124.db2.gz XYMZFOCZBXJYHN-IBGZPJMESA-N 2 0 400.567 4.237 20 0 HIADRP C[C@@H](CCc1ccc(Cl)s1)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000468427225 882370803 /nfs/dbraw/zinc/37/08/03/882370803.db2.gz IRIXIDPOEMYGAY-LPHOPBHVSA-N 2 0 420.022 4.210 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000446562733 870473635 /nfs/dbraw/zinc/47/36/35/870473635.db2.gz CYPMXMCRQXNHFX-UKILVPOCSA-N 2 0 420.601 4.309 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)Nc2ccccc2CC[NH+](C)C)c2ccccc2)CC1 ZINC000446578096 870489185 /nfs/dbraw/zinc/48/91/85/870489185.db2.gz ZCLXNVUFZSUEAA-XMMPIXPASA-N 2 0 408.590 4.385 20 0 HIADRP C[C@H](C[NH2+][C@H](c1ccc(Br)cc1Cl)C1CC1)CN1CC[NH+](C)CC1 ZINC000446817982 870732330 /nfs/dbraw/zinc/73/23/30/870732330.db2.gz LEFSUENMLBQXCD-KUHUBIRLSA-N 2 0 414.819 4.027 20 0 HIADRP c1c[nH]c([C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c2ccccc2)n1 ZINC000446924375 870837824 /nfs/dbraw/zinc/83/78/24/870837824.db2.gz GDGBKBYGUTVKDP-DEOSSOPVSA-N 2 0 404.558 4.160 20 0 HIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H](NC[C@@H]2C[NH+](Cc4ccccc4)CCCO2)C3)cc1 ZINC000447595501 871500308 /nfs/dbraw/zinc/50/03/08/871500308.db2.gz NYNXLSNGXVXRKC-JVYGEBFASA-N 2 0 419.613 4.063 20 0 HIADRP C[C@@H](CC[NH+]1CCC(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000447732886 871681040 /nfs/dbraw/zinc/68/10/40/871681040.db2.gz YQPBFWNJXIIRIE-QFIPXVFZSA-N 2 0 407.602 4.140 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC000448212161 872114085 /nfs/dbraw/zinc/11/40/85/872114085.db2.gz GUPDIBAXYQJKNO-XRODADMRSA-N 2 0 424.633 4.077 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)[C@H](C)C1 ZINC000448461396 872419064 /nfs/dbraw/zinc/41/90/64/872419064.db2.gz KWLLCWVEPQZJEV-HYBUGGRVSA-N 2 0 414.638 4.323 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](CC(C)C)[NH2+][C@H](C)c2ccccc2)[C@H](C)C1 ZINC000448519703 872503535 /nfs/dbraw/zinc/50/35/35/872503535.db2.gz FMJJLBBVIVCNHX-SCPDWHHUSA-N 2 0 402.627 4.124 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCCc1nc(-c2ccccc2)no1 ZINC000460344456 872960135 /nfs/dbraw/zinc/96/01/35/872960135.db2.gz BNNPUQKIMIANDI-GZOXUSKESA-N 2 0 404.558 4.415 20 0 HIADRP COc1cccc(Cn2c3ccccc3nc2NCc2cn(-c3cc[nH+]cc3)nc2C)c1 ZINC000460664768 873409046 /nfs/dbraw/zinc/40/90/46/873409046.db2.gz SQLIVHWSBGBHQQ-UHFFFAOYSA-N 2 0 424.508 4.594 20 0 HIADRP CC[NH+]1CCN(c2ccc(C(=O)Nc3ccc(C[NH+]4CCCCCC4)cc3)cc2)CC1 ZINC000468706114 882822095 /nfs/dbraw/zinc/82/20/95/882822095.db2.gz MURUFIYNUJYAGN-UHFFFAOYSA-N 2 0 420.601 4.457 20 0 HIADRP C[C@H]1CC[C@H](C)[NH+]1CC(=O)N1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000461999108 875120466 /nfs/dbraw/zinc/12/04/66/875120466.db2.gz BMSBLBCBWWZFEC-IRXDYDNUSA-N 2 0 411.512 4.001 20 0 HIADRP CC[C@H](C(=O)N1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1)[NH+](CC)CC ZINC000462001742 875123483 /nfs/dbraw/zinc/12/34/83/875123483.db2.gz UQQVGLCQSROMOO-HXUWFJFHSA-N 2 0 413.528 4.249 20 0 HIADRP C[C@H]([NH2+]Cc1cc(Br)cc2c1OCC2)c1cccc(OCC[NH+](C)C)c1 ZINC000462835619 875869947 /nfs/dbraw/zinc/86/99/47/875869947.db2.gz BXULFUUNCUTFAP-HNNXBMFYSA-N 2 0 419.363 4.175 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CCC[C@](CO)(Cc2ccccc2)C1)C1CC[NH+](C)CC1 ZINC000463041818 876067310 /nfs/dbraw/zinc/06/73/10/876067310.db2.gz HRSQGANMLZZLFB-MHZLTWQESA-N 2 0 421.629 4.034 20 0 HIADRP C[N@@H+](Cc1cc(Br)cc2c1OCC2)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000463062710 876091611 /nfs/dbraw/zinc/09/16/11/876091611.db2.gz QPNNGJKRLDSXLC-UHFFFAOYSA-N 2 0 416.363 4.127 20 0 HIADRP COc1ccc(C)cc1C1(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)CCOCC1 ZINC000463079913 876110806 /nfs/dbraw/zinc/11/08/06/876110806.db2.gz MUBIXVZCPVHYGU-UHFFFAOYSA-N 2 0 422.613 4.349 20 0 HIADRP COc1cc(OC)cc(N2CC[C@@H]([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000463233901 876287985 /nfs/dbraw/zinc/28/79/85/876287985.db2.gz QGVUSXNWAJDLCQ-GTCWDNOESA-N 2 0 421.585 4.068 20 0 HIADRP C[C@@H]1C[C@@H](NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000463238025 876293311 /nfs/dbraw/zinc/29/33/11/876293311.db2.gz NDLQFDPXDBPBDG-JTVPTGRASA-N 2 0 409.540 4.434 20 0 HIADRP COc1cccc([C@@H]2[C@H](NC3CC[NH+](CCc4ccccc4)CC3)CC[N@@H+]2C2CC2)c1 ZINC000463280357 876337394 /nfs/dbraw/zinc/33/73/94/876337394.db2.gz LNIYIHUFYOPNFH-KAYWLYCHSA-N 2 0 419.613 4.270 20 0 HIADRP Cc1ccc([C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N2CCOCC2)cc1 ZINC000463283800 876342114 /nfs/dbraw/zinc/34/21/14/876342114.db2.gz QGZZIEYXKPEJBX-ZAEYVGPMSA-N 2 0 419.613 4.154 20 0 HIADRP O=C1CCCN1Cc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000463285260 876343032 /nfs/dbraw/zinc/34/30/32/876343032.db2.gz SCGZUULKYNTRDL-QILAJZQNSA-N 2 0 403.570 4.094 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000463298374 876360180 /nfs/dbraw/zinc/36/01/80/876360180.db2.gz CKCQOJCMDJPKSM-LFHKSINYSA-N 2 0 404.602 4.077 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000463298377 876360488 /nfs/dbraw/zinc/36/04/88/876360488.db2.gz CKCQOJCMDJPKSM-UZSIOOOCSA-N 2 0 404.602 4.077 20 0 HIADRP CCC[N@H+](CCc1cccs1)CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000464579903 877802808 /nfs/dbraw/zinc/80/28/08/877802808.db2.gz XSNSPIFVTYURSE-UHFFFAOYSA-N 2 0 417.644 4.190 20 0 HIADRP C[C@H]1CC[N@H+](CCOc2ccc(NC(=O)c3cccc(C[NH+]4CCCC4)c3)cc2)C1 ZINC000465197003 878596790 /nfs/dbraw/zinc/59/67/90/878596790.db2.gz QGRAMTWWPUKROV-FQEVSTJZSA-N 2 0 407.558 4.255 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)c1 ZINC000465511132 878952033 /nfs/dbraw/zinc/95/20/33/878952033.db2.gz DMDMEPNGLSVNPD-JOCHJYFZSA-N 2 0 422.617 4.334 20 0 HIADRP CC(C)[C@@H](CNC(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)[NH+]1CCC(C)CC1 ZINC000465547849 879010263 /nfs/dbraw/zinc/01/02/63/879010263.db2.gz QKYUICIXSJGYQK-KCZVDYSFSA-N 2 0 420.667 4.187 20 0 HIADRP CC(C)[C@@H](CNC(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[NH+]1CCC(C)CC1 ZINC000465547852 879010640 /nfs/dbraw/zinc/01/06/40/879010640.db2.gz QKYUICIXSJGYQK-VWPQPMDRSA-N 2 0 420.667 4.187 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)CC[N@@H+]1C ZINC000465573513 879048001 /nfs/dbraw/zinc/04/80/01/879048001.db2.gz PGTYBGRWFGLMNC-AUSIDOKSSA-N 2 0 408.590 4.039 20 0 HIADRP C[C@H]1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000465590278 879072426 /nfs/dbraw/zinc/07/24/26/879072426.db2.gz AMHSBAMOGASWSK-QFIPXVFZSA-N 2 0 420.601 4.088 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@@H]1CCC[NH+](C)[C@@H]1c1cccs1 ZINC000465591926 879074447 /nfs/dbraw/zinc/07/44/47/879074447.db2.gz GACAFLQXKMCFOM-DYXWJJEUSA-N 2 0 406.640 4.085 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCC[NH+]1CCC(C)CC1 ZINC000465601120 879090969 /nfs/dbraw/zinc/09/09/69/879090969.db2.gz NMOWOXZYOTXDLU-DEOSSOPVSA-N 2 0 414.638 4.052 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)cc1 ZINC000465640239 879156301 /nfs/dbraw/zinc/15/63/01/879156301.db2.gz VWFMIJRYSCAPNW-QFIPXVFZSA-N 2 0 422.617 4.334 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@@H]2CCC[NH+](C)[C@@H]2c2cccs2)c1 ZINC000465818519 879444568 /nfs/dbraw/zinc/44/45/68/879444568.db2.gz UJENEOBKUQHAFH-UNMCSNQZSA-N 2 0 414.619 4.082 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000503447751 912469198 /nfs/dbraw/zinc/46/91/98/912469198.db2.gz SELLFSRYVGIYRI-DEOSSOPVSA-N 2 0 414.638 4.326 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000465923923 879586358 /nfs/dbraw/zinc/58/63/58/879586358.db2.gz RVCBPNWMYWMMHI-JTHBVZDNSA-N 2 0 422.617 4.279 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1 ZINC000466729016 880514098 /nfs/dbraw/zinc/51/40/98/880514098.db2.gz XJBQZCUJXUYKSN-UHFFFAOYSA-N 2 0 409.574 4.262 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NCc1ccc(CC[NH+](C)C)cc1 ZINC000466972703 880776601 /nfs/dbraw/zinc/77/66/01/880776601.db2.gz IQZBYOAHSOBQAQ-NRFANRHFSA-N 2 0 422.617 4.165 20 0 HIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3ccc4c(c3)COC(C)(C)O4)CC2)C[C@H](C)O1 ZINC000469186904 883285114 /nfs/dbraw/zinc/28/51/14/883285114.db2.gz CJAJMNWKOODVOV-KDURUIRLSA-N 2 0 402.579 4.043 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H](NCc2ccc(Br)c(Cl)c2)[C@H](C)C1 ZINC000469765945 883935273 /nfs/dbraw/zinc/93/52/73/883935273.db2.gz CUNQDNOCAPPVSN-RDTXWAMCSA-N 2 0 403.792 4.329 20 0 HIADRP CC1(C)[C@@H](C(F)(F)F)CC[NH+]1CCOCC[N@H+]1CC[C@H](C(F)(F)F)C1(C)C ZINC000469992639 884208823 /nfs/dbraw/zinc/20/88/23/884208823.db2.gz SKTKANGMYOWJEY-KBPBESRZSA-N 2 0 404.439 4.329 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)o1 ZINC000470733647 885188173 /nfs/dbraw/zinc/18/81/73/885188173.db2.gz SWAQKANPRSKXBJ-DHIUTWEWSA-N 2 0 424.589 4.031 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@H](C[N@H+](C)CC2CC2)C1)c1ccccc1Cl ZINC000470735965 885192038 /nfs/dbraw/zinc/19/20/38/885192038.db2.gz HTWPMAIWDSPIPZ-DENIHFKCSA-N 2 0 421.029 4.096 20 0 HIADRP CN(C(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470737112 885193562 /nfs/dbraw/zinc/19/35/62/885193562.db2.gz MVDOOOHUFUEYOI-DHIUTWEWSA-N 2 0 424.589 4.113 20 0 HIADRP CN(C(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470752788 885218536 /nfs/dbraw/zinc/21/85/36/885218536.db2.gz BEVRMITWQGYOMU-DQEYMECFSA-N 2 0 420.601 4.130 20 0 HIADRP CCN(C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000471375604 886017589 /nfs/dbraw/zinc/01/75/89/886017589.db2.gz ZGEFWEADBBNUKB-MDNUFGMLSA-N 2 0 424.589 4.284 20 0 HIADRP CCN(C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000471375605 886018052 /nfs/dbraw/zinc/01/80/52/886018052.db2.gz ZGEFWEADBBNUKB-YMPZKCBVSA-N 2 0 424.589 4.284 20 0 HIADRP C[C@H](CCCCN1C(=O)c2ccccc2C1=O)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000471618993 886336290 /nfs/dbraw/zinc/33/62/90/886336290.db2.gz LQYZZPZRSVLFIU-AABGKKOBSA-N 2 0 411.590 4.084 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000472601405 887474970 /nfs/dbraw/zinc/47/49/70/887474970.db2.gz YHNXQNWVLFYSJK-PMWMKWCKSA-N 2 0 419.613 4.157 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N(C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)c1 ZINC000473745398 888528307 /nfs/dbraw/zinc/52/83/07/888528307.db2.gz DTZSMUYUEYSRDW-NZQKXSOJSA-N 2 0 402.627 4.323 20 0 HIADRP CCN(C(=O)NCc1cccc(C[NH+](C)C)c1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473943895 888820812 /nfs/dbraw/zinc/82/08/12/888820812.db2.gz IVQQYCYQBWCORH-YKSBVNFPSA-N 2 0 408.590 4.115 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)N(CC)[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)CC1 ZINC000474010999 888867498 /nfs/dbraw/zinc/86/74/98/888867498.db2.gz OIWUKUJUWNQTTR-NFBKMPQASA-N 2 0 400.611 4.118 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccnn3-c3ccc(F)cc3)CC2)cc1 ZINC000474605082 889471538 /nfs/dbraw/zinc/47/15/38/889471538.db2.gz YBBCUDNYEQWJGM-UHFFFAOYSA-N 2 0 408.521 4.022 20 0 HIADRP FC(F)(F)c1cc(Br)ccc1CNC1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000474793353 889648912 /nfs/dbraw/zinc/64/89/12/889648912.db2.gz DJPTYVGGXQDFEQ-ZDUSSCGKSA-N 2 0 421.301 4.058 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000475109693 889959739 /nfs/dbraw/zinc/95/97/39/889959739.db2.gz AARHCMFOWTVDJU-PXDATVDWSA-N 2 0 420.601 4.128 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000475139241 890005125 /nfs/dbraw/zinc/00/51/25/890005125.db2.gz OPYQYVVBCKPZRF-HSZRJFAPSA-N 2 0 400.611 4.166 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475297561 890203950 /nfs/dbraw/zinc/20/39/50/890203950.db2.gz NPPGOHCJNFTQFM-SIKLNZKXSA-N 2 0 413.993 4.189 20 0 HIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@H]2C)CC1 ZINC000477937773 893027651 /nfs/dbraw/zinc/02/76/51/893027651.db2.gz NDWCOTACWCIQOB-ATIYNZHBSA-N 2 0 406.618 4.314 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479291563 894572464 /nfs/dbraw/zinc/57/24/64/894572464.db2.gz ZJTMDUUVTRJJEN-QFIPXVFZSA-N 2 0 416.407 4.154 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000479365704 894666193 /nfs/dbraw/zinc/66/61/93/894666193.db2.gz UIEPTKMSOXGDPO-UKILVPOCSA-N 2 0 424.633 4.077 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCCc3cc(Br)ccc32)CC1 ZINC000479383596 894684650 /nfs/dbraw/zinc/68/46/50/894684650.db2.gz CWEUYENKTWQGRR-PWRODBHTSA-N 2 0 407.396 4.184 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CCc1cccc(OCC(F)(F)F)c1 ZINC000479523529 894833107 /nfs/dbraw/zinc/83/31/07/894833107.db2.gz QFTZMXPDGBGQGO-LAUBAEHRSA-N 2 0 407.480 4.065 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000480225429 895629799 /nfs/dbraw/zinc/62/97/99/895629799.db2.gz KMHXIVIXGVPQMC-HBMCJLEFSA-N 2 0 421.585 4.273 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H](Cc1cccc(F)c1)c1cccc(F)c1)N1CC[NH+](C)CC1 ZINC000480539200 895902244 /nfs/dbraw/zinc/90/22/44/895902244.db2.gz JVOKSZFHPIJCNC-DNQXCXABSA-N 2 0 401.545 4.110 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480539261 895902545 /nfs/dbraw/zinc/90/25/45/895902545.db2.gz KEYFIOOCXABSPY-OXJNMPFZSA-N 2 0 404.599 4.180 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(SCC(F)(F)F)cc1)N1CC[NH+](C)CC1 ZINC000480544323 895905823 /nfs/dbraw/zinc/90/58/23/895905823.db2.gz ZFRKWUHUYGGOMZ-QFBILLFUSA-N 2 0 403.558 4.264 20 0 HIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@H](C(C)C)N2CC[NH+](C)CC2)CCC3)cc1 ZINC000480557575 895916668 /nfs/dbraw/zinc/91/66/68/895916668.db2.gz RIIHYUQOWPMKNZ-IFMALSPDSA-N 2 0 412.647 4.358 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](C)c2cnn(-c3ccc(Cl)cc3Cl)c2C)CC1 ZINC000480600073 895962285 /nfs/dbraw/zinc/96/22/85/895962285.db2.gz HTJUNHJCJUPDIX-CVEARBPZSA-N 2 0 424.420 4.164 20 0 HIADRP CC(C)(C)[NH+]1CCC([NH2+]C2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC1 ZINC000480665143 896030824 /nfs/dbraw/zinc/03/08/24/896030824.db2.gz NPFHJTMLKPQCPD-UHFFFAOYSA-N 2 0 411.512 4.163 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3ccccc3OC(F)F)cc2)CC1 ZINC000480693313 896056331 /nfs/dbraw/zinc/05/63/31/896056331.db2.gz MHHLTLNSLKAHKQ-GOSISDBHSA-N 2 0 403.517 4.276 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C3CCN(Cc4ccccn4)CC3)cc2)C1 ZINC000480706029 896069025 /nfs/dbraw/zinc/06/90/25/896069025.db2.gz NWLJSNDPRVBPRO-FGZHOGPDSA-N 2 0 406.618 4.314 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(OC)c4ccccc43)cn2)CC1 ZINC000480714518 896076275 /nfs/dbraw/zinc/07/62/75/896076275.db2.gz ZGQZRNCEXGFJTE-IBGZPJMESA-N 2 0 404.558 4.236 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCN(c3ccccc3C(F)(F)F)C2)[C@@H](C)C1 ZINC000480722067 896082541 /nfs/dbraw/zinc/08/25/41/896082541.db2.gz ADFNZAZLNDZGDF-NSHGMRRFSA-N 2 0 413.528 4.011 20 0 HIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000480730563 896092405 /nfs/dbraw/zinc/09/24/05/896092405.db2.gz KQAOVTAURQRRJV-JOCHJYFZSA-N 2 0 406.599 4.277 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc4cc(OC)ccc4c3)cn2)CC1 ZINC000480732956 896094191 /nfs/dbraw/zinc/09/41/91/896094191.db2.gz FHQDOZQFELDDCR-IBGZPJMESA-N 2 0 404.558 4.236 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]C2CCC3(CC2)c2ccccc2NC3=O)cc1 ZINC000480733788 896095813 /nfs/dbraw/zinc/09/58/13/896095813.db2.gz GKLZKIOXJOCOAU-UHFFFAOYSA-N 2 0 421.585 4.330 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)CC1 ZINC000480761361 896122811 /nfs/dbraw/zinc/12/28/11/896122811.db2.gz SIOUMUFDZXAROJ-QGZVFWFLSA-N 2 0 404.599 4.326 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000480769093 896130899 /nfs/dbraw/zinc/13/08/99/896130899.db2.gz LGCSSKAJSJVFAW-FQEVSTJZSA-N 2 0 416.610 4.334 20 0 HIADRP COc1ccc2cc([C@H](C)[NH2+]Cc3ccc(CN4CC[NH+](C)CC4)cc3)ccc2c1 ZINC000480920750 896278851 /nfs/dbraw/zinc/27/88/51/896278851.db2.gz MWBXZOQDZYOGFC-FQEVSTJZSA-N 2 0 403.570 4.447 20 0 HIADRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc(-c3c(OC)ccc4ccccc43)no2)C1 ZINC000481064842 896386511 /nfs/dbraw/zinc/38/65/11/896386511.db2.gz YEXMDWZDUIGRSW-HXUWFJFHSA-N 2 0 423.557 4.436 20 0 HIADRP O=C(NCCC[NH+](Cc1ccccc1)Cc1ccccc1)N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000481065897 896387799 /nfs/dbraw/zinc/38/77/99/896387799.db2.gz ZCLSRRBCWRHGOJ-LOSJGSFVSA-N 2 0 420.601 4.005 20 0 HIADRP COc1ccccc1[C@H](C[NH2+][C@@H]1CCN(Cc2ccccn2)C[C@H]1C)N1CCCCC1 ZINC000481181388 896521357 /nfs/dbraw/zinc/52/13/57/896521357.db2.gz ZJWDSWRHGFXZJO-SDUSCBPUSA-N 2 0 422.617 4.117 20 0 HIADRP CC(C)[NH+]1CCC(C(=O)NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC1 ZINC000481218982 896571992 /nfs/dbraw/zinc/57/19/92/896571992.db2.gz BDRDEAVNTBOTMF-UHFFFAOYSA-N 2 0 407.602 4.316 20 0 HIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]Cc3cccnc3N3CC[NH+](C)CC3)cs2)cs1 ZINC000481238476 896588771 /nfs/dbraw/zinc/58/87/71/896588771.db2.gz ZTEZNOKRLGOSFG-OAHLLOKOSA-N 2 0 413.616 4.178 20 0 HIADRP C[C@@H]([NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000481302763 896649043 /nfs/dbraw/zinc/64/90/43/896649043.db2.gz DQJMCYSULZIRSD-GOSISDBHSA-N 2 0 417.544 4.220 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCc3c2cc(Br)cc3F)c1 ZINC000481316090 896666888 /nfs/dbraw/zinc/66/68/88/896666888.db2.gz XDHABMYDPHNYME-HXUWFJFHSA-N 2 0 407.327 4.306 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc(NS(=O)(=O)CC)cc2)c1 ZINC000481325944 896683467 /nfs/dbraw/zinc/68/34/67/896683467.db2.gz WOXMUUYLNDQNGA-SFHVURJKSA-N 2 0 403.592 4.141 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H](O)COc1cccc(Cl)c1Cl ZINC000481532488 896893216 /nfs/dbraw/zinc/89/32/16/896893216.db2.gz JQQCKNUWQMQAMI-KPFFTGBYSA-N 2 0 423.384 4.233 20 0 HIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1OCC(=O)N(C)C ZINC000481547315 896911969 /nfs/dbraw/zinc/91/19/69/896911969.db2.gz ROQOVDZPRZNUHH-DEOSSOPVSA-N 2 0 423.601 4.107 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3nnn(-c4ccccc4)c3C)CC2)cc1 ZINC000481720577 897114406 /nfs/dbraw/zinc/11/44/06/897114406.db2.gz VQPUHAAOSVAWFW-IBGZPJMESA-N 2 0 419.573 4.147 20 0 HIADRP COc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc(OC)c1OC ZINC000481722404 897116367 /nfs/dbraw/zinc/11/63/67/897116367.db2.gz ZCEFXICNCMPMMV-INIZCTEOSA-N 2 0 404.576 4.337 20 0 HIADRP C[C@@H](C[NH2+][C@H]1CCC(C)(C)c2ccc(Br)cc21)CN1CC[NH+](C)CC1 ZINC000481925934 897309049 /nfs/dbraw/zinc/30/90/49/897309049.db2.gz NKDDQRRYSXQVLI-JXFKEZNVSA-N 2 0 408.428 4.035 20 0 HIADRP COC(=O)c1ccc(-c2ccc(C[NH2+]CC3CCN(c4cc[nH+]cc4)CC3)o2)cc1 ZINC000482054347 897481592 /nfs/dbraw/zinc/48/15/92/897481592.db2.gz IJOYVEYRVQPDEE-UHFFFAOYSA-N 2 0 405.498 4.134 20 0 HIADRP COc1ccc2oc([C@H](C)[NH2+]CCCN3CCN(c4cc[nH+]cc4)CC3)c(C)c2c1 ZINC000482117141 897568946 /nfs/dbraw/zinc/56/89/46/897568946.db2.gz BOAYOIFNQKDPIE-IBGZPJMESA-N 2 0 408.546 4.008 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc(Cl)sc1Cl ZINC000482451598 898017144 /nfs/dbraw/zinc/01/71/44/898017144.db2.gz JVAHYGRKZIWPCL-CQSZACIVSA-N 2 0 414.406 4.098 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1Cl ZINC000482457775 898028443 /nfs/dbraw/zinc/02/84/43/898028443.db2.gz RGDFICANAFATBN-INIZCTEOSA-N 2 0 408.377 4.036 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)CC1 ZINC000482496475 898077176 /nfs/dbraw/zinc/07/71/76/898077176.db2.gz QNZHVYGLKZVTMA-MOPGFXCFSA-N 2 0 400.636 4.351 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)[C@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000482504039 898086246 /nfs/dbraw/zinc/08/62/46/898086246.db2.gz MPDTWFVNUOSLHL-ZACQAIPSSA-N 2 0 402.410 4.012 20 0 HIADRP CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(OC)c(OC)c1 ZINC000482536914 898123886 /nfs/dbraw/zinc/12/38/86/898123886.db2.gz QNPXJAWBUYHZPY-LAUBAEHRSA-N 2 0 415.553 4.397 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccc(N2CCCC2=O)c1 ZINC000482537550 898125498 /nfs/dbraw/zinc/12/54/98/898125498.db2.gz NTSQOGMXXRDCBM-MOPGFXCFSA-N 2 0 424.564 4.116 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(-n2ccnc2)cc1 ZINC000482539402 898126806 /nfs/dbraw/zinc/12/68/06/898126806.db2.gz ACOTTYNADAQZPF-OALUTQOASA-N 2 0 407.537 4.175 20 0 HIADRP COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c1 ZINC000482553191 898143493 /nfs/dbraw/zinc/14/34/93/898143493.db2.gz DJMXHLCCXTVDNV-DLBZAZTESA-N 2 0 401.526 4.007 20 0 HIADRP C[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(-c2ccccc2Br)s1 ZINC000482555052 898147833 /nfs/dbraw/zinc/14/78/33/898147833.db2.gz JAENIMASJBWTRD-JKSUJKDBSA-N 2 0 422.436 4.464 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccccc1OC(F)F ZINC000482560607 898152856 /nfs/dbraw/zinc/15/28/56/898152856.db2.gz ASDDIVLJKFWBJM-NRFANRHFSA-N 2 0 404.501 4.486 20 0 HIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c1 ZINC000482560655 898152896 /nfs/dbraw/zinc/15/28/96/898152896.db2.gz OJFIBFGGWFNKCO-KRWDZBQOSA-N 2 0 404.501 4.404 20 0 HIADRP COCCOc1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000482564870 898157815 /nfs/dbraw/zinc/15/78/15/898157815.db2.gz LXHJNKWRSACURB-RBUKOAKNSA-N 2 0 415.553 4.015 20 0 HIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+]C2CCN(Cc3ccccn3)CC2)CC1 ZINC000482628210 898230888 /nfs/dbraw/zinc/23/08/88/898230888.db2.gz IXQIQQGNEQGAOX-UHFFFAOYSA-N 2 0 413.009 4.201 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(-c2ccccc2)o1 ZINC000482816247 898426909 /nfs/dbraw/zinc/42/69/09/898426909.db2.gz BDNBECRSIWGPOY-CVDCTZTESA-N 2 0 417.553 4.495 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCc3c2cc(Br)cc3F)(N2CCCCC2)CC1 ZINC000483544289 899205378 /nfs/dbraw/zinc/20/53/78/899205378.db2.gz NHNPVBCTVGQMMZ-HXUWFJFHSA-N 2 0 424.402 4.115 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3CCCC[C@H]3C)cc2)C[C@H]1C ZINC000483697260 899354888 /nfs/dbraw/zinc/35/48/88/899354888.db2.gz DZZCQXHWOBLYQO-VIZSFHNOSA-N 2 0 400.611 4.075 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC3CC[NH+](C4CCCC4)CC3)cc2)C1 ZINC000483708338 899364521 /nfs/dbraw/zinc/36/45/21/899364521.db2.gz HTVXNMPOOZOFTL-FQEVSTJZSA-N 2 0 412.622 4.125 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2CCCC[C@H]2C)C[C@@H]1C ZINC000483715492 899372590 /nfs/dbraw/zinc/37/25/90/899372590.db2.gz YTLFKBDHNSRLCM-QTEQDKRBSA-N 2 0 400.611 4.075 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2CCCC[C@@H]2C)C[C@@H]1C ZINC000483715490 899372828 /nfs/dbraw/zinc/37/28/28/899372828.db2.gz YTLFKBDHNSRLCM-JTAQYXEDSA-N 2 0 400.611 4.075 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@H]2CCc3cc(F)ccc32)CC1 ZINC000483722510 899382166 /nfs/dbraw/zinc/38/21/66/899382166.db2.gz HOYCDPZYPNLZNP-FQEVSTJZSA-N 2 0 407.455 4.373 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCC2CC[NH+](Cc3ccccc3Cl)CC2)C[C@@H]1C ZINC000483741818 899405393 /nfs/dbraw/zinc/40/53/93/899405393.db2.gz FDWQFGGGOSZABY-GHTZIAJQSA-N 2 0 421.029 4.066 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC(CC)(CC)[NH2+][C@H](C)c2ccccc2)C[C@@H]1C ZINC000483795814 899467877 /nfs/dbraw/zinc/46/78/77/899467877.db2.gz BKXYVHSAPFJYAF-VWPQPMDRSA-N 2 0 402.627 4.410 20 0 HIADRP C[C@H]1C[C@H](N(C)C(=O)NC2CC[NH+](C3CCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000483994636 899633768 /nfs/dbraw/zinc/63/37/68/899633768.db2.gz QRBLKZLWCVNKQX-GBXCKJPGSA-N 2 0 412.622 4.088 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(-n3ccnc3)cc2C)CC1 ZINC000484068541 899701594 /nfs/dbraw/zinc/70/15/94/899701594.db2.gz BYESJGMTBAQCBR-HXUWFJFHSA-N 2 0 421.564 4.313 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(Cl)ccc1Cl ZINC000484273762 899845027 /nfs/dbraw/zinc/84/50/27/899845027.db2.gz BWSGOECSDSYSHK-CQSZACIVSA-N 2 0 400.394 4.271 20 0 HIADRP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000484294988 899858851 /nfs/dbraw/zinc/85/88/51/899858851.db2.gz CUDFRJZUEZMQRR-OAHLLOKOSA-N 2 0 408.656 4.026 20 0 HIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccc([S@@](C)=O)cc1 ZINC000484475685 899969077 /nfs/dbraw/zinc/96/90/77/899969077.db2.gz MPIGWNKQGVQEFH-AFJIDDCJSA-N 2 0 414.615 4.146 20 0 HIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccc([S@](C)=O)cc1 ZINC000484475687 899969304 /nfs/dbraw/zinc/96/93/04/899969304.db2.gz MPIGWNKQGVQEFH-WRONEBCDSA-N 2 0 414.615 4.146 20 0 HIADRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000484491089 899983055 /nfs/dbraw/zinc/98/30/55/899983055.db2.gz IYHSDXNXBQRIRF-ZDUSSCGKSA-N 2 0 411.434 4.401 20 0 HIADRP C[N@H+](CCC(=O)Nc1ccccc1C(F)(F)F)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000485432913 900729081 /nfs/dbraw/zinc/72/90/81/900729081.db2.gz DSFILUULWKNPAY-LJQANCHMSA-N 2 0 419.491 4.488 20 0 HIADRP COc1ccc(NC(=O)CC[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1Cl ZINC000485440049 900736748 /nfs/dbraw/zinc/73/67/48/900736748.db2.gz QDGJZIORMIVSFO-IBGZPJMESA-N 2 0 415.965 4.131 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000486188316 901373845 /nfs/dbraw/zinc/37/38/45/901373845.db2.gz GKXKOERLLWUVHW-BWKNWUBXSA-N 2 0 405.586 4.313 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)[C@H]2CCC[N@H+](Cc3cccc(F)c3)C2)CC1 ZINC000488692260 902945710 /nfs/dbraw/zinc/94/57/10/902945710.db2.gz ITXZNBQPJUHKDE-QHCPKHFHSA-N 2 0 423.576 4.161 20 0 HIADRP c1cc(C[NH+]2CCC[C@@]3(CCCOC3)C2)cc(C[N@@H+]2CCC[C@@]3(CCCOC3)C2)c1 ZINC000489400189 903368155 /nfs/dbraw/zinc/36/81/55/903368155.db2.gz ZGNKHSVQYRRUIH-CLJLJLNGSA-N 2 0 412.618 4.472 20 0 HIADRP Cc1ccc(-c2noc([C@H](C)[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)n2)cc1F ZINC000506027558 914710555 /nfs/dbraw/zinc/71/05/55/914710555.db2.gz MPMWVDGPNGANRH-SFHVURJKSA-N 2 0 416.541 4.070 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000489842834 903625420 /nfs/dbraw/zinc/62/54/20/903625420.db2.gz WRMVHWGPDFLBLA-AKIFATBCSA-N 2 0 424.589 4.016 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)Nc2ccn(C3CC[NH+](C)CC3)n2)c1 ZINC000490005819 903721031 /nfs/dbraw/zinc/72/10/31/903721031.db2.gz ZBFAJXBRWNWFEY-UHFFFAOYSA-N 2 0 417.557 4.034 20 0 HIADRP c1ccc(CN2CC[NH+](CCCC[NH2+][C@@H](c3ccccc3)c3ccccn3)CC2)cc1 ZINC000490129068 903782127 /nfs/dbraw/zinc/78/21/27/903782127.db2.gz CHKFJTYDIOILMF-MHZLTWQESA-N 2 0 414.597 4.359 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H](c1ccccc1)c1ccc(OC(F)F)cc1)N1CC[NH+](C)CC1 ZINC000490163838 903805478 /nfs/dbraw/zinc/80/54/78/903805478.db2.gz HVOIIKDJQOCCBI-GOTSBHOMSA-N 2 0 417.544 4.239 20 0 HIADRP Cc1ccc(-c2nnc([C@@H](C)[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)o2)cc1C ZINC000506051911 914752226 /nfs/dbraw/zinc/75/22/26/914752226.db2.gz ORTIGSSLTAIDEJ-HXUWFJFHSA-N 2 0 412.578 4.239 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000491021358 904373957 /nfs/dbraw/zinc/37/39/57/904373957.db2.gz NWJYMGIJVDQHPQ-NTKDMRAZSA-N 2 0 416.009 4.301 20 0 HIADRP COc1ccc([C@@H]([NH2+]CC2CC[NH+](CCN(C)C)CC2)c2ccccc2Cl)cc1 ZINC000491060069 904403350 /nfs/dbraw/zinc/40/33/50/904403350.db2.gz MJEKCGDUVLGHHK-XMMPIXPASA-N 2 0 416.009 4.301 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccccc1)c1ccccc1Br ZINC000492253195 904824010 /nfs/dbraw/zinc/82/40/10/904824010.db2.gz OIEAONXEHGUZJF-KNQAVFIVSA-N 2 0 417.391 4.365 20 0 HIADRP CSc1cccc([C@@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2ccc(F)c(F)c2)c1 ZINC000493056789 905004351 /nfs/dbraw/zinc/00/43/51/905004351.db2.gz KZVRXHUJEDMSON-HSZRJFAPSA-N 2 0 419.585 4.392 20 0 HIADRP CC[NH+]1CCC(CC[NH2+][C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000493276011 905073396 /nfs/dbraw/zinc/07/33/96/905073396.db2.gz FEPQZLZQOQZPFB-QHCPKHFHSA-N 2 0 418.578 4.030 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)CC3 ZINC000493307834 905081257 /nfs/dbraw/zinc/08/12/57/905081257.db2.gz WYHYPSLDWMCGFU-NRFANRHFSA-N 2 0 403.570 4.080 20 0 HIADRP COc1cc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1OCC(F)(F)F ZINC000512390324 921125502 /nfs/dbraw/zinc/12/55/02/921125502.db2.gz CHYAJZHAFOOKLN-NVXWUHKLSA-N 2 0 400.485 4.379 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CC(c3ccc(Br)cc3)C2)[C@H](C)C1 ZINC000493892941 905249718 /nfs/dbraw/zinc/24/97/18/905249718.db2.gz APQWSWARTWNLMG-RWCFQUGRSA-N 2 0 409.412 4.422 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CC(c3ccc(Br)cc3)C2)[C@H](C)C1 ZINC000493892942 905250302 /nfs/dbraw/zinc/25/03/02/905250302.db2.gz APQWSWARTWNLMG-XPVQEHEOSA-N 2 0 409.412 4.422 20 0 HIADRP C[C@H]([NH2+]CC1=Cc2cc(Br)ccc2OC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512397047 921132826 /nfs/dbraw/zinc/13/28/26/921132826.db2.gz ZJAQNQRAUMOKAY-DOTOQJQBSA-N 2 0 405.380 4.468 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Br)c(Cl)c2)CC1 ZINC000494090424 905423951 /nfs/dbraw/zinc/42/39/51/905423951.db2.gz QQUVBVLMAIRXMJ-UHFFFAOYSA-N 2 0 423.782 4.349 20 0 HIADRP Clc1ccc2c(c1)nccc2SCC[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000512479982 921189250 /nfs/dbraw/zinc/18/92/50/921189250.db2.gz KJXAGKCGFWYNJP-UHFFFAOYSA-N 2 0 405.995 4.025 20 0 HIADRP Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000495445624 906455330 /nfs/dbraw/zinc/45/53/30/906455330.db2.gz XXNZWLLDWLJTBR-HUUCEWRRSA-N 2 0 412.500 4.414 20 0 HIADRP C[C@@H](NC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H](c1ccccc1)[NH+](C)C ZINC000496652422 906731185 /nfs/dbraw/zinc/73/11/85/906731185.db2.gz RYYSPQBIQCBFAE-GIODWXBMSA-N 2 0 420.601 4.173 20 0 HIADRP O=C1CCCN1Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000512636730 921269435 /nfs/dbraw/zinc/26/94/35/921269435.db2.gz NNOWVLVZXVVSJX-TWJOJJKGSA-N 2 0 417.597 4.199 20 0 HIADRP c1cn(Cc2ccc(C[NH2+][C@@H]3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)cc2)cn1 ZINC000512648529 921274033 /nfs/dbraw/zinc/27/40/33/921274033.db2.gz NZFPGTZPFHKNBP-JIMJEQGWSA-N 2 0 400.570 4.322 20 0 HIADRP C[C@H](NC(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1)[C@@H](c1ccccc1)[NH+](C)C ZINC000497634218 907117602 /nfs/dbraw/zinc/11/76/02/907117602.db2.gz QKBLMCRWTPAVAR-SKPFHBQLSA-N 2 0 408.590 4.203 20 0 HIADRP CCN(CC[NH+]1CCCCCC1)C(=O)NC1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000497634718 907118616 /nfs/dbraw/zinc/11/86/16/907118616.db2.gz SZTLHMJDRYOXFK-OAQYLSRUSA-N 2 0 400.611 4.120 20 0 HIADRP CCC[NH+]1CCC(N(C)C(=O)NCc2ccccc2C[NH+]2CCCCCC2)CC1 ZINC000497725208 907225509 /nfs/dbraw/zinc/22/55/09/907225509.db2.gz IYEJBFKNDUYWOQ-UHFFFAOYSA-N 2 0 400.611 4.078 20 0 HIADRP CCOC1CC2(C1)CC[NH+](Cc1ccc(C[N@H+]3CCC4(CC(OCC)C4)C3)cc1)C2 ZINC000512838853 921342047 /nfs/dbraw/zinc/34/20/47/921342047.db2.gz FNMWLLKOWXULTO-UHFFFAOYSA-N 2 0 412.618 4.469 20 0 HIADRP CCCCN(C(=O)NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)[C@@H](C)c1ccccc1 ZINC000498711006 908136867 /nfs/dbraw/zinc/13/68/67/908136867.db2.gz RXPQABDSOFDJRO-QFIPXVFZSA-N 2 0 423.605 4.167 20 0 HIADRP CC[NH+]1CCN(c2ccccc2N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499118751 908475808 /nfs/dbraw/zinc/47/58/08/908475808.db2.gz RQQKUTSOOBNYMU-JOZNFPNDSA-N 2 0 404.602 4.436 20 0 HIADRP c1ccc(CC[N@@H+]2CC[C@H](CN[C@@H]3C[C@H]4CC[C@@H](C3)[NH+]4Cc3ccccc3)C2)cc1 ZINC000499156751 908513324 /nfs/dbraw/zinc/51/33/24/908513324.db2.gz MKTHMPWFBCPJTC-CWTOASCOSA-N 2 0 403.614 4.336 20 0 HIADRP COc1cc(OC)cc(OCCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499177285 908531477 /nfs/dbraw/zinc/53/14/77/908531477.db2.gz PHMPBRQCPOSESX-KOUNCHBCSA-N 2 0 410.558 4.258 20 0 HIADRP FC(F)(F)c1cccnc1OCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499188756 908542745 /nfs/dbraw/zinc/54/27/45/908542745.db2.gz LDQMUQKNXQDPRR-LDLYASANSA-N 2 0 405.464 4.264 20 0 HIADRP COc1cc(OC)cc(N2CC[C@@H]([NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499238025 908601939 /nfs/dbraw/zinc/60/19/39/908601939.db2.gz QGVUSXNWAJDLCQ-BXXSPATCSA-N 2 0 421.585 4.068 20 0 HIADRP O=C(CCc1ccccc1)N1CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000499243301 908611660 /nfs/dbraw/zinc/61/16/60/908611660.db2.gz JYKXNIRXTXWNSX-POTDNYQPSA-N 2 0 417.597 4.005 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@H](C)C[NH+]2CCCC2)cc1 ZINC000513085603 921535715 /nfs/dbraw/zinc/53/57/15/921535715.db2.gz DLGIKXNSTMFTPK-NRFANRHFSA-N 2 0 418.585 4.429 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNC(=O)NCc2cccc(C[NH+](C)C)c2)C1 ZINC000500697086 910030021 /nfs/dbraw/zinc/03/00/21/910030021.db2.gz HYFQSKLTMRFYCB-OYRHEFFESA-N 2 0 422.617 4.226 20 0 HIADRP C[N@@H+](CC(=O)N[C@@H](c1cccs1)C(C)(C)C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501028493 910246273 /nfs/dbraw/zinc/24/62/73/910246273.db2.gz ZJBDYNCWXFNADR-QFIPXVFZSA-N 2 0 414.619 4.195 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCc3ccccc3[C@@H](c3ccccc3)[C@H]2C)CC1 ZINC000501033804 910249577 /nfs/dbraw/zinc/24/95/77/910249577.db2.gz VYTMGTLCSLUEPW-YIXXDRMTSA-N 2 0 405.630 4.481 20 0 HIADRP CCN(C(=O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1cccc2ccccc21 ZINC000501040292 910254720 /nfs/dbraw/zinc/25/47/20/910254720.db2.gz PUGLLOCZIGMXEX-UHFFFAOYSA-N 2 0 416.569 4.436 20 0 HIADRP C[N@H+](CCc1nc(-c2ccc(Cl)cc2)no1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501049256 910258776 /nfs/dbraw/zinc/25/87/76/910258776.db2.gz UKPVFHXCNMOHGC-UHFFFAOYSA-N 2 0 411.937 4.176 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000501054297 910264716 /nfs/dbraw/zinc/26/47/16/910264716.db2.gz XUTHZHLKZCLQTN-DENIHFKCSA-N 2 0 421.029 4.431 20 0 HIADRP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@H+](CCCN2CC[NH+](C(C)C)CC2)C1 ZINC000501055937 910267300 /nfs/dbraw/zinc/26/73/00/910267300.db2.gz BTTCJLUNHIQGIX-JOCHJYFZSA-N 2 0 411.638 4.213 20 0 HIADRP Cc1cc(-c2noc([C@H](C)[N@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)n2)ccc1F ZINC000501078535 910278474 /nfs/dbraw/zinc/27/84/74/910278474.db2.gz JZLHQRMXIHNBDZ-KRWDZBQOSA-N 2 0 409.509 4.489 20 0 HIADRP C[C@@H](C(=O)Nc1ccccc1C(F)(F)F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501080679 910281911 /nfs/dbraw/zinc/28/19/11/910281911.db2.gz OHJNYNAEWDIRSF-INIZCTEOSA-N 2 0 420.479 4.276 20 0 HIADRP COCC[N@H+](C)CCCC1CCN([C@H](C)c2nc3sc(C)c(C)c3c(=O)[nH]2)CC1 ZINC000501788240 910841003 /nfs/dbraw/zinc/84/10/03/910841003.db2.gz DSBGBJSDWPVFIF-MRXNPFEDSA-N 2 0 420.623 4.145 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000501793555 910845779 /nfs/dbraw/zinc/84/57/79/910845779.db2.gz AQHKSJNPYFTFLB-LEWJYISDSA-N 2 0 412.603 4.021 20 0 HIADRP COc1cccc(NC(=O)[C@@H](c2ccccc2)[NH+]2CCC(CCC[NH+](C)C)CC2)c1 ZINC000501802192 910853836 /nfs/dbraw/zinc/85/38/36/910853836.db2.gz DRKLYAFTSDKYSA-XMMPIXPASA-N 2 0 409.574 4.429 20 0 HIADRP CSc1nnc(CCC[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)n1CC(C)C ZINC000513208412 921624557 /nfs/dbraw/zinc/62/45/57/921624557.db2.gz SQECCNLZVLHUAN-QUCCMNQESA-N 2 0 407.672 4.221 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N[C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000513209544 921626293 /nfs/dbraw/zinc/62/62/93/921626293.db2.gz DHTXTJGGKDBIKJ-HSZRJFAPSA-N 2 0 421.585 4.246 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C1 ZINC000502646045 911684005 /nfs/dbraw/zinc/68/40/05/911684005.db2.gz APCYTASFZZKUJN-SZPZYZBQSA-N 2 0 406.659 4.042 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NC[C@@H](c2cccc(OC)c2)[NH+]2CCCC2)cc1 ZINC000513287241 921686051 /nfs/dbraw/zinc/68/60/51/921686051.db2.gz OKSUPPFXQMULGN-DEOSSOPVSA-N 2 0 409.574 4.104 20 0 HIADRP CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)NC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000502815257 911831309 /nfs/dbraw/zinc/83/13/09/911831309.db2.gz UBOJNXAXKKIWRI-QFIPXVFZSA-N 2 0 421.029 4.237 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)C1 ZINC000502826458 911841129 /nfs/dbraw/zinc/84/11/29/911841129.db2.gz TWPAENLQTAZQNL-QFIPXVFZSA-N 2 0 422.617 4.179 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1)c1ccccc1 ZINC000503090215 912062288 /nfs/dbraw/zinc/06/22/88/912062288.db2.gz ODSIIRJNSNSVNK-SXWKCWPCSA-N 2 0 408.590 4.251 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1)c1ccccc1 ZINC000503141511 912103396 /nfs/dbraw/zinc/10/33/96/912103396.db2.gz SKZFVMMJRZEJSK-PZJWPPBQSA-N 2 0 412.578 4.235 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](Cc2cn(-c3ccccc3)nc2-c2ccncc2)CC1 ZINC000506863827 915651329 /nfs/dbraw/zinc/65/13/29/915651329.db2.gz YCFYAUVJNQCZST-UHFFFAOYSA-N 2 0 403.574 4.488 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](Cc2cn(-c3ccccc3)nc2-c2cccnc2)CC1 ZINC000506911384 915711425 /nfs/dbraw/zinc/71/14/25/915711425.db2.gz XKZFKHNTBIFJTB-UHFFFAOYSA-N 2 0 403.574 4.488 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000506940285 915746067 /nfs/dbraw/zinc/74/60/67/915746067.db2.gz NZBWQECCDOGFRO-VXKWHMMOSA-N 2 0 414.638 4.324 20 0 HIADRP C[C@H]([NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)c1ccc(Cl)cc1 ZINC000506947683 915752958 /nfs/dbraw/zinc/75/29/58/915752958.db2.gz OUBYWSUYPBDLJT-INIZCTEOSA-N 2 0 403.979 4.178 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000506957648 915764664 /nfs/dbraw/zinc/76/46/64/915764664.db2.gz XDHOAJBXSURFDC-XUZZJYLKSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)c1cccc(N2CCCC2=O)c1 ZINC000507469649 916237019 /nfs/dbraw/zinc/23/70/19/916237019.db2.gz KXRVQWOZHIJGBU-XAHYKELJSA-N 2 0 403.570 4.375 20 0 HIADRP FC(F)n1c2ccccc2nc1CC[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000507469399 916237678 /nfs/dbraw/zinc/23/76/78/916237678.db2.gz KAIRUQKKFFUBEF-XUVXKRRUSA-N 2 0 410.512 4.474 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@H]34)ccc2NC1=O ZINC000507487942 916254550 /nfs/dbraw/zinc/25/45/50/916254550.db2.gz SODZGNFRFWSADA-JDVFBPCKSA-N 2 0 419.569 4.357 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccncc1 ZINC000507654489 916416996 /nfs/dbraw/zinc/41/69/96/916416996.db2.gz UNPJLUAZJAFJGE-GOSISDBHSA-N 2 0 406.496 4.353 20 0 HIADRP C[C@@H](c1ccc(F)c(Cl)c1)[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000507914135 916792627 /nfs/dbraw/zinc/79/26/27/916792627.db2.gz PDOXIAYLSQOIKH-KRWDZBQOSA-N 2 0 409.977 4.244 20 0 HIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]C3CCC(C(=O)OC(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000507936322 916807265 /nfs/dbraw/zinc/80/72/65/916807265.db2.gz PTFHLOMRGMCCOP-NAMINWQUSA-N 2 0 416.606 4.286 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](CCC(=O)NC(c2ccccc2)c2ccccc2)CC1 ZINC000507965356 916818479 /nfs/dbraw/zinc/81/84/79/916818479.db2.gz JURSBIKFKXVGCD-UHFFFAOYSA-N 2 0 407.602 4.336 20 0 HIADRP C[C@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508714573 917474743 /nfs/dbraw/zinc/47/47/43/917474743.db2.gz HLSFVWCSAVWUPW-OFVILXPXSA-N 2 0 407.602 4.213 20 0 HIADRP COc1cccc([C@H](CN[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)c1 ZINC000508718547 917481275 /nfs/dbraw/zinc/48/12/75/917481275.db2.gz NYRYUPISEFJWPR-CVJWPJSTSA-N 2 0 407.602 4.332 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccccc2Br)cc1 ZINC000509475073 918121547 /nfs/dbraw/zinc/12/15/47/918121547.db2.gz GEIAQLAFVKSRCH-SFHVURJKSA-N 2 0 416.407 4.232 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000509586646 918235017 /nfs/dbraw/zinc/23/50/17/918235017.db2.gz ICJSLGRAMUHYKM-JAXLGGSGSA-N 2 0 412.578 4.015 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N(C)[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000509613191 918260289 /nfs/dbraw/zinc/26/02/89/918260289.db2.gz JNCWOLCIUSKGME-BVSLBCMMSA-N 2 0 412.578 4.015 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000510334409 918838565 /nfs/dbraw/zinc/83/85/65/918838565.db2.gz RLYZNQNMBQMUGS-UHFFFAOYSA-N 2 0 405.542 4.410 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NC[C@@H](c1ccc(C)o1)[NH+]1CCCC1 ZINC000510461896 918917676 /nfs/dbraw/zinc/91/76/76/918917676.db2.gz NPVKHWJXRZMYNQ-QFIPXVFZSA-N 2 0 412.578 4.066 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCc4ccc(Br)cc43)cc2)CC1 ZINC000510673108 919112764 /nfs/dbraw/zinc/11/27/64/919112764.db2.gz YTSIQNYFLMITER-JOCHJYFZSA-N 2 0 415.375 4.183 20 0 HIADRP O=C(Nc1ccccc1)N1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000511030420 919608145 /nfs/dbraw/zinc/60/81/45/919608145.db2.gz LGYAWUNXQBXKNG-XQUALCHDSA-N 2 0 404.558 4.078 20 0 HIADRP C[C@@H](NC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511286647 919881997 /nfs/dbraw/zinc/88/19/97/919881997.db2.gz MIESOLLTOAXFBJ-QUCCMNQESA-N 2 0 421.029 4.066 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000511375898 919975140 /nfs/dbraw/zinc/97/51/40/919975140.db2.gz FVCJVALODMVCMG-ZEQRLZLVSA-N 2 0 416.009 4.342 20 0 HIADRP C[C@@H](NC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000511399474 920011594 /nfs/dbraw/zinc/01/15/94/920011594.db2.gz JJZCRIWXSMXYNG-NQAHQMCFSA-N 2 0 424.633 4.134 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccc(N3CC[NH+](C)CC3)cc2C)cc1 ZINC000511411578 920024345 /nfs/dbraw/zinc/02/43/45/920024345.db2.gz AQUVTCSIUHYTLG-UHFFFAOYSA-N 2 0 408.590 4.231 20 0 HIADRP C[C@H](NC(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000511449129 920058155 /nfs/dbraw/zinc/05/81/55/920058155.db2.gz MZAWBMKKXXFKTF-PSHVLCQKSA-N 2 0 418.651 4.083 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@@H](c2ccccc2OC)[NH+]2CCCC2)cc1)C1CC1 ZINC000511529427 920148615 /nfs/dbraw/zinc/14/86/15/920148615.db2.gz QMCQBHGYPDYWMR-DEOSSOPVSA-N 2 0 421.585 4.246 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000511803587 920497912 /nfs/dbraw/zinc/49/79/12/920497912.db2.gz ZEGNLXIRJBSBDN-DEOSSOPVSA-N 2 0 405.586 4.313 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000511809048 920506652 /nfs/dbraw/zinc/50/66/52/920506652.db2.gz ROPKDFMBNARVBB-VWLOTQADSA-N 2 0 419.613 4.316 20 0 HIADRP Cc1cc([C@@H](C)[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)sc1Br ZINC000512135559 920882987 /nfs/dbraw/zinc/88/29/87/920882987.db2.gz LYORWMOINQWIKU-MRXNPFEDSA-N 2 0 423.424 4.077 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)CC2(C)C)C1 ZINC000512137935 920883883 /nfs/dbraw/zinc/88/38/83/920883883.db2.gz JPNYTCVVNFELKW-JTHBVZDNSA-N 2 0 414.638 4.098 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000512150902 920892295 /nfs/dbraw/zinc/89/22/95/920892295.db2.gz XCLGMZXRTHHMFK-PVUWLOKVSA-N 2 0 403.876 4.292 20 0 HIADRP COc1ccc(-c2n[nH]cc2C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513544985 921883316 /nfs/dbraw/zinc/88/33/16/921883316.db2.gz NNYZFZZXMQQLCO-FPOVZHCZSA-N 2 0 404.558 4.476 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccccc2OC(F)(F)F)C[C@H](C)O1 ZINC000513588048 921919917 /nfs/dbraw/zinc/91/99/17/921919917.db2.gz GVQCUSBGEKKPRL-CALCHBBNSA-N 2 0 408.464 4.484 20 0 HIADRP Cc1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000513588092 921920536 /nfs/dbraw/zinc/92/05/36/921920536.db2.gz HTDHRCJPVQRDEO-ACRUOGEOSA-N 2 0 409.574 4.111 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC(=O)Nc2ccc(F)c(F)c2F)CC1 ZINC000513698317 922019021 /nfs/dbraw/zinc/01/90/21/922019021.db2.gz ZDRGRYOMRQZOBE-UHFFFAOYSA-N 2 0 405.464 4.075 20 0 HIADRP c1ncn(Cc2ccc(C[NH2+][C@@H]3CCCC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)cc2)n1 ZINC000513761153 922079996 /nfs/dbraw/zinc/07/99/96/922079996.db2.gz MJGRREQINJRLCO-KKUQBAQOSA-N 2 0 415.585 4.107 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NCc1ccccc1C[NH+]1CCCCC1)c1ccco1 ZINC000514009384 922333615 /nfs/dbraw/zinc/33/36/15/922333615.db2.gz DPSXGPQLWDIPJF-QFIPXVFZSA-N 2 0 412.578 4.148 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)c1ccco1 ZINC000514029347 922352256 /nfs/dbraw/zinc/35/22/56/922352256.db2.gz PWSYEUAQXWKNDQ-QFIPXVFZSA-N 2 0 412.578 4.148 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000514033850 922355272 /nfs/dbraw/zinc/35/52/72/922355272.db2.gz ZNTSZGXYCONFGT-SQJMNOBHSA-N 2 0 420.601 4.307 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000514033848 922356117 /nfs/dbraw/zinc/35/61/17/922356117.db2.gz ZNTSZGXYCONFGT-BWKNWUBXSA-N 2 0 420.601 4.307 20 0 HIADRP CCCN(C(=O)NC1CC[NH+](CC(C)C)CC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000514061429 922384846 /nfs/dbraw/zinc/38/48/46/922384846.db2.gz GOHHZEOWWRPTFG-XMMPIXPASA-N 2 0 414.638 4.193 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H](c2cccs2)N2CCOCC2)CC1 ZINC000514096237 922421465 /nfs/dbraw/zinc/42/14/65/922421465.db2.gz VQJRTKJAVTYNJI-XPPIMPSXSA-N 2 0 413.631 4.154 20 0 HIADRP O=C(c1ccccc1)N1CC[C@@H](C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)C1 ZINC000514118471 922452312 /nfs/dbraw/zinc/45/23/12/922452312.db2.gz JIQQJHSBYSIGTH-DEOSSOPVSA-N 2 0 417.597 4.137 20 0 HIADRP C[NH+]1CCC(N(Cc2ccco2)C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000514579368 922716000 /nfs/dbraw/zinc/71/60/00/922716000.db2.gz WHYQATVDJPGBMC-UHFFFAOYSA-N 2 0 424.589 4.072 20 0 HIADRP COc1cccc(OC)c1OCCCC[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000514689058 922756287 /nfs/dbraw/zinc/75/62/87/922756287.db2.gz SWJMZJAYAMVSSQ-SFTDATJTSA-N 2 0 404.595 4.449 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(=O)Nc1ccc(F)c(F)c1 ZINC000515518755 923149898 /nfs/dbraw/zinc/14/98/98/923149898.db2.gz NDLLWNWSWNJYNT-DLBZAZTESA-N 2 0 401.501 4.314 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2ccccc2Br)c1 ZINC000515526083 923155675 /nfs/dbraw/zinc/15/56/75/923155675.db2.gz BGCUSPTZNRAHCH-INIZCTEOSA-N 2 0 418.379 4.408 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H](c1ccc(Br)s1)C1CC1 ZINC000516440712 923734590 /nfs/dbraw/zinc/73/45/90/923734590.db2.gz HLHDCLFEYMVJIY-LJQANCHMSA-N 2 0 424.408 4.477 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H](c1ccc(Br)s1)C1CC1 ZINC000516440708 923734943 /nfs/dbraw/zinc/73/49/43/923734943.db2.gz HLHDCLFEYMVJIY-IBGZPJMESA-N 2 0 424.408 4.477 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NCc2cccc(C[NH+](C)C)c2)c2ccccc2)CC1 ZINC000516559921 923796118 /nfs/dbraw/zinc/79/61/18/923796118.db2.gz FEGJKEQTUGJQNU-DEOSSOPVSA-N 2 0 408.590 4.021 20 0 HIADRP O[C@H](C[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)COCc1ccccc1Cl ZINC000516709654 923857285 /nfs/dbraw/zinc/85/72/85/923857285.db2.gz NPFWILIUCAEBIQ-FYYLOGMGSA-N 2 0 416.993 4.109 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1Cl ZINC000517104062 923998546 /nfs/dbraw/zinc/99/85/46/923998546.db2.gz PDXICXQYWXGZOQ-WIYYLYMNSA-N 2 0 409.018 4.143 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)c1ccc(C[NH+]2CCSCC2)cc1)c1ccccc1 ZINC000517566333 926683410 /nfs/dbraw/zinc/68/34/10/926683410.db2.gz KQKZZLQFILLDGS-IBGZPJMESA-N 2 0 411.615 4.095 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2c[nH]nc2-c2ccc(Cl)cc2)[C@@H](c2ccccc2)C1 ZINC000518767810 927483508 /nfs/dbraw/zinc/48/35/08/927483508.db2.gz SJMTWCJGIOFTEL-HSZRJFAPSA-N 2 0 423.992 4.199 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+]Cc1c(Cl)cccc1OCc1ccccc1Cl ZINC000518793998 927496539 /nfs/dbraw/zinc/49/65/39/927496539.db2.gz IWMDMXIQCRJCOB-QGZVFWFLSA-N 2 0 422.400 4.298 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(Br)c2)CC1 ZINC000520044750 928268329 /nfs/dbraw/zinc/26/83/29/928268329.db2.gz SKQFEXYAABWRCI-INIZCTEOSA-N 2 0 410.400 4.220 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCNC(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000520726335 928775904 /nfs/dbraw/zinc/77/59/04/928775904.db2.gz LIOUCKGAWPZYPA-IBGZPJMESA-N 2 0 421.029 4.116 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1)c1ccsc1 ZINC000520953455 928887617 /nfs/dbraw/zinc/88/76/17/928887617.db2.gz HGJIKVXGAPRCHL-UGKGYDQZSA-N 2 0 417.594 4.299 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1NC[C@H]1C[NH+](Cc2ccccc2)CCCO1 ZINC000521282898 929098954 /nfs/dbraw/zinc/09/89/54/929098954.db2.gz VJVWNVYUHYTLOS-IZZNHLLZSA-N 2 0 421.629 4.168 20 0 HIADRP CC[NH+](CC)CCOc1ccc(NC(=O)N2CCC[N@H+](Cc3ccccc3)CC2)cc1 ZINC000521959715 929596198 /nfs/dbraw/zinc/59/61/98/929596198.db2.gz QYVJSNOQDGLTSE-UHFFFAOYSA-N 2 0 424.589 4.147 20 0 HIADRP C[NH+](C)CCn1ccc2ccc(NC(=O)C3CC[NH+](Cc4ccccc4)CC3)cc21 ZINC000524818945 929842280 /nfs/dbraw/zinc/84/22/80/929842280.db2.gz RXIGVTCHFWGKFM-UHFFFAOYSA-N 2 0 404.558 4.054 20 0 HIADRP CC(C)=CCSc1ccccc1C(=O)NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000524938150 929899865 /nfs/dbraw/zinc/89/98/65/929899865.db2.gz PTNGCVKZIHFKFA-UHFFFAOYSA-N 2 0 424.614 4.082 20 0 HIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC1 ZINC000525636975 930376607 /nfs/dbraw/zinc/37/66/07/930376607.db2.gz UJOZDERZQDLQOP-LJQANCHMSA-N 2 0 401.639 4.461 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000526945020 930554242 /nfs/dbraw/zinc/55/42/42/930554242.db2.gz KSTLHYIDFSFANV-RBUKOAKNSA-N 2 0 400.588 4.173 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccccc2C[N@H+]2CCCC[C@@H]2C)CC1 ZINC000530727773 930809764 /nfs/dbraw/zinc/80/97/64/930809764.db2.gz RFQBXIPOPREVSX-NRFANRHFSA-N 2 0 420.601 4.297 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ncc(-c4ccc(F)cc4)o3)CC2)CC1 ZINC000531429796 931053285 /nfs/dbraw/zinc/05/32/85/931053285.db2.gz WUDGZHRPOLNBJG-UHFFFAOYSA-N 3 0 414.569 4.109 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3ccc(OC)c(Cl)c3)cc2)CC1 ZINC000531682579 931150494 /nfs/dbraw/zinc/15/04/94/931150494.db2.gz VVTURODFEAKLAD-GOSISDBHSA-N 2 0 401.982 4.337 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3ccc(-n4ccnc4C)cc3)cc2)CC1 ZINC000531682134 931150518 /nfs/dbraw/zinc/15/05/18/931150518.db2.gz YUQRYTURDRCROU-OAQYLSRUSA-N 2 0 417.601 4.169 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531682248 931151045 /nfs/dbraw/zinc/15/10/45/931151045.db2.gz XVFJVRWSPOIUKD-MOPGFXCFSA-N 2 0 400.588 4.173 20 0 HIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]C[C@H](c2cccc(F)c2)N2CCOCC2)cc1 ZINC000531697149 931161166 /nfs/dbraw/zinc/16/11/66/931161166.db2.gz ZMJQVBSPESLMQN-MHECFPHRSA-N 2 0 408.521 4.044 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccccc1OCc1ccccc1 ZINC000531941789 931255127 /nfs/dbraw/zinc/25/51/27/931255127.db2.gz XWYFLNGIYMBTOC-OAQYLSRUSA-N 2 0 416.569 4.263 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000531944388 931257009 /nfs/dbraw/zinc/25/70/09/931257009.db2.gz NBYYACFABKBQDI-LJQANCHMSA-N 2 0 413.993 4.463 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531945157 931257887 /nfs/dbraw/zinc/25/78/87/931257887.db2.gz CAXSSXCGORGYPT-GUDVDZBRSA-N 2 0 407.558 4.031 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]C3CCN(c4ccccc4)CC3)CC2)c1 ZINC000531944965 931257952 /nfs/dbraw/zinc/25/79/52/931257952.db2.gz NBKMECZKILEQSN-UHFFFAOYSA-N 2 0 406.618 4.156 20 0 HIADRP C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531966889 931269608 /nfs/dbraw/zinc/26/96/08/931269608.db2.gz WWSVHHVXXKBHGR-AWEZNQCLSA-N 2 0 411.443 4.413 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CCc3ccccc3)c3ccccc3)cn2)CC1 ZINC000531989566 931278611 /nfs/dbraw/zinc/27/86/11/931278611.db2.gz KUTFZEBXPZPMBH-RUZDIDTESA-N 2 0 400.570 4.297 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+]Cc2cccc(OCCCc3ccccc3)c2)CC1 ZINC000532016274 931285147 /nfs/dbraw/zinc/28/51/47/931285147.db2.gz YBRMHKQDWYRPAR-CLJLJLNGSA-N 2 0 408.586 4.166 20 0 HIADRP CN(C)c1cc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c2ccccc2n1 ZINC000532105327 931313609 /nfs/dbraw/zinc/31/36/09/931313609.db2.gz MBTYWOHJAQYBJT-UHFFFAOYSA-N 2 0 417.601 4.121 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000532205251 931349391 /nfs/dbraw/zinc/34/93/91/931349391.db2.gz AOCBEKQJWHXGGK-IBGZPJMESA-N 2 0 400.588 4.317 20 0 HIADRP CSc1ccc([C@@H](C)[NH2+]Cc2cccc(OCCN3CCOCC3)c2)cc1F ZINC000532211955 931353939 /nfs/dbraw/zinc/35/39/39/931353939.db2.gz ILFFFTCTMGMCLY-QGZVFWFLSA-N 2 0 404.551 4.109 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000532222658 931360767 /nfs/dbraw/zinc/36/07/67/931360767.db2.gz BAOIMRZFDYESQQ-INIZCTEOSA-N 2 0 405.945 4.068 20 0 HIADRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000532374146 931414267 /nfs/dbraw/zinc/41/42/67/931414267.db2.gz HZFMDLZGNLHJMM-UHFFFAOYSA-N 2 0 422.548 4.003 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCCO2)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000532483202 931456259 /nfs/dbraw/zinc/45/62/59/931456259.db2.gz WGCNAPBBOBOUGX-ZWKOTPCHSA-N 2 0 413.537 4.151 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)OCCCO2 ZINC000532483199 931456490 /nfs/dbraw/zinc/45/64/90/931456490.db2.gz WGCNAPBBOBOUGX-MSOLQXFVSA-N 2 0 413.537 4.151 20 0 HIADRP CCc1ccc([C@H](NC(=O)C[NH+]2CCC(CC[NH+](C)C)CC2)c2cccs2)cc1 ZINC000532486227 931457327 /nfs/dbraw/zinc/45/73/27/931457327.db2.gz LIBGRLDNOCEISM-DEOSSOPVSA-N 2 0 413.631 4.180 20 0 HIADRP O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H]([NH2+]CCCCC[NH+]2CCCCC2)C1 ZINC000532762649 931624947 /nfs/dbraw/zinc/62/49/47/931624947.db2.gz ZFXYBMNUCVBGIK-LEWJYISDSA-N 2 0 411.590 4.230 20 0 HIADRP COc1ccc(NC(=O)CC[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)cc1 ZINC000532986614 931727111 /nfs/dbraw/zinc/72/71/11/931727111.db2.gz JEFGEYRQXHBDDD-RUZDIDTESA-N 2 0 407.558 4.012 20 0 HIADRP CCC1(C[NH2+]Cc2ccc(OC)c(OC)c2OC)CC[NH+](Cc2ccccc2)CC1 ZINC000533125619 931775923 /nfs/dbraw/zinc/77/59/23/931775923.db2.gz TUHHWCKOHZLNCR-UHFFFAOYSA-N 2 0 412.574 4.494 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(OCc3nccn3C)cc2)CC1 ZINC000533342000 931842511 /nfs/dbraw/zinc/84/25/11/931842511.db2.gz HOELKSPMEHHFDJ-NRFANRHFSA-N 2 0 410.606 4.476 20 0 HIADRP COCCC[NH+]1CCC([NH2+][C@H]2CCc3c2cc(Cl)cc3Br)CC1 ZINC000534058865 932238341 /nfs/dbraw/zinc/23/83/41/932238341.db2.gz HGKVIEAHXHBQHH-SFHVURJKSA-N 2 0 401.776 4.180 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCc3c2cc(Br)cc3Cl)CC1 ZINC000534058728 932238435 /nfs/dbraw/zinc/23/84/35/932238435.db2.gz MXTRYNOTGWIGEE-LJQANCHMSA-N 2 0 414.819 4.097 20 0 HIADRP O=C([C@@H]1CCC[N@@H+]1Cc1ccccc1)N1CCC2(CC[NH+](Cc3ccccc3)C2)CC1 ZINC000534247995 932363510 /nfs/dbraw/zinc/36/35/10/932363510.db2.gz LMWHKCJSNSRFAW-VWLOTQADSA-N 2 0 417.597 4.166 20 0 HIADRP c1cc(C[N@@H+]2CC[C@H](C3CCOCC3)C2)ccc1C[NH+]1CC[C@H](C2CCOCC2)C1 ZINC000534380282 932407784 /nfs/dbraw/zinc/40/77/84/932407784.db2.gz FIJYKIOGPSYAKK-UIOOFZCWSA-N 2 0 412.618 4.184 20 0 HIADRP C[C@H](C(=O)N(C)Cc1ccccc1)[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534964752 932863795 /nfs/dbraw/zinc/86/37/95/932863795.db2.gz BLZSUSALOKRNHK-JOCHJYFZSA-N 2 0 405.586 4.022 20 0 HIADRP CC1CCC([NH+]2CCN(CCCCN3CC[NH+](C4CCC(C)CC4)CC3)CC2)CC1 ZINC000535011370 932885128 /nfs/dbraw/zinc/88/51/28/932885128.db2.gz UUVUKDJGNOZSTI-UHFFFAOYSA-N 2 0 418.714 4.159 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CC[NH+](C)[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000535434062 933133495 /nfs/dbraw/zinc/13/34/95/933133495.db2.gz CJKDZTLKENCSDL-GATIMQMVSA-N 2 0 420.601 4.126 20 0 HIADRP C[NH+](C)CCOc1cccc(CN[C@H]2CCc3c2c(Br)ccc3F)c1 ZINC000535509298 933203380 /nfs/dbraw/zinc/20/33/80/933203380.db2.gz RWGHWFMMDSGXHW-IBGZPJMESA-N 2 0 407.327 4.306 20 0 HIADRP O=C(NC1CC[NH+](C2CCCC2)CC1)N1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000535676782 933326552 /nfs/dbraw/zinc/32/65/52/933326552.db2.gz QFGALRBLLDQACG-UHFFFAOYSA-N 2 0 424.633 4.091 20 0 HIADRP Cn1nccc1[C@@H]1CCC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000562617677 945109070 /nfs/dbraw/zinc/10/90/70/945109070.db2.gz RXEIXVROQPOISE-DHIUTWEWSA-N 2 0 410.606 4.107 20 0 HIADRP Cn1nccc1[C@@H]1CCC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000562617679 945109095 /nfs/dbraw/zinc/10/90/95/945109095.db2.gz RXEIXVROQPOISE-PKTZIBPZSA-N 2 0 410.606 4.107 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)N(C)CC[C@@H]3CCCC[N@@H+]3C)c2)CC1 ZINC000537671803 938350892 /nfs/dbraw/zinc/35/08/92/938350892.db2.gz QXKZFXSMQIJPDD-QHCPKHFHSA-N 2 0 400.611 4.299 20 0 HIADRP CC[C@@H]([NH2+]Cc1c(Cl)cccc1N1CC[NH+](C)CC1)c1ccc2c(c1)OCCO2 ZINC000537749532 938369150 /nfs/dbraw/zinc/36/91/50/938369150.db2.gz QSUWCSOKWQCCII-HXUWFJFHSA-N 2 0 415.965 4.104 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC1)CC1CC1 ZINC000537819007 938383617 /nfs/dbraw/zinc/38/36/17/938383617.db2.gz XJXQHYJUWWJHOD-RUZDIDTESA-N 2 0 411.634 4.259 20 0 HIADRP Cc1ccc([C@H](C)NC(=O)C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1C ZINC000537840987 938387228 /nfs/dbraw/zinc/38/72/28/938387228.db2.gz ILFXFDRPSHWDGN-NRFANRHFSA-N 2 0 408.590 4.114 20 0 HIADRP COc1ccc(-c2cnc(C[N@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)o2)cc1 ZINC000537843134 938387530 /nfs/dbraw/zinc/38/75/30/938387530.db2.gz KALOPUHWYKDXQR-UHFFFAOYSA-N 2 0 406.530 4.484 20 0 HIADRP CCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cc1OCCC ZINC000537957913 938433272 /nfs/dbraw/zinc/43/32/72/938433272.db2.gz YNCYNNLGOPGDBC-BWAGFHJFSA-N 2 0 404.595 4.293 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1 ZINC000537992165 938453807 /nfs/dbraw/zinc/45/38/07/938453807.db2.gz YUXFITAMYWZLEG-OFVILXPXSA-N 2 0 405.586 4.313 20 0 HIADRP CC(C)Oc1cccc([C@H](C)[NH2+][C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000538124879 938511685 /nfs/dbraw/zinc/51/16/85/938511685.db2.gz OHARTUFZJWPORP-SFTDATJTSA-N 2 0 423.601 4.294 20 0 HIADRP Cc1nccn1-c1ccc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1F ZINC000538276742 938581699 /nfs/dbraw/zinc/58/16/99/938581699.db2.gz REWGNVUOQLLIIC-JOCHJYFZSA-N 2 0 420.532 4.398 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]C[C@H]1CCCN1Cc1ccccc1)c1ccccc1O2 ZINC000538295936 938585871 /nfs/dbraw/zinc/58/58/71/938585871.db2.gz NCFSCOZRZWKQLU-ISKFKSNPSA-N 2 0 405.586 4.229 20 0 HIADRP COc1ccc(C[C@H](C)[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1OC ZINC000538299311 938586710 /nfs/dbraw/zinc/58/67/10/938586710.db2.gz TXNWNXCOTVMVAQ-GHTZIAJQSA-N 2 0 410.558 4.213 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cc3cccc(OC)c3o2)CC1 ZINC000538398432 938611326 /nfs/dbraw/zinc/61/13/26/938611326.db2.gz MCPLWIDSDOYHST-IBGZPJMESA-N 2 0 407.558 4.430 20 0 HIADRP C/C(=C\c1ccccc1)C[NH+]1CCC(C(=O)NCC[N@@H+](C)Cc2ccccc2)CC1 ZINC000538734840 938696485 /nfs/dbraw/zinc/69/64/85/938696485.db2.gz GCXWVZOCFWBNLL-ZBJSNUHESA-N 2 0 405.586 4.050 20 0 HIADRP CC[C@@H]([NH2+][C@@H](C)c1ccc(S(=O)(=O)NCCC[NH+](C)C)cc1)c1ccc(C)cc1 ZINC000539041148 938778022 /nfs/dbraw/zinc/77/80/22/938778022.db2.gz SOYDDGNNIJMYBA-WMZHIEFXSA-N 2 0 417.619 4.027 20 0 HIADRP COc1ccc(OC)c(NC(=O)C[C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000539047009 938781963 /nfs/dbraw/zinc/78/19/63/938781963.db2.gz QALZSOUCPKIFAX-HDYDNRTBSA-N 2 0 417.594 4.054 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]Cc1ccnc(OCC[NH+](C)C)c1 ZINC000539058579 938786652 /nfs/dbraw/zinc/78/66/52/938786652.db2.gz IFULMHYHYWCLIW-OAHLLOKOSA-N 2 0 414.550 4.444 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc(-n2cccn2)cc1 ZINC000539091145 938801018 /nfs/dbraw/zinc/80/10/18/938801018.db2.gz SUYKIOBUFYPWBX-JOCHJYFZSA-N 2 0 403.574 4.125 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](c3ccc(Cl)c(Cl)c3)C3CC3)cn2)CC1 ZINC000539164694 938814712 /nfs/dbraw/zinc/81/47/12/938814712.db2.gz WAILHGCGCUBLKX-OAQYLSRUSA-N 2 0 405.373 4.381 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](c3ccc(Cl)c(Cl)c3)C3CC3)cn2)CC1 ZINC000539164692 938814796 /nfs/dbraw/zinc/81/47/96/938814796.db2.gz WAILHGCGCUBLKX-NRFANRHFSA-N 2 0 405.373 4.381 20 0 HIADRP CN(C)C(=O)N1CCC([NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000539309416 938838519 /nfs/dbraw/zinc/83/85/19/938838519.db2.gz RCPFMFSJZWDOSX-UHFFFAOYSA-N 2 0 420.601 4.185 20 0 HIADRP C[N@H+](CCc1cccc(NC(=O)c2ccc(C[NH+]3CCSCC3)cc2)c1)C1CC1 ZINC000539330067 938842952 /nfs/dbraw/zinc/84/29/52/938842952.db2.gz AGHCEJPQHITOQW-UHFFFAOYSA-N 2 0 409.599 4.124 20 0 HIADRP COc1cccc(N2CC[C@@H](C[NH2+][C@H]3CC4(CC[NH+](C)CC4)Oc4ccccc43)C2)c1 ZINC000539363710 938849157 /nfs/dbraw/zinc/84/91/57/938849157.db2.gz QSWZXPDSKAJQRK-RDPSFJRHSA-N 2 0 421.585 4.099 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]C[C@H](c1ccccc1)N1CCCC1)c1ccccc1O2 ZINC000539369081 938850192 /nfs/dbraw/zinc/85/01/92/938850192.db2.gz BEWYYJBAPYFRAD-DNQXCXABSA-N 2 0 405.586 4.401 20 0 HIADRP CC[C@@H]([NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1ccc2c(c1)OCCO2 ZINC000539393253 938853772 /nfs/dbraw/zinc/85/37/72/938853772.db2.gz LJWNVOAIIKVVJW-NHCUHLMSSA-N 2 0 408.542 4.487 20 0 HIADRP Cc1cc(C)n2c(C[NH2+]CCCC[NH+]3CCC(Cc4ccccc4)CC3)cnc2n1 ZINC000539506160 938870390 /nfs/dbraw/zinc/87/03/90/938870390.db2.gz WBCIWZXBVBPIFM-UHFFFAOYSA-N 2 0 405.590 4.171 20 0 HIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)cc1 ZINC000539609424 938887551 /nfs/dbraw/zinc/88/75/51/938887551.db2.gz GXDZGKACNAGTGV-DQEYMECFSA-N 2 0 423.601 4.191 20 0 HIADRP C[C@@H](Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000539630413 938890459 /nfs/dbraw/zinc/89/04/59/938890459.db2.gz PZPPGALGQGTDFT-OAQYLSRUSA-N 2 0 422.617 4.332 20 0 HIADRP c1cc(C[NH+]2CCC[C@@H]2C2CCOCC2)cc(C[N@@H+]2CCC[C@@H]2C2CCOCC2)c1 ZINC000539727757 938914516 /nfs/dbraw/zinc/91/45/16/938914516.db2.gz QZMPOTLNXFIBOR-CLJLJLNGSA-N 2 0 412.618 4.469 20 0 HIADRP c1cc(C[NH+]2CCC[C@@H]2C2CCOCC2)cc(C[N@@H+]2CCC[C@H]2C2CCOCC2)c1 ZINC000539727759 938914625 /nfs/dbraw/zinc/91/46/25/938914625.db2.gz QZMPOTLNXFIBOR-WMPKNSHKSA-N 2 0 412.618 4.469 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cc(C(F)(F)F)ccc3F)CC2)CC1 ZINC000539822693 938945232 /nfs/dbraw/zinc/94/52/32/938945232.db2.gz RERWRGBCUJUZLP-UHFFFAOYSA-N 2 0 415.519 4.473 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)N(CC[NH+](C)C)Cc3ccco3)c2)CC1 ZINC000539871792 938962809 /nfs/dbraw/zinc/96/28/09/938962809.db2.gz FMCUODAXJDGSFL-UHFFFAOYSA-N 2 0 412.578 4.150 20 0 HIADRP COCCc1nc(C)c([C@H](C)[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000539969964 938982557 /nfs/dbraw/zinc/98/25/57/938982557.db2.gz YIBSXNMBGHPVHP-LNLFQRSKSA-N 2 0 401.620 4.448 20 0 HIADRP COc1ccc(-c2noc([C@@H](C)[N@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)n2)cc1 ZINC000540042398 939046379 /nfs/dbraw/zinc/04/63/79/939046379.db2.gz DFOOOPMDQFAKQN-GOSISDBHSA-N 2 0 421.545 4.440 20 0 HIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]Cc1ccnc(OCC[NH+](C)C)c1 ZINC000540157608 939094761 /nfs/dbraw/zinc/09/47/61/939094761.db2.gz NQNZOWPQLOYZOS-HNNXBMFYSA-N 2 0 414.550 4.444 20 0 HIADRP C[C@@H](CCc1ccc(Cl)s1)[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000540169713 939101956 /nfs/dbraw/zinc/10/19/56/939101956.db2.gz IBSJSCVSGSCBBB-KRWDZBQOSA-N 2 0 420.022 4.338 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)cc1 ZINC000540172967 939102970 /nfs/dbraw/zinc/10/29/70/939102970.db2.gz GRMCBZQNGBUWNB-HXUWFJFHSA-N 2 0 406.357 4.062 20 0 HIADRP CC(C)[C@H]([NH2+]CCCN1CC[N@H+](C)C[C@@H]1c1ccccc1)c1ccc2[nH]c(=O)oc2c1 ZINC000540260242 939176225 /nfs/dbraw/zinc/17/62/25/939176225.db2.gz BDDDIOWSDFOYHK-VWNXMTODSA-N 2 0 422.573 4.199 20 0 HIADRP CC(C)[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1 ZINC000540302607 939187946 /nfs/dbraw/zinc/18/79/46/939187946.db2.gz PTWSLEWXVQXTBN-NRFANRHFSA-N 2 0 401.986 4.019 20 0 HIADRP CC(C[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)C[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000540389411 939227141 /nfs/dbraw/zinc/22/71/41/939227141.db2.gz MLPMNIJQGVPLTD-VEYUFSJPSA-N 2 0 408.586 4.357 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CCCc3cc(F)ccc32)c1)C1CCOCC1 ZINC000540416654 939240944 /nfs/dbraw/zinc/24/09/44/939240944.db2.gz VIISZWYOFUQNHU-VWLOTQADSA-N 2 0 412.549 4.483 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]C[C@H]1CCN(c3ccc(F)cc3)C1)c1ccccc1O2 ZINC000540475385 939266923 /nfs/dbraw/zinc/26/69/23/939266923.db2.gz UIMFEMQPMSERPN-AUSIDOKSSA-N 2 0 409.549 4.230 20 0 HIADRP CN(C)[C@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1c(F)cccc1F ZINC000540493078 939273831 /nfs/dbraw/zinc/27/38/31/939273831.db2.gz SDGKACMOSKNGLI-NHCUHLMSSA-N 2 0 415.528 4.145 20 0 HIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)CN1Cc1ccccc1 ZINC000540494350 939274974 /nfs/dbraw/zinc/27/49/74/939274974.db2.gz XSDPYBDZBDYTMQ-JCTONOIOSA-N 2 0 405.586 4.227 20 0 HIADRP C[C@@H]1C[C@H]1[C@@H]([NH2+]CC(=O)Nc1nc(CN2CCCC2)cs1)c1ccc(Cl)cc1 ZINC000540519134 939284928 /nfs/dbraw/zinc/28/49/28/939284928.db2.gz BDWUPODCHQNRFI-DJKXOVBDSA-N 2 0 418.994 4.318 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc2cc(Cl)ccc2o1 ZINC000540594718 939314637 /nfs/dbraw/zinc/31/46/37/939314637.db2.gz YXPBUYZVHBSUCD-KRWDZBQOSA-N 2 0 413.953 4.129 20 0 HIADRP CC(C)[NH+]1CCN(c2cccc(N[C@@H](C)c3cccc(OCC[NH+](C)C)c3)c2)CC1 ZINC000540748323 939357940 /nfs/dbraw/zinc/35/79/40/939357940.db2.gz XIYBCZYDZAGWQA-NRFANRHFSA-N 2 0 410.606 4.331 20 0 HIADRP C[C@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000540749928 939358236 /nfs/dbraw/zinc/35/82/36/939358236.db2.gz RKESJADTMIRVQG-FQEVSTJZSA-N 2 0 411.590 4.004 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc(Br)ccc1F ZINC000540988143 939425690 /nfs/dbraw/zinc/42/56/90/939425690.db2.gz HEQCFPTXANSBEH-KDOFPFPSSA-N 2 0 407.327 4.006 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)NCC[NH+]2CCCCC2)cc1)C[C@H]1CCCCO1 ZINC000541031918 939436486 /nfs/dbraw/zinc/43/64/86/939436486.db2.gz JIBWQKWWPQFLAM-HSZRJFAPSA-N 2 0 416.610 4.074 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(-c4ccc(F)cc4)s3)CC2)CC1 ZINC000541760723 939623246 /nfs/dbraw/zinc/62/32/46/939623246.db2.gz LIKJDNUJYDYERL-UHFFFAOYSA-N 2 0 401.595 4.404 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H](C)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000542302721 939792413 /nfs/dbraw/zinc/79/24/13/939792413.db2.gz BVWIPRWIDXBIQW-QGZVFWFLSA-N 2 0 412.497 4.074 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)CCCc1cc(-c2ccc(F)cc2)n(C)n1 ZINC000542466421 939827866 /nfs/dbraw/zinc/82/78/66/939827866.db2.gz JDBMFYWCWZTKRW-UHFFFAOYSA-N 2 0 418.520 4.180 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000542474825 939829508 /nfs/dbraw/zinc/82/95/08/939829508.db2.gz OLWHJKBQAKMIHR-VWLOTQADSA-N 2 0 406.549 4.081 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](c2ccccc2)c2ccc(F)cn2)[C@@H](c2ccccc2)C1 ZINC000542480797 939830936 /nfs/dbraw/zinc/83/09/36/939830936.db2.gz QLHGTXKTQKDSFW-CLJLJLNGSA-N 2 0 418.560 4.279 20 0 HIADRP CCC1(CNC(=O)N(C)[C@@H](C)C2CC[NH+](C)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000542757565 939859399 /nfs/dbraw/zinc/85/93/99/939859399.db2.gz UZBKJGFCYISJEP-NRFANRHFSA-N 2 0 414.638 4.051 20 0 HIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cc1F ZINC000542847769 939862810 /nfs/dbraw/zinc/86/28/10/939862810.db2.gz SZCYWQSHRSPQGT-WPFOTENUSA-N 2 0 412.549 4.217 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1 ZINC000542852320 939863258 /nfs/dbraw/zinc/86/32/58/939863258.db2.gz YRBNACNTIMDHQF-DVECYGJZSA-N 2 0 424.589 4.024 20 0 HIADRP CC(C)N(CC[NH+](C)C)C(=O)Nc1ccc(C[N@H+](C[C@@H]2CCCCO2)C(C)C)cc1 ZINC000542890959 939865643 /nfs/dbraw/zinc/86/56/43/939865643.db2.gz KSZBGWNCAPIDBW-QHCPKHFHSA-N 2 0 418.626 4.270 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000543403962 940053623 /nfs/dbraw/zinc/05/36/23/940053623.db2.gz IINZOJLTGYBBGS-UXHICEINSA-N 2 0 410.558 4.321 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000543406308 940054987 /nfs/dbraw/zinc/05/49/87/940054987.db2.gz GYVXASCXKFNQOA-FQEVSTJZSA-N 2 0 410.558 4.321 20 0 HIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)ccc1SC ZINC000543774511 940181741 /nfs/dbraw/zinc/18/17/41/940181741.db2.gz FUXXSLMKCYBQJQ-LAUBAEHRSA-N 2 0 400.588 4.225 20 0 HIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000543776874 940183167 /nfs/dbraw/zinc/18/31/67/940183167.db2.gz PTIMNYZQOXWBIR-FDDCHVKYSA-N 2 0 421.610 4.460 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCOc2cc3c(cc21)CCC3 ZINC000543776836 940183191 /nfs/dbraw/zinc/18/31/91/940183191.db2.gz XJBVOEBBLPSMCD-NOZRDPDXSA-N 2 0 406.570 4.136 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000544358011 940399630 /nfs/dbraw/zinc/39/96/30/940399630.db2.gz HUAXZFIRMUGMQD-AREMUKBSSA-N 2 0 420.576 4.327 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000544358012 940399787 /nfs/dbraw/zinc/39/97/87/940399787.db2.gz HUAXZFIRMUGMQD-SANMLTNESA-N 2 0 420.576 4.327 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000544366284 940403224 /nfs/dbraw/zinc/40/32/24/940403224.db2.gz USAIXYKFMACINQ-VWLOTQADSA-N 2 0 406.549 4.081 20 0 HIADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)Nc1cccc(CC[NH+]2CCC(C)CC2)c1 ZINC000544610109 940489973 /nfs/dbraw/zinc/48/99/73/940489973.db2.gz KJUQULIZSRZQHH-HXUWFJFHSA-N 2 0 400.611 4.155 20 0 HIADRP COc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)CC3 ZINC000545899843 940655476 /nfs/dbraw/zinc/65/54/76/940655476.db2.gz QXQOCQVBDCVBRS-IBGZPJMESA-N 2 0 407.558 4.154 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@@H]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000547363105 941058504 /nfs/dbraw/zinc/05/85/04/941058504.db2.gz PEXLMQWPYMLLCS-BJKOFHAPSA-N 2 0 409.549 4.077 20 0 HIADRP COc1ccc(CC[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC(F)F ZINC000547504550 941065899 /nfs/dbraw/zinc/06/58/99/941065899.db2.gz OPCBJSLIOAKIJF-FXAWDEMLSA-N 2 0 404.501 4.339 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)c1ccc(C[NH+]2CCCC2)cc1)c1cccc(OC)c1 ZINC000547757481 941075032 /nfs/dbraw/zinc/07/50/32/941075032.db2.gz GMORNXZKRCRLAY-XMMPIXPASA-N 2 0 409.574 4.104 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000549037953 941147168 /nfs/dbraw/zinc/14/71/68/941147168.db2.gz LAJYCOFSNQGUFB-CLJLJLNGSA-N 2 0 417.597 4.409 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000549251110 941174177 /nfs/dbraw/zinc/17/41/77/941174177.db2.gz OCMBAVXHPSGFKN-IBGZPJMESA-N 2 0 403.574 4.406 20 0 HIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2c(Cl)cccc2N2CCOCC2)cc1 ZINC000549689206 941204628 /nfs/dbraw/zinc/20/46/28/941204628.db2.gz ZUPVXKJUEMUIJN-UHFFFAOYSA-N 2 0 401.982 4.308 20 0 HIADRP Cc1cc(Cl)cc(C[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)c1 ZINC000549733856 941205971 /nfs/dbraw/zinc/20/59/71/941205971.db2.gz NXYGSYAYARHUJO-UHFFFAOYSA-N 2 0 402.966 4.428 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+]Cc3ccnc4ccccc34)C3(C2)CCOCC3)cc1 ZINC000549867962 941220868 /nfs/dbraw/zinc/22/08/68/941220868.db2.gz KLSAZCUNTACDEY-HSZRJFAPSA-N 2 0 401.554 4.253 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)cc1 ZINC000550835265 941372800 /nfs/dbraw/zinc/37/28/00/941372800.db2.gz HDSAIGSPOIJTPS-QFIPXVFZSA-N 2 0 418.585 4.427 20 0 HIADRP C[N@@H+]1CCCC[C@@H]1CN1CC[NH+](CC(Cc2ccccc2)Cc2ccccc2)CC1 ZINC000550954387 941385846 /nfs/dbraw/zinc/38/58/46/941385846.db2.gz PDFQMCVIKIIIMY-HHHXNRCGSA-N 2 0 405.630 4.190 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@H]3Cc4[nH]c5ccccc5c4C3)C3(C2)CCOCC3)cc1 ZINC000551265278 941439450 /nfs/dbraw/zinc/43/94/50/941439450.db2.gz RYJODZFGTPRSNS-FGZHOGPDSA-N 2 0 415.581 4.154 20 0 HIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551265286 941439531 /nfs/dbraw/zinc/43/95/31/941439531.db2.gz SGHSPRGOSPXOBP-QPPBQGQZSA-N 2 0 424.560 4.340 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC[C@@H]1C[NH+](Cc2ccccc2)CCCO1 ZINC000551397031 941469600 /nfs/dbraw/zinc/46/96/00/941469600.db2.gz YHHLXHGYSIICCN-GJHDXROTSA-N 2 0 421.629 4.024 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+][C@H]3CCC[C@H]3c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000551787872 941545527 /nfs/dbraw/zinc/54/55/27/941545527.db2.gz NSIOVEGMQVEVDK-VXKWHMMOSA-N 2 0 409.540 4.490 20 0 HIADRP CCn1nccc1[C@@H]1OCC[C@H]1C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000552054086 941575146 /nfs/dbraw/zinc/57/51/46/941575146.db2.gz JQVXLCRSXRQLMC-VIMOMQNVSA-N 2 0 422.617 4.261 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCCC2)cc1)N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000552336302 941636590 /nfs/dbraw/zinc/63/65/90/941636590.db2.gz YFPHIBSIZVUINP-HHHXNRCGSA-N 2 0 417.597 4.411 20 0 HIADRP COc1cc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)c(-c2ccccc2)cc1OC ZINC000552497681 941689004 /nfs/dbraw/zinc/68/90/04/941689004.db2.gz UHQHZOFAYJOBEK-ACIOBRDBSA-N 2 0 410.558 4.054 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1)c1ccc(Cl)cc1 ZINC000554251273 942078903 /nfs/dbraw/zinc/07/89/03/942078903.db2.gz NFZRHUHTIAXRDH-RBBKRZOGSA-N 2 0 421.029 4.096 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(NC2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)c1 ZINC000554404457 942128518 /nfs/dbraw/zinc/12/85/18/942128518.db2.gz YTZHBVBZDYWNPV-CVDCTZTESA-N 2 0 400.611 4.422 20 0 HIADRP Cc1cc2ncn(C[C@@H](O)C[NH2+]Cc3ccc(C[N@H+]4CCCC[C@@H]4C)cc3)c2cc1C ZINC000554863409 942298019 /nfs/dbraw/zinc/29/80/19/942298019.db2.gz RQDHSDNBVGDFDD-URXFXBBRSA-N 2 0 420.601 4.178 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000554988914 942345167 /nfs/dbraw/zinc/34/51/67/942345167.db2.gz RWYUFXIFRSGGTF-JOCHJYFZSA-N 2 0 408.590 4.215 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000555335891 942481683 /nfs/dbraw/zinc/48/16/83/942481683.db2.gz CAANNMGULLFPMN-UHFFFAOYSA-N 2 0 403.574 4.228 20 0 HIADRP C[C@H](c1ccccc1F)N1CCC[C@@H]([NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)C1=O ZINC000556223551 942820699 /nfs/dbraw/zinc/82/06/99/942820699.db2.gz KLSJGZVLFCXTLY-FOTFPPMPSA-N 2 0 423.576 4.378 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCS(=O)(=O)Cc2ccccc2)CC1 ZINC000556239677 942824726 /nfs/dbraw/zinc/82/47/26/942824726.db2.gz SADCVOITWNUZQW-UHFFFAOYSA-N 2 0 414.615 4.024 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CN(Cc3ccccc3)CCCO2)CC1 ZINC000556240618 942824900 /nfs/dbraw/zinc/82/49/00/942824900.db2.gz PAFDIIKPHYTOSZ-RCSZBHJWSA-N 2 0 421.629 4.310 20 0 HIADRP COc1ncc([C@@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cc1Cl ZINC000556584083 942906296 /nfs/dbraw/zinc/90/62/96/942906296.db2.gz PWJDJZYKGOMWKE-GOSISDBHSA-N 2 0 417.981 4.466 20 0 HIADRP C[C@@H](C[NH2+][C@@H](c1sccc1Br)C1CCCCC1)N1CC[NH+](C)CC1 ZINC000556584294 942907398 /nfs/dbraw/zinc/90/73/98/942907398.db2.gz UCCUCUJVQDBUKU-MAUKXSAKSA-N 2 0 414.457 4.358 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3c3cccc(C(F)(F)F)c3)cn2)CC1 ZINC000556589236 942908028 /nfs/dbraw/zinc/90/80/28/942908028.db2.gz QFLJVHAMZHLFCZ-NHCUHLMSSA-N 2 0 418.507 4.278 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]CCCc4nnc5n4CCCCC5)[C@H]3C2)cc1 ZINC000556870675 942945789 /nfs/dbraw/zinc/94/57/89/942945789.db2.gz GUBSJRZUJFJUOI-HJOGWXRNSA-N 2 0 421.633 4.218 20 0 HIADRP c1csc(N2CCC([NH2+][C@@H]3CCCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)CC2)n1 ZINC000556887630 942951869 /nfs/dbraw/zinc/95/18/69/942951869.db2.gz ZOKCXPPSPRLIIW-MDNUFGMLSA-N 2 0 410.631 4.392 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)cc1 ZINC000557640805 943245714 /nfs/dbraw/zinc/24/57/14/943245714.db2.gz MCLPFUYEULQDKW-AREMUKBSSA-N 2 0 405.586 4.267 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H]1CCc2c1cc(Br)cc2Cl ZINC000558164463 943405414 /nfs/dbraw/zinc/40/54/14/943405414.db2.gz CKUPCSCWXIQQOR-GOSISDBHSA-N 2 0 424.770 4.215 20 0 HIADRP C[NH+](C)CCOc1cccc(NC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000558742280 943637349 /nfs/dbraw/zinc/63/73/49/943637349.db2.gz LLDGWNLSADGOPA-QHCPKHFHSA-N 2 0 424.589 4.049 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000558781506 943661404 /nfs/dbraw/zinc/66/14/04/943661404.db2.gz UJEHADZZYLHGQG-AUSIDOKSSA-N 2 0 403.574 4.274 20 0 HIADRP CC(=O)NC1CCC([NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000558975181 943779271 /nfs/dbraw/zinc/77/92/71/943779271.db2.gz KWVYKSOVCAJODD-YBNMEYLKSA-N 2 0 403.998 4.291 20 0 HIADRP CCOc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1F ZINC000559330013 943897162 /nfs/dbraw/zinc/89/71/62/943897162.db2.gz MGLXNEZJYQVBSU-QFIPXVFZSA-N 2 0 412.549 4.243 20 0 HIADRP COc1ccsc1[C@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000559892572 944077178 /nfs/dbraw/zinc/07/71/78/944077178.db2.gz KNEWVGZBMWOFLL-ICSRJNTNSA-N 2 0 400.588 4.336 20 0 HIADRP COc1cccc2c1CC[C@H]2[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000559892325 944077598 /nfs/dbraw/zinc/07/75/98/944077598.db2.gz ICGREYYMYZHYPB-ZJSXRUAMSA-N 2 0 406.570 4.201 20 0 HIADRP O=C(C[NH2+][C@H](c1cccc(Cl)c1)C1CCCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000561199641 944511382 /nfs/dbraw/zinc/51/13/82/944511382.db2.gz QEQWIMSIRLQSNQ-QHCPKHFHSA-N 2 0 403.998 4.294 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H](c2ccccc2C)C2CC2)CC1 ZINC000561402338 944581525 /nfs/dbraw/zinc/58/15/25/944581525.db2.gz MMSRMGVKVHMURH-SANMLTNESA-N 2 0 405.586 4.125 20 0 HIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccc(Oc5cnccn5)cc4)C[C@H]3C2)cc1 ZINC000562214333 945023463 /nfs/dbraw/zinc/02/34/63/945023463.db2.gz PLYQFTHSJHDNLS-DHIUTWEWSA-N 2 0 400.526 4.223 20 0 HIADRP COc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)CC3 ZINC000564233944 945449606 /nfs/dbraw/zinc/44/96/06/945449606.db2.gz PVSYRMIHUQRSAY-LJQANCHMSA-N 2 0 419.569 4.297 20 0 HIADRP C[C@H]([NH2+]Cc1cc(O)cc(C(F)(F)F)c1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000564407591 945560327 /nfs/dbraw/zinc/56/03/27/945560327.db2.gz IHKBYOGEAVBKQA-AWEZNQCLSA-N 2 0 411.443 4.153 20 0 HIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000564419839 945572366 /nfs/dbraw/zinc/57/23/66/945572366.db2.gz RCMPKIKOWCAUJI-GSDHBNRESA-N 2 0 408.586 4.337 20 0 HIADRP c1ccc(N2CCC[NH+](CCCC[N@@H+]3CCCN(c4ccccc4)CC3)CC2)cc1 ZINC000564507419 945636957 /nfs/dbraw/zinc/63/69/57/945636957.db2.gz VTHJWLOCYZSKKA-UHFFFAOYSA-N 2 0 406.618 4.191 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H](c1ccc(Br)cc1)C1CC1 ZINC000564753097 945748940 /nfs/dbraw/zinc/74/89/40/945748940.db2.gz AXJDMLDNGRSNJT-HXUWFJFHSA-N 2 0 404.352 4.025 20 0 HIADRP C[NH+](CC(O)C[N@@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000565620012 945856747 /nfs/dbraw/zinc/85/67/47/945856747.db2.gz JOWOKCZLHOHRET-RUPPMWDTSA-N 2 0 418.466 4.453 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)N(CCC)[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000568015653 946444139 /nfs/dbraw/zinc/44/41/39/946444139.db2.gz YWYPLIXVZZOYTE-DEOSSOPVSA-N 2 0 414.638 4.337 20 0 HIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3nc(-c4cccc(Br)c4)c[nH]3)C2)CC1 ZINC000568814574 946713052 /nfs/dbraw/zinc/71/30/52/946713052.db2.gz PFJXMESGAXRMGN-QGZVFWFLSA-N 2 0 403.368 4.003 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000569678651 946937213 /nfs/dbraw/zinc/93/72/13/946937213.db2.gz RODIWURJTSYELX-FQEVSTJZSA-N 2 0 404.558 4.255 20 0 HIADRP C(CC[NH+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1)CC[N@@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000569746376 946970194 /nfs/dbraw/zinc/97/01/94/946970194.db2.gz LGUHIPURUAEXLH-CWBXHPNXSA-N 2 0 402.623 4.224 20 0 HIADRP Fc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1Cl ZINC000570937455 947393147 /nfs/dbraw/zinc/39/31/47/947393147.db2.gz WXIGNEFPUMVBKO-HXUWFJFHSA-N 2 0 402.941 4.498 20 0 HIADRP CCC[NH+]1CCC(NC(=O)[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2c2cccc(C)c2)CC1 ZINC000573815677 948301067 /nfs/dbraw/zinc/30/10/67/948301067.db2.gz DHRNDCUROSRKTC-FTJBHMTQSA-N 2 0 419.613 4.201 20 0 HIADRP C[N@H+](CCCN1CC[NH+](C)CC1)Cc1ccc(-c2ccccc2Br)s1 ZINC000574240406 948395823 /nfs/dbraw/zinc/39/58/23/948395823.db2.gz MDRIDYFPZIFFJV-UHFFFAOYSA-N 2 0 422.436 4.247 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)cc1 ZINC000030913881 847796831 /nfs/dbraw/zinc/79/68/31/847796831.db2.gz YFNXLAORMHJYEU-UHFFFAOYSA-N 2 0 401.554 4.307 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000047777595 849109451 /nfs/dbraw/zinc/10/94/51/849109451.db2.gz MZUFQOXNYQNPAR-QFIPXVFZSA-N 2 0 412.578 4.146 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2c[nH]nc2-c2ccc(F)cc2)C[C@H](C)O1 ZINC000048816730 849269941 /nfs/dbraw/zinc/26/99/41/849269941.db2.gz YEMJKIGFCVWQSQ-ROUUACIJSA-N 2 0 408.521 4.115 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3cc(Cl)ccc3OC(F)F)cc2)CC1 ZINC000061070037 851287533 /nfs/dbraw/zinc/28/75/33/851287533.db2.gz LMYDCVGRKHIOOZ-UHFFFAOYSA-N 2 0 423.935 4.369 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(Br)cc3F)cc2)CC1 ZINC000061070176 851287696 /nfs/dbraw/zinc/28/76/96/851287696.db2.gz HVKQWXDGDSBYMF-UHFFFAOYSA-N 2 0 420.370 4.016 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc(CC[NH+]3CCSCC3)cc2)cc1 ZINC000061287903 851339190 /nfs/dbraw/zinc/33/91/90/851339190.db2.gz QGAYJFQLGNERQF-UHFFFAOYSA-N 2 0 411.615 4.372 20 0 HIADRP C[C@@H](CC[NH+](C)C)NC(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000062505913 851567078 /nfs/dbraw/zinc/56/70/78/851567078.db2.gz KBXQDNYBNHDADE-FQEVSTJZSA-N 2 0 408.590 4.089 20 0 HIADRP O=C(NC1CC[NH+](CC2CCCCC2)CC1)N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000062528493 851570630 /nfs/dbraw/zinc/57/06/30/851570630.db2.gz AFCICFQEKDDMEH-UHFFFAOYSA-N 2 0 418.670 4.329 20 0 HIADRP FC(F)(F)CN1CCC(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000437071732 862268280 /nfs/dbraw/zinc/26/82/80/862268280.db2.gz IMLCHUXXXYFHOS-BHDDXSALSA-N 2 0 409.540 4.151 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cc4c(cc3OC)C[C@H](C)O4)CC2)cc1 ZINC000063319575 851658653 /nfs/dbraw/zinc/65/86/53/851658653.db2.gz GBZUTJFJGWGOOW-SFHVURJKSA-N 2 0 410.558 4.029 20 0 HIADRP Cc1cc[n+](C(C(=O)c2ccc(C(C)C)cc2)C(=S)NC2CC[NH+](C)CC2)cc1 ZINC000063441603 851691158 /nfs/dbraw/zinc/69/11/58/851691158.db2.gz ZIMYSXBMMRJGNP-UHFFFAOYSA-O 2 0 410.607 4.029 20 0 HIADRP O=C(NC[C@@H](c1ccccc1)[NH+]1CCCC1)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000072036184 852479418 /nfs/dbraw/zinc/47/94/18/852479418.db2.gz CVNGVCPRAZMJJZ-VWLOTQADSA-N 2 0 420.601 4.035 20 0 HIADRP O=C([C@H]1CCC[N@H+](Cc2ccccc2)C1)N1CCC[NH+](CCCc2ccccc2)CC1 ZINC000072072798 852497055 /nfs/dbraw/zinc/49/70/55/852497055.db2.gz KSESYRYWBFZEPP-SANMLTNESA-N 2 0 419.613 4.066 20 0 HIADRP COc1ccccc1[C@H](CNC(=O)[C@H]1CCC[N@@H+]1Cc1ccccc1)[NH+]1CCCCC1 ZINC000108934213 852895735 /nfs/dbraw/zinc/89/57/35/852895735.db2.gz DXTZVTYDYJYJJM-RPWUZVMVSA-N 2 0 421.585 4.003 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000109340110 852955654 /nfs/dbraw/zinc/95/56/54/852955654.db2.gz OAGDRWHXTHVCIH-XMMPIXPASA-N 2 0 423.576 4.340 20 0 HIADRP O=C(NCCC[NH+]1CCCC1)C1CC[NH+](CC(c2ccccc2)c2ccccc2)CC1 ZINC000147321983 853586115 /nfs/dbraw/zinc/58/61/15/853586115.db2.gz VUIVBPZWMDFWNZ-UHFFFAOYSA-N 2 0 419.613 4.133 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)C(=O)NCc1ccc(F)cc1 ZINC000195538715 853673533 /nfs/dbraw/zinc/67/35/33/853673533.db2.gz JNZOBXDQQMEDBL-HSALFYBXSA-N 2 0 411.565 4.098 20 0 HIADRP c1sc(CC[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)nc1-c1ccccn1 ZINC000236653836 853908448 /nfs/dbraw/zinc/90/84/48/853908448.db2.gz XCNYFESGCISORI-UHFFFAOYSA-N 2 0 408.571 4.012 20 0 HIADRP CC(C)c1nn(-c2ccccc2)c(Cl)c1C[NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1 ZINC000236702856 853913335 /nfs/dbraw/zinc/91/33/35/853913335.db2.gz BGFLNONVTSCUJG-OAQYLSRUSA-N 2 0 418.029 4.011 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+]Cc2ccc(-c3cccc(Br)c3)s2)CC1 ZINC000237172761 853975430 /nfs/dbraw/zinc/97/54/30/853975430.db2.gz HXAVRGMNKDCTOR-UHFFFAOYSA-N 2 0 422.436 4.295 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2ccc(-c3ccccc3F)s2)cc1 ZINC000237177798 853976645 /nfs/dbraw/zinc/97/66/45/853976645.db2.gz KLVWFHXAYNEJJU-UHFFFAOYSA-N 2 0 411.546 4.135 20 0 HIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000237191411 853978313 /nfs/dbraw/zinc/97/83/13/853978313.db2.gz UDWNENUAFRFTLR-UHFFFAOYSA-N 2 0 412.965 4.373 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1OC(F)F ZINC000237216376 853984236 /nfs/dbraw/zinc/98/42/36/853984236.db2.gz BCUMESJZDUVYPD-CALCHBBNSA-N 2 0 420.500 4.196 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2cc(Br)ccc2OC(F)F)C[C@@H](C)O1 ZINC000237503490 854046244 /nfs/dbraw/zinc/04/62/44/854046244.db2.gz RMFDVTDDXWKEOU-ZIAGYGMSSA-N 2 0 421.326 4.030 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cc(Br)ccc2F)C[C@H](C)O1 ZINC000237620389 854063954 /nfs/dbraw/zinc/06/39/54/854063954.db2.gz DJGAHCLLEYGUJV-HOTGVXAUSA-N 2 0 421.354 4.487 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2ccc(Cl)cc2Cl)cc1 ZINC000237688952 854076021 /nfs/dbraw/zinc/07/60/21/854076021.db2.gz VXMUNMHPMSFEKY-UHFFFAOYSA-N 2 0 406.357 4.109 20 0 HIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)cc1 ZINC000237711231 854080871 /nfs/dbraw/zinc/08/08/71/854080871.db2.gz QZJIHHZXUCBVCY-RUZDIDTESA-N 2 0 418.585 4.174 20 0 HIADRP Cn1cc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)c(-c2ccncc2)n1 ZINC000237756852 854090101 /nfs/dbraw/zinc/09/01/01/854090101.db2.gz QYFQPKYEODZDHL-UHFFFAOYSA-N 2 0 417.601 4.307 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cc(-c4ccccc4)cs3)c2)C1 ZINC000237923065 854120003 /nfs/dbraw/zinc/12/00/03/854120003.db2.gz KAVIBVCZOGZHAJ-JOCHJYFZSA-N 2 0 419.594 4.402 20 0 HIADRP C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000303054378 854740492 /nfs/dbraw/zinc/74/04/92/854740492.db2.gz JZKDGQSLSXUGIQ-JKSUJKDBSA-N 2 0 412.405 4.367 20 0 HIADRP O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000303140299 854781233 /nfs/dbraw/zinc/78/12/33/854781233.db2.gz BAPJFUNACKKSQG-LADGPHEKSA-N 2 0 412.622 4.121 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000303159101 854792613 /nfs/dbraw/zinc/79/26/13/854792613.db2.gz PAUCCEUKMUTNEB-VAMGGRTRSA-N 2 0 420.667 4.016 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000303207537 854817080 /nfs/dbraw/zinc/81/70/80/854817080.db2.gz QHSBPUGCWVXZMD-UHFFFAOYSA-N 2 0 422.617 4.253 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000303241097 854832081 /nfs/dbraw/zinc/83/20/81/854832081.db2.gz JSKJNGNUUHCDFT-XMMPIXPASA-N 2 0 412.622 4.223 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000303689611 855134995 /nfs/dbraw/zinc/13/49/95/855134995.db2.gz MGQIXLLWXMHNDH-ZJSXRUAMSA-N 2 0 405.586 4.240 20 0 HIADRP COc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1Br ZINC000310788939 855367094 /nfs/dbraw/zinc/36/70/94/855367094.db2.gz DEWAFJMDDKKIRN-QFBILLFUSA-N 2 0 403.364 4.458 20 0 HIADRP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1Br ZINC000310943494 855367714 /nfs/dbraw/zinc/36/77/14/855367714.db2.gz WWFDNMPYQDIVGA-IBGZPJMESA-N 2 0 403.364 4.460 20 0 HIADRP Cc1cc(C[NH2+]C[C@H]2CN(Cc3ccccc3)CCCO2)ccc1Br ZINC000390860899 855457599 /nfs/dbraw/zinc/45/75/99/855457599.db2.gz LGVYNVBHDYDXOD-FQEVSTJZSA-N 2 0 403.364 4.138 20 0 HIADRP C[C@H]([NH2+]CC1CCN(C(=O)OC(C)(C)C)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000393945852 855469032 /nfs/dbraw/zinc/46/90/32/855469032.db2.gz QOOZLZHDBGGVTL-UGKGYDQZSA-N 2 0 401.595 4.134 20 0 HIADRP O=C(OCc1ccccc1)N1CCC([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000397517701 855472931 /nfs/dbraw/zinc/47/29/31/855472931.db2.gz SSUJFNWVXJXSMS-UHFFFAOYSA-N 2 0 421.585 4.289 20 0 HIADRP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)NCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000410346188 855940257 /nfs/dbraw/zinc/94/02/57/855940257.db2.gz UODFTPZHHYZHNV-LEWJYISDSA-N 2 0 400.611 4.125 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)Nc1cccc(OCC[NH+](C)C)c1 ZINC000410354308 855946067 /nfs/dbraw/zinc/94/60/67/855946067.db2.gz PDRNLWVGZGFVSK-HXUWFJFHSA-N 2 0 424.589 4.323 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@H](c1ccsc1)[NH+](C)C ZINC000410372415 855957709 /nfs/dbraw/zinc/95/77/09/855957709.db2.gz VTPCWOMWMCNEHS-XMSQKQJNSA-N 2 0 414.619 4.225 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2ccccc2C[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000410373796 855958910 /nfs/dbraw/zinc/95/89/10/855958910.db2.gz RMRBMQYUCIQHJU-QFIPXVFZSA-N 2 0 414.638 4.372 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000410394531 855970722 /nfs/dbraw/zinc/97/07/22/855970722.db2.gz ZBPIMSSOAVFNJX-OFVILXPXSA-N 2 0 420.601 4.135 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000425926538 856002764 /nfs/dbraw/zinc/00/27/64/856002764.db2.gz YLGLXHWPHUTDRE-QHCPKHFHSA-N 2 0 400.998 4.026 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000426045280 856069211 /nfs/dbraw/zinc/06/92/11/856069211.db2.gz BSELRTFWVYKRLX-TZRRMPRUSA-N 2 0 413.993 4.376 20 0 HIADRP Cc1ccc(-c2nnc([C@@H](C)[NH+]3CCC(CC[N@H+]4C[C@@H](C)O[C@@H](C)C4)CC3)o2)cc1 ZINC000426788216 856477930 /nfs/dbraw/zinc/47/79/30/856477930.db2.gz LFAJYWHQJDTVFY-HSALFYBXSA-N 2 0 412.578 4.317 20 0 HIADRP Cc1oc(-c2ccsc2)nc1C[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000426789716 856479338 /nfs/dbraw/zinc/47/93/38/856479338.db2.gz XDCKJDOHWPNCAX-IAGOWNOFSA-N 2 0 403.592 4.423 20 0 HIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000427704457 856916033 /nfs/dbraw/zinc/91/60/33/856916033.db2.gz DGASBOPAXSAEKN-HXUWFJFHSA-N 2 0 407.480 4.251 20 0 HIADRP Cc1cc2c(cc1C)[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)CCS2 ZINC000427723737 856923101 /nfs/dbraw/zinc/92/31/01/856923101.db2.gz ZIWJNSFOFQVSIM-HXUWFJFHSA-N 2 0 403.636 4.057 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)NC2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000428121449 857080203 /nfs/dbraw/zinc/08/02/03/857080203.db2.gz XJCNQNRNICPSFF-OFVILXPXSA-N 2 0 420.601 4.003 20 0 HIADRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1NC(C)=O ZINC000428246832 857125259 /nfs/dbraw/zinc/12/52/59/857125259.db2.gz ZCRGYUSESJKCKL-RBZQAINGSA-N 2 0 421.585 4.434 20 0 HIADRP COc1ccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1NC(C)=O ZINC000428246833 857125379 /nfs/dbraw/zinc/12/53/79/857125379.db2.gz ZCRGYUSESJKCKL-TZRRMPRUSA-N 2 0 421.585 4.434 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1Cc1ccccc1 ZINC000428277219 857137222 /nfs/dbraw/zinc/13/72/22/857137222.db2.gz PKRAQGUAUMAIAB-OFVILXPXSA-N 2 0 420.601 4.135 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000428277478 857137458 /nfs/dbraw/zinc/13/74/58/857137458.db2.gz RBWGZAXTEYJSJE-SDUSCBPUSA-N 2 0 420.601 4.176 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000428369177 857178530 /nfs/dbraw/zinc/17/85/30/857178530.db2.gz HPZZFLVZZOHSFO-BWKNWUBXSA-N 2 0 422.617 4.379 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000428369179 857178671 /nfs/dbraw/zinc/17/86/71/857178671.db2.gz HPZZFLVZZOHSFO-PXDATVDWSA-N 2 0 422.617 4.379 20 0 HIADRP Cn1cc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c(C(F)(F)F)n1 ZINC000428457428 857209289 /nfs/dbraw/zinc/20/92/89/857209289.db2.gz WZDCZGVOQWLERX-YZGWKJHDSA-N 2 0 406.496 4.219 20 0 HIADRP O=C(NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)[C@H]1CCC[N@@H+]1C1CC1 ZINC000429061548 857485899 /nfs/dbraw/zinc/48/58/99/857485899.db2.gz CMILIKBLFJIZRZ-RUZDIDTESA-N 2 0 403.570 4.192 20 0 HIADRP O=C(NC[C@H]1CCC[N@@H+]1C1CCCCC1)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000437653762 862990400 /nfs/dbraw/zinc/99/04/00/862990400.db2.gz UFQJTOGQVHTWDS-OAQYLSRUSA-N 2 0 418.651 4.056 20 0 HIADRP CC(C)Oc1ccc(NC(=O)N(C)CCC2CC[NH+](C3CCN(C)CC3)CC2)cc1 ZINC000431108789 858449482 /nfs/dbraw/zinc/44/94/82/858449482.db2.gz VQJNBFFYGMYCCO-UHFFFAOYSA-N 2 0 416.610 4.134 20 0 HIADRP Cc1ccc(NC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c(OCC[NH+](C)C)c1 ZINC000431196361 858498204 /nfs/dbraw/zinc/49/82/04/858498204.db2.gz LERCVHKVONBRFE-UNMCSNQZSA-N 2 0 424.589 4.110 20 0 HIADRP C[C@@H]1C[N@H+](CCC[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)CCCO1 ZINC000432364515 859124144 /nfs/dbraw/zinc/12/41/44/859124144.db2.gz JXMNVBJTIUSJOA-OAQYLSRUSA-N 2 0 404.558 4.130 20 0 HIADRP C[C@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000432415094 859153548 /nfs/dbraw/zinc/15/35/48/859153548.db2.gz UYDQYZFUHPQPCN-KHYOSLBOSA-N 2 0 413.425 4.323 20 0 HIADRP C[C@@H]1CSc2ccc(Br)cc2[C@H]1[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000432415093 859153886 /nfs/dbraw/zinc/15/38/86/859153886.db2.gz UYDQYZFUHPQPCN-CLCXKQKWSA-N 2 0 413.425 4.323 20 0 HIADRP C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000432415096 859154407 /nfs/dbraw/zinc/15/44/07/859154407.db2.gz UYDQYZFUHPQPCN-SPYBWZPUSA-N 2 0 413.425 4.323 20 0 HIADRP COc1ccc(C[C@@H]([NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)c2ccc(OC)cc2)cc1 ZINC000432416212 859155610 /nfs/dbraw/zinc/15/56/10/859155610.db2.gz QAHFWYFMGFTGBV-NBGIEHNGSA-N 2 0 412.574 4.078 20 0 HIADRP C[C@@H]1CN(CCC[NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCCO1 ZINC000432424568 859158918 /nfs/dbraw/zinc/15/89/18/859158918.db2.gz PFIXTRMFURJOPO-VQIMIIECSA-N 2 0 403.567 4.417 20 0 HIADRP CC(C)(C)[N@@H+]1C[C@@H](C(=O)Nc2ccc(CC[NH+]3CCCC3)cc2)[C@H](C(F)(F)F)C1 ZINC000432899090 859416470 /nfs/dbraw/zinc/41/64/70/859416470.db2.gz UPGLERCWTYAMBE-RTBURBONSA-N 2 0 411.512 4.172 20 0 HIADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)c1cc(C2CC2)nc2ccc(Cl)cc21 ZINC000434262895 860240188 /nfs/dbraw/zinc/24/01/88/860240188.db2.gz CEOSVBJBWQQDMN-UHFFFAOYSA-N 2 0 416.997 4.111 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](CCc2cccc(Cl)c2Cl)CC1 ZINC000434543688 860393546 /nfs/dbraw/zinc/39/35/46/860393546.db2.gz HYGZDGJLDIHPAQ-UHFFFAOYSA-N 2 0 414.421 4.096 20 0 HIADRP Cc1cc(C[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)ccc1Br ZINC000467777409 881596856 /nfs/dbraw/zinc/59/68/56/881596856.db2.gz WGGYBILFTDADCS-MRXNPFEDSA-N 2 0 420.370 4.499 20 0 HIADRP CN(c1ccccc1)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cn1 ZINC000435783649 861058601 /nfs/dbraw/zinc/05/86/01/861058601.db2.gz WZYZIRRGBXEKGQ-VWLOTQADSA-N 2 0 416.569 4.096 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccc(Br)c1 ZINC000467842760 881682942 /nfs/dbraw/zinc/68/29/42/881682942.db2.gz DZAYRDNDJMCYTR-QGZVFWFLSA-N 2 0 402.380 4.047 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000467860259 881711093 /nfs/dbraw/zinc/71/10/93/881711093.db2.gz YZYYWXWACLZJJO-QZTJIDSGSA-N 2 0 415.553 4.397 20 0 HIADRP COc1cc(NC(C)=O)ccc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000439082625 864530720 /nfs/dbraw/zinc/53/07/20/864530720.db2.gz DRARNMGDRBCWCA-MRXNPFEDSA-N 2 0 401.576 4.278 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)Nc1ccc(F)c(F)c1 ZINC000439597337 864920621 /nfs/dbraw/zinc/92/06/21/864920621.db2.gz PVYLOMQOGPUHJQ-MRXNPFEDSA-N 2 0 413.468 4.307 20 0 HIADRP CCC[NH+]1CCC(N(C)C(=O)NC[C@@H](CC(C)C)[NH2+][C@H](C)c2ccccc2)CC1 ZINC000468015049 881853216 /nfs/dbraw/zinc/85/32/16/881853216.db2.gz AUDMBISQMKKGBM-IFMALSPDSA-N 2 0 402.627 4.268 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCC(CC[NH+](C)C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000468026780 881860690 /nfs/dbraw/zinc/86/06/90/881860690.db2.gz ARVLNTNWKHLXKF-NFBKMPQASA-N 2 0 402.627 4.125 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000440535714 865808234 /nfs/dbraw/zinc/80/82/34/865808234.db2.gz SLLCICLYNBJYJZ-FTJBHMTQSA-N 2 0 419.613 4.269 20 0 HIADRP Cc1ccc([C@H](OC[C@@H](O)C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c2ccccc2)cc1 ZINC000441460626 866536656 /nfs/dbraw/zinc/53/66/56/866536656.db2.gz YYVDASFUOPACJL-DURWQBQJSA-N 2 0 422.613 4.270 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[C@@H](c4ccc(C(F)(F)F)cc4)C3)cn2)CC1 ZINC000442713410 867642675 /nfs/dbraw/zinc/64/26/75/867642675.db2.gz WPEXANNTOVDWRN-CTNGQTDRSA-N 2 0 418.507 4.278 20 0 HIADRP FC(F)(F)c1ncc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000443984879 868509413 /nfs/dbraw/zinc/50/94/13/868509413.db2.gz GNQHJDLTGIKRTO-UHFFFAOYSA-N 2 0 413.509 4.323 20 0 HIADRP O=C(CC[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1)NC(c1ccccc1)c1ccccc1 ZINC000444205088 868665344 /nfs/dbraw/zinc/66/53/44/868665344.db2.gz KNADALBFEVKXRZ-QFIPXVFZSA-N 2 0 405.586 4.090 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cncn2Cc2ccccc2)CC1 ZINC000445806825 869832938 /nfs/dbraw/zinc/83/29/38/869832938.db2.gz BHYMQAAMIGXURW-FQEVSTJZSA-N 2 0 421.564 4.063 20 0 HIADRP CCCCOc1ccccc1C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000468411143 882354247 /nfs/dbraw/zinc/35/42/47/882354247.db2.gz GJOFSSNUJHHYCU-UHFFFAOYSA-N 2 0 401.639 4.494 20 0 HIADRP C[C@H](CCc1ccc(Cl)s1)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000468427228 882371057 /nfs/dbraw/zinc/37/10/57/882371057.db2.gz IRIXIDPOEMYGAY-VQIMIIECSA-N 2 0 420.022 4.210 20 0 HIADRP CC[C@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(Br)cc1Cl ZINC000446816202 870729955 /nfs/dbraw/zinc/72/99/55/870729955.db2.gz AIEZUCLHKIAPEG-KSSFIOAISA-N 2 0 402.808 4.027 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)N(CC[NH+](C)C)Cc2ccco2)CCCC1)c1ccccc1 ZINC000447414667 871321825 /nfs/dbraw/zinc/32/18/25/871321825.db2.gz WACHEFYZUFAPEG-HXUWFJFHSA-N 2 0 412.578 4.016 20 0 HIADRP C[NH+](C)[C@H]1CCOc2c(NC(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)cccc21 ZINC000447724404 871668708 /nfs/dbraw/zinc/66/87/08/871668708.db2.gz VURSSDFHDUVXSR-QFIPXVFZSA-N 2 0 407.558 4.313 20 0 HIADRP c1[nH]c(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)nc1-c1ccccc1 ZINC000447851119 871771412 /nfs/dbraw/zinc/77/14/12/871771412.db2.gz QFZLWYSCCJUEKA-UHFFFAOYSA-N 2 0 404.558 4.238 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)[C@@H](C)C1 ZINC000448464028 872430872 /nfs/dbraw/zinc/43/08/72/872430872.db2.gz BZFHXKKQSRSFQX-CPJSRVTESA-N 2 0 422.617 4.287 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC(CC)(CC)[NH2+][C@@H](C)c2ccccc2)[C@@H](C)C1 ZINC000448524978 872519908 /nfs/dbraw/zinc/51/99/08/872519908.db2.gz MQSVKSAOWQZFOX-ONTIZHBOSA-N 2 0 402.627 4.268 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+]Cc2ccccc2Oc2ccc(F)cc2Cl)CC1 ZINC000461404635 874416938 /nfs/dbraw/zinc/41/69/38/874416938.db2.gz GTWKXKKHZIQERI-UHFFFAOYSA-N 2 0 405.945 4.389 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCSCC2)cc1)[C@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000468746730 882840661 /nfs/dbraw/zinc/84/06/61/882840661.db2.gz AJZJFWRZDXXVCI-XMMPIXPASA-N 2 0 423.626 4.271 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)cnn1C(C)(C)C ZINC000468828196 882879718 /nfs/dbraw/zinc/87/97/18/882879718.db2.gz FBVFLEGINIVPSM-OAQYLSRUSA-N 2 0 411.638 4.195 20 0 HIADRP Cc1c([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cnn1C(C)(C)C ZINC000468834097 882882449 /nfs/dbraw/zinc/88/24/49/882882449.db2.gz FVZXNUXIINEJGY-DLBZAZTESA-N 2 0 401.574 4.249 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2cccc(CN3CC[NH+](C)CC3)c2)cc1 ZINC000461867298 875017656 /nfs/dbraw/zinc/01/76/56/875017656.db2.gz PNIWYGBNFTXYGT-NRFANRHFSA-N 2 0 420.601 4.061 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)[NH+](C)C)c1 ZINC000468861396 882895190 /nfs/dbraw/zinc/89/51/90/882895190.db2.gz FWXSFCCGCCUSNI-IBGZPJMESA-N 2 0 408.468 4.191 20 0 HIADRP C[NH+]1CCC(C[NH2+]Cc2cccc(OCc3ccccc3)c2)(N2CCCCC2)CC1 ZINC000462739140 875810184 /nfs/dbraw/zinc/81/01/84/875810184.db2.gz VNWWJKYDXNWTBI-UHFFFAOYSA-N 2 0 407.602 4.306 20 0 HIADRP C[C@H](CCN1CCOCC1)[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462817223 875858717 /nfs/dbraw/zinc/85/87/17/875858717.db2.gz NEPPSXLUEIXMCE-ZJSXRUAMSA-N 2 0 405.602 4.079 20 0 HIADRP C[C@@H]([NH2+]Cc1cc(Br)cc2c1OCC2)c1ccc(OCC[NH+](C)C)cc1 ZINC000462845365 875880596 /nfs/dbraw/zinc/88/05/96/875880596.db2.gz LQHMQGAWBCVWQD-OAHLLOKOSA-N 2 0 419.363 4.175 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)[C@@H](C)C1 ZINC000463126311 876170684 /nfs/dbraw/zinc/17/06/84/876170684.db2.gz TUIQIDWHECCWSU-WMZHIEFXSA-N 2 0 408.030 4.031 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+]C2CCN(Cc3ccccc3Cl)CC2)c1 ZINC000463131181 876177346 /nfs/dbraw/zinc/17/73/46/876177346.db2.gz JVVKUKKTVWOQQY-UHFFFAOYSA-N 2 0 401.982 4.035 20 0 HIADRP COc1cccc([C@H](CN[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[NH+]2CCCC2)c1 ZINC000463139454 876190399 /nfs/dbraw/zinc/19/03/99/876190399.db2.gz GYDRXIFBMYBQIX-QQSVUBKYSA-N 2 0 407.602 4.475 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cncc(C(F)(F)F)c2)CC1 ZINC000463154482 876207827 /nfs/dbraw/zinc/20/78/27/876207827.db2.gz DZQDZVRBAXSRBI-HNNXBMFYSA-N 2 0 410.459 4.232 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cncc(C(F)(F)F)c2)CC1 ZINC000463154483 876208473 /nfs/dbraw/zinc/20/84/73/876208473.db2.gz DZQDZVRBAXSRBI-OAHLLOKOSA-N 2 0 410.459 4.232 20 0 HIADRP O[C@@H]1CCC[C@]1(C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1ccc(F)cc1 ZINC000463235070 876290245 /nfs/dbraw/zinc/29/02/45/876290245.db2.gz FPBQKPMFHITXAM-CLJLJLNGSA-N 2 0 410.577 4.196 20 0 HIADRP Cc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(N2CCOCC2)c1 ZINC000463239503 876295045 /nfs/dbraw/zinc/29/50/45/876295045.db2.gz ZCIXQSNEFJTTTP-QILAJZQNSA-N 2 0 405.586 4.117 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)C1 ZINC000503389100 912371553 /nfs/dbraw/zinc/37/15/53/912371553.db2.gz QTBYSCHAWNQGRH-XPWALMASSA-N 2 0 406.659 4.042 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C)c1ccccc1Cl ZINC000465434997 878866580 /nfs/dbraw/zinc/86/65/80/878866580.db2.gz SCNPPIGORMGWOT-XQBPLPMBSA-N 2 0 421.029 4.380 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)c2cccs2)CC1 ZINC000465435746 878868281 /nfs/dbraw/zinc/86/82/81/878868281.db2.gz SXNIHNKBYUHILH-PMACEKPBSA-N 2 0 406.640 4.037 20 0 HIADRP CC[NH+]1CCC(CCNC(=O)NCc2ccccc2C[N@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000465534999 878994583 /nfs/dbraw/zinc/99/45/83/878994583.db2.gz VLYJICZCOMRQJV-OYRHEFFESA-N 2 0 414.638 4.086 20 0 HIADRP CC[NH+]1CCC(CCNC(=O)NCc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)CC1 ZINC000465535000 878994931 /nfs/dbraw/zinc/99/49/31/878994931.db2.gz VLYJICZCOMRQJV-SFTDATJTSA-N 2 0 414.638 4.086 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000465537024 878995881 /nfs/dbraw/zinc/99/58/81/878995881.db2.gz GERXVVMGIQRAPW-BHIFYINESA-N 2 0 414.638 4.038 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)C1 ZINC000465537025 878996627 /nfs/dbraw/zinc/99/66/27/878996627.db2.gz GERXVVMGIQRAPW-FKBYEOEOSA-N 2 0 414.638 4.038 20 0 HIADRP CCC(CC)[C@H](CNC(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)[NH+]1CCCC1 ZINC000465564734 879037099 /nfs/dbraw/zinc/03/70/99/879037099.db2.gz IGOYKFOIESXZFQ-RZUBCFFCSA-N 2 0 420.667 4.331 20 0 HIADRP C[C@H]1C[C@@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)CC[N@@H+]1C ZINC000465573515 879048459 /nfs/dbraw/zinc/04/84/59/879048459.db2.gz PGTYBGRWFGLMNC-CVDCTZTESA-N 2 0 408.590 4.039 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)C1 ZINC000503426252 912423361 /nfs/dbraw/zinc/42/33/61/912423361.db2.gz NAQXDKARDKYJQM-CQOQZXRMSA-N 2 0 412.622 4.120 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCC1([NH+](C)C)CCCCCC1 ZINC000465643502 879161270 /nfs/dbraw/zinc/16/12/70/879161270.db2.gz XLLLHZPWWIDXDE-QHCPKHFHSA-N 2 0 414.638 4.195 20 0 HIADRP CN(C)[C@@H](CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccccc1Cl ZINC000503437329 912445999 /nfs/dbraw/zinc/44/59/99/912445999.db2.gz PVASSMBMBXKZES-UGKGYDQZSA-N 2 0 421.029 4.240 20 0 HIADRP CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)NC[C@@H]1CCC[NH+](C)[C@H]1c1cccs1 ZINC000465871808 879524293 /nfs/dbraw/zinc/52/42/93/879524293.db2.gz JHYWUTFUWASBOB-QKNQBKEWSA-N 2 0 406.640 4.085 20 0 HIADRP CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000465888947 879543959 /nfs/dbraw/zinc/54/39/59/879543959.db2.gz MORYELWURWOJNU-GMAHTHKFSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)CCCC1)c1ccccc1 ZINC000465911887 879573906 /nfs/dbraw/zinc/57/39/06/879573906.db2.gz SBTAIYFDFHPHRF-IFMALSPDSA-N 2 0 400.611 4.166 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000465923921 879586782 /nfs/dbraw/zinc/58/67/82/879586782.db2.gz RVCBPNWMYWMMHI-GGAORHGYSA-N 2 0 422.617 4.279 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)N2CC[NH+](CC3CCCCC3)CC2)[C@H]1c1cccs1 ZINC000466077476 879789670 /nfs/dbraw/zinc/78/96/70/879789670.db2.gz MAWZYKSWXCDPAT-IRLDBZIGSA-N 2 0 418.651 4.039 20 0 HIADRP CC1CCC([NH+]2CCN(C(=O)NC[C@@H]3CCC[N@H+](C)[C@H]3c3cccs3)CC2)CC1 ZINC000466084507 879803963 /nfs/dbraw/zinc/80/39/63/879803963.db2.gz ZUHYLHDONYXEPZ-RUCRBOMBSA-N 2 0 418.651 4.037 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NC[C@H]2CCC[NH+](C)[C@H]2c2cccs2)CC1 ZINC000466087541 879807146 /nfs/dbraw/zinc/80/71/46/879807146.db2.gz YIQGCMGUCNLZFE-IFMALSPDSA-N 2 0 420.667 4.285 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NCc2ccc(CC[NH+](C)C)cc2)cc1 ZINC000466971899 880773950 /nfs/dbraw/zinc/77/39/50/880773950.db2.gz AUAYGIDKIXMPQD-OAQYLSRUSA-N 2 0 422.617 4.165 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccnn1-c1ccccc1 ZINC000467313041 881060752 /nfs/dbraw/zinc/06/07/52/881060752.db2.gz KZSXTRHDMBWGFB-HBMCJLEFSA-N 2 0 404.558 4.332 20 0 HIADRP CC[C@H]1C[C@H](C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)CCO1 ZINC000503597985 912687087 /nfs/dbraw/zinc/68/70/87/912687087.db2.gz NUJOOYXEEUMSSA-GJZUVCINSA-N 2 0 407.602 4.304 20 0 HIADRP C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NC[C@H]1CCC[NH+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000469538986 883806174 /nfs/dbraw/zinc/80/61/74/883806174.db2.gz AVLKCVZNCINSRY-AWQBJMPUSA-N 2 0 411.512 4.077 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NCCC1CC[NH+](CC)CC1)c1cccc(C(F)(F)F)c1 ZINC000469634220 883842517 /nfs/dbraw/zinc/84/25/17/883842517.db2.gz RYKKEDPWROHJLL-FQEVSTJZSA-N 2 0 413.528 4.327 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CCCc1nc(-c2cccs2)no1 ZINC000469764467 883933534 /nfs/dbraw/zinc/93/35/34/883933534.db2.gz PGTUKIDNRJOOLO-ROUUACIJSA-N 2 0 410.587 4.477 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)c1ccccc1 ZINC000503690511 912794679 /nfs/dbraw/zinc/79/46/79/912794679.db2.gz PJFUWUMXCXBHGW-YADHBBJMSA-N 2 0 414.638 4.269 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NCC(C)(C)[NH2+][C@H](C)c2ccccc2)CC1 ZINC000503725064 912810539 /nfs/dbraw/zinc/81/05/39/912810539.db2.gz JZTJDYHVRHQJAG-HXUWFJFHSA-N 2 0 402.627 4.269 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N1CCC[N@H+](Cc2ccccc2)CC1)c1ccccc1 ZINC000503729156 912811747 /nfs/dbraw/zinc/81/17/47/912811747.db2.gz QNQALLVDIOUNPF-NRFANRHFSA-N 2 0 408.590 4.033 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)o1 ZINC000470733649 885187749 /nfs/dbraw/zinc/18/77/49/885187749.db2.gz SWAQKANPRSKXBJ-PKTZIBPZSA-N 2 0 424.589 4.031 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N(C)[C@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000470749275 885215232 /nfs/dbraw/zinc/21/52/32/885215232.db2.gz LWOFUXONRMSUJS-ZDXQCDESSA-N 2 0 414.638 4.051 20 0 HIADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CCC(=O)N[C@H](c2cccs2)c2ccccc2)C1 ZINC000470972621 885472948 /nfs/dbraw/zinc/47/29/48/885472948.db2.gz YMLJBYREDZMTSM-YKSBVNFPSA-N 2 0 411.615 4.008 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000471895062 886677341 /nfs/dbraw/zinc/67/73/41/886677341.db2.gz ILNROOHBLFUJNM-GGAORHGYSA-N 2 0 420.601 4.033 20 0 HIADRP CC(C)[NH+]1CCN(c2cccc(NC(=O)c3oc4ccccc4c3C[NH+](C)C)c2)CC1 ZINC000504207622 913086476 /nfs/dbraw/zinc/08/64/76/913086476.db2.gz JPKNIWDYGCZNNK-UHFFFAOYSA-N 2 0 420.557 4.277 20 0 HIADRP Cc1ccncc1C[NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000474474631 889335270 /nfs/dbraw/zinc/33/52/70/889335270.db2.gz GUJMKVQLHZCLND-UHFFFAOYSA-N 2 0 406.496 4.101 20 0 HIADRP CC(C)n1nccc1C[NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000474480883 889341989 /nfs/dbraw/zinc/34/19/89/889341989.db2.gz VDYTVZATNCFWLC-UHFFFAOYSA-N 2 0 423.527 4.175 20 0 HIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000474820813 889675136 /nfs/dbraw/zinc/67/51/36/889675136.db2.gz HSDZBQKJVJGKAD-RBUKOAKNSA-N 2 0 400.636 4.328 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[N@H+]4CCCC45CC[NH+](C)CC5)cc3)nc12 ZINC000475117770 889972555 /nfs/dbraw/zinc/97/25/55/889972555.db2.gz LBVMHQQHDVLLNF-UHFFFAOYSA-N 2 0 404.558 4.282 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NC2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000475119457 889975044 /nfs/dbraw/zinc/97/50/44/889975044.db2.gz NFJPFXIVLPRFRX-FQEVSTJZSA-N 2 0 412.622 4.308 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475282714 890181280 /nfs/dbraw/zinc/18/12/80/890181280.db2.gz GEPKEWNYGBWEMK-FPOVZHCZSA-N 2 0 413.993 4.189 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475297558 890205071 /nfs/dbraw/zinc/20/50/71/890205071.db2.gz NPPGOHCJNFTQFM-DENIHFKCSA-N 2 0 413.993 4.189 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000475950851 890872075 /nfs/dbraw/zinc/87/20/75/890872075.db2.gz CCTGRESQMMRJHL-NRFANRHFSA-N 2 0 418.626 4.190 20 0 HIADRP C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000476013558 890941880 /nfs/dbraw/zinc/94/18/80/890941880.db2.gz UFJAVFLIIQJPRZ-UHFFFAOYSA-N 2 0 421.029 4.210 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)[C@H](C)C1 ZINC000477918000 893002739 /nfs/dbraw/zinc/00/27/39/893002739.db2.gz OOOANYIVHGLNDS-RDGATRHJSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(Br)cc1C(F)(F)F ZINC000479297501 894581571 /nfs/dbraw/zinc/58/15/71/894581571.db2.gz RFGOESIUDHTZFQ-ZFWWWQNUSA-N 2 0 423.317 4.355 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000479365702 894663804 /nfs/dbraw/zinc/66/38/04/894663804.db2.gz UIEPTKMSOXGDPO-ILBGXUMGSA-N 2 0 424.633 4.077 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)N2CCC(CC[NH+]3CCCC[C@@H]3C)CC2)C1 ZINC000479446427 894762636 /nfs/dbraw/zinc/76/26/36/894762636.db2.gz BHRZLBTXSZYGPY-YADHBBJMSA-N 2 0 406.659 4.185 20 0 HIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)c1 ZINC000480215171 895618136 /nfs/dbraw/zinc/61/81/36/895618136.db2.gz FPLGPWFGEVSJEH-NRFANRHFSA-N 2 0 408.590 4.206 20 0 HIADRP COCCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)cc1 ZINC000480238560 895649326 /nfs/dbraw/zinc/64/93/26/895649326.db2.gz DMVYUFBMKAXJJJ-NJYVYQBISA-N 2 0 412.574 4.172 20 0 HIADRP COc1cc(F)c([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1OC ZINC000480247234 895658004 /nfs/dbraw/zinc/65/80/04/895658004.db2.gz ZSQGOZCJWFTPQQ-FGTMMUONSA-N 2 0 416.537 4.303 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccc(COCC(F)(F)F)cc1 ZINC000480363273 895768881 /nfs/dbraw/zinc/76/88/81/895768881.db2.gz LWICBIHQBVXXIM-UTKZUKDTSA-N 2 0 407.480 4.161 20 0 HIADRP Cc1nn(Cc2ccccc2)c(C)c1C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000480432567 895825321 /nfs/dbraw/zinc/82/53/21/895825321.db2.gz ARBKULDCJZDDJM-LJQANCHMSA-N 2 0 406.574 4.339 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)c1ccc(-n2cnnn2)cc1 ZINC000480541798 895903937 /nfs/dbraw/zinc/90/39/37/895903937.db2.gz QOWPEQQSMBBSMC-LJQANCHMSA-N 2 0 412.541 4.242 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480599256 895960609 /nfs/dbraw/zinc/96/06/09/895960609.db2.gz DCKMBEJKVYEQLU-MSOLQXFVSA-N 2 0 418.578 4.312 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3CCN(Cc4ccccn4)C[C@@H]3C)cc2)C1 ZINC000480603858 895967739 /nfs/dbraw/zinc/96/77/39/895967739.db2.gz CLBIAALPNGHHAI-UFPGJGBJSA-N 2 0 406.618 4.314 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3CCN(Cc4ccccn4)C[C@H]3C)cc2)C1 ZINC000480603861 895967940 /nfs/dbraw/zinc/96/79/40/895967940.db2.gz CLBIAALPNGHHAI-XLGIIRLISA-N 2 0 406.618 4.314 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)[C@@H](C)C1 ZINC000480630955 896000998 /nfs/dbraw/zinc/00/09/98/896000998.db2.gz MCOMCYQFSAPTTF-HWBMXIPRSA-N 3 0 401.639 4.288 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000480721286 896080731 /nfs/dbraw/zinc/08/07/31/896080731.db2.gz LUDCJTOLLQBMQE-ZWKOTPCHSA-N 2 0 410.562 4.323 20 0 HIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000480736042 896097318 /nfs/dbraw/zinc/09/73/18/896097318.db2.gz TYLPOCNPAVKGKY-SFHVURJKSA-N 2 0 421.614 4.040 20 0 HIADRP C[C@@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000480749888 896111508 /nfs/dbraw/zinc/11/15/08/896111508.db2.gz QJOWJSLZZYWBCG-HOTGVXAUSA-N 2 0 403.364 4.444 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 ZINC000480765416 896129497 /nfs/dbraw/zinc/12/94/97/896129497.db2.gz ZNKLGVDBXHWNJS-INIZCTEOSA-N 2 0 407.027 4.450 20 0 HIADRP O=C(NCCC[NH+](Cc1ccccc1)Cc1ccccc1)N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000481065896 896386862 /nfs/dbraw/zinc/38/68/62/896386862.db2.gz ZCLSRRBCWRHGOJ-JWQCQUIFSA-N 2 0 420.601 4.005 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H](O)Cc1ccccc1C(F)(F)F ZINC000481180670 896521279 /nfs/dbraw/zinc/52/12/79/896521279.db2.gz XKAYSSGUNACEPY-AGHHOFFYSA-N 2 0 406.492 4.109 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCCOc3ccc(Br)cc32)c1 ZINC000481303307 896649126 /nfs/dbraw/zinc/64/91/26/896649126.db2.gz FGJWGLOLXOYASL-HXUWFJFHSA-N 2 0 419.363 4.393 20 0 HIADRP COc1ccc(Cc2nc(C)c([C@@H](C)NC[C@@H](C)C[NH+]3CCCC3)s2)cc1OC ZINC000481344325 896711718 /nfs/dbraw/zinc/71/17/18/896711718.db2.gz WTLKEVQHSWQVDL-IAGOWNOFSA-N 2 0 417.619 4.442 20 0 HIADRP O=C1Nc2ccccc2C12CCC([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000481543450 896902788 /nfs/dbraw/zinc/90/27/88/896902788.db2.gz FCDVAMDOTCTDLE-UHFFFAOYSA-N 2 0 403.570 4.321 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000481716326 897107611 /nfs/dbraw/zinc/10/76/11/897107611.db2.gz KIMBIONVXDNJRN-ATIYNZHBSA-N 2 0 406.618 4.458 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1NC(C)=O ZINC000481731674 897124988 /nfs/dbraw/zinc/12/49/88/897124988.db2.gz WAHARGITIJDZKU-MRXNPFEDSA-N 2 0 401.576 4.278 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCCOc2c(Br)cccc21 ZINC000481733589 897127420 /nfs/dbraw/zinc/12/74/20/897127420.db2.gz FUZXEWCPBIXXCL-IBGZPJMESA-N 2 0 419.363 4.393 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCCOc4ccc(OC)cc43)CC2)cc1 ZINC000481737593 897131246 /nfs/dbraw/zinc/13/12/46/897131246.db2.gz PKYCXOMVRDARFZ-XMMPIXPASA-N 2 0 410.558 4.419 20 0 HIADRP C[N@H+](CC(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)[C@@H]1CCSC1 ZINC000481901629 897281591 /nfs/dbraw/zinc/28/15/91/897281591.db2.gz QBIPEBLAOQCOME-HSZRJFAPSA-N 2 0 423.626 4.003 20 0 HIADRP COc1ccc(-c2ccncc2)cc1C[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000482007925 897405305 /nfs/dbraw/zinc/40/53/05/897405305.db2.gz QJICPIWKUHQOJW-WOJBJXKFSA-N 2 0 409.574 4.078 20 0 HIADRP Cc1cc(NC(=O)c2ccc(Cn3ccnc3)cc2)cc(N2CC[NH+](C(C)C)CC2)c1 ZINC000482032901 897445217 /nfs/dbraw/zinc/44/52/17/897445217.db2.gz MTVUWRLAVRIMAY-UHFFFAOYSA-N 2 0 417.557 4.023 20 0 HIADRP C[C@@H]([NH2+]C[C@H]1CCCN(Cc2cccs2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000482122410 897576216 /nfs/dbraw/zinc/57/62/16/897576216.db2.gz NAJCKMKXDHVODB-WOJBJXKFSA-N 2 0 401.620 4.251 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc2c(c1)COC2 ZINC000482257066 897738675 /nfs/dbraw/zinc/73/86/75/897738675.db2.gz ILALLUSAQMMQRK-LJQANCHMSA-N 2 0 410.558 4.057 20 0 HIADRP Cc1c([C@H](C)[NH2+]C[C@H](C)CN2CC[NH+](C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000482459891 898032275 /nfs/dbraw/zinc/03/22/75/898032275.db2.gz CGFGXTUAWGREDZ-HOTGVXAUSA-N 2 0 424.420 4.022 20 0 HIADRP CCc1nc2c(s1)[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CCC2 ZINC000482529098 898116517 /nfs/dbraw/zinc/11/65/17/898116517.db2.gz APYLSIFSBQFYSS-MAUKXSAKSA-N 2 0 402.583 4.325 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(N2CCCC2=O)c1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482537555 898125249 /nfs/dbraw/zinc/12/52/49/898125249.db2.gz NTSQOGMXXRDCBM-RBUKOAKNSA-N 2 0 424.564 4.116 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccc(N2CCCC2=O)c1 ZINC000482537557 898125567 /nfs/dbraw/zinc/12/55/67/898125567.db2.gz NTSQOGMXXRDCBM-RTBURBONSA-N 2 0 424.564 4.116 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cnn(Cc2ccccc2)c1 ZINC000482550211 898140035 /nfs/dbraw/zinc/14/00/35/898140035.db2.gz PNRHHNODOBAWEH-UXHICEINSA-N 2 0 421.564 4.234 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccccc1Br ZINC000482552039 898141975 /nfs/dbraw/zinc/14/19/75/898141975.db2.gz DXDYGIKXCYRHBG-MRXNPFEDSA-N 2 0 403.364 4.257 20 0 HIADRP CCSc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000482651019 898255420 /nfs/dbraw/zinc/25/54/20/898255420.db2.gz KZGIFJLWFFHEQE-NQIIRXRSSA-N 2 0 411.615 4.347 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3c2cc(Br)cc3F)[C@H](C)C1 ZINC000483129404 898813327 /nfs/dbraw/zinc/81/33/27/898813327.db2.gz SOOOOSWLRZKPMS-UAOJZALGSA-N 2 0 413.375 4.302 20 0 HIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000483202125 898855542 /nfs/dbraw/zinc/85/55/42/898855542.db2.gz QTARVAVJGBPWDH-GIVPXCGWSA-N 2 0 415.528 4.367 20 0 HIADRP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000483247677 898889811 /nfs/dbraw/zinc/88/98/11/898889811.db2.gz OQBGZEUZUZGAHH-OAQYLSRUSA-N 2 0 420.601 4.026 20 0 HIADRP CCOc1ccc(-c2nc(CN3CC[C@H]4[C@@H](CCC[N@@H+]4C)C3)cs2)cc1OC ZINC000483481707 899127102 /nfs/dbraw/zinc/12/71/02/899127102.db2.gz IQHOXHKUCSBPGP-HKUYNNGSSA-N 2 0 401.576 4.134 20 0 HIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(F)c(Br)c1 ZINC000483540582 899201642 /nfs/dbraw/zinc/20/16/42/899201642.db2.gz RFFSXMGWFLBNLQ-INIZCTEOSA-N 2 0 412.391 4.189 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@@H]2CCc3c2cccc3F)CC1 ZINC000483724744 899383393 /nfs/dbraw/zinc/38/33/93/899383393.db2.gz HFUXOZDYWODUQX-HXUWFJFHSA-N 2 0 407.455 4.373 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)NC2CC[NH+](C3CCCC3)CC2)CCCC1)c1ccccc1 ZINC000483795415 899467772 /nfs/dbraw/zinc/46/77/72/899467772.db2.gz ANNWGSHNVUQBEV-HXUWFJFHSA-N 2 0 412.622 4.356 20 0 HIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(-c2ccccc2Br)s1 ZINC000484139739 899761309 /nfs/dbraw/zinc/76/13/09/899761309.db2.gz FUPFAQCSCUEXRG-CQSZACIVSA-N 2 0 409.393 4.285 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+][C@@H](CCSc2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000484150878 899772754 /nfs/dbraw/zinc/77/27/54/899772754.db2.gz DWXXSARTJKCPEJ-NRFANRHFSA-N 2 0 406.542 4.235 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(Cl)sc1Cl ZINC000484288515 899854139 /nfs/dbraw/zinc/85/41/39/899854139.db2.gz AQFBCTJFDHRKRC-GFCCVEGCSA-N 2 0 406.423 4.332 20 0 HIADRP COc1ccc2oc([C@@H](C)[NH2+]CC3CC[NH+](CC(=O)NC(C)(C)C)CC3)c(C)c2c1 ZINC000484292342 899856765 /nfs/dbraw/zinc/85/67/65/899856765.db2.gz CUUDBQPXORCOBW-QGZVFWFLSA-N 2 0 415.578 4.027 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(F)c(Cl)cc1Cl ZINC000484298969 899861337 /nfs/dbraw/zinc/86/13/37/899861337.db2.gz NSGWCQSHIRXELX-CYBMUJFWSA-N 2 0 418.384 4.410 20 0 HIADRP CC[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cccc(Br)c1 ZINC000484301444 899863824 /nfs/dbraw/zinc/86/38/24/899863824.db2.gz AXDMULGLJNDRJI-IBGZPJMESA-N 2 0 424.427 4.117 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000484304980 899864765 /nfs/dbraw/zinc/86/47/65/899864765.db2.gz IDVVFCYAFUNSSX-AWEZNQCLSA-N 2 0 400.394 4.271 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@@H]4CCO[C@@]5(CCSC5)C4)[C@H]3C2)cc1 ZINC000485258678 900543231 /nfs/dbraw/zinc/54/32/31/900543231.db2.gz HEVVBLAKLTWKMZ-HTUFRPJOSA-N 2 0 400.632 4.322 20 0 HIADRP CCOc1ccccc1NC(=O)CC[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000485260667 900544791 /nfs/dbraw/zinc/54/47/91/900544791.db2.gz LXSOXHXESNIDSJ-FQEVSTJZSA-N 2 0 401.595 4.390 20 0 HIADRP CCOc1ccccc1NC(=O)CC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000485347946 900639753 /nfs/dbraw/zinc/63/97/53/900639753.db2.gz NAWKVCBMYACIJC-UPVQGACJSA-N 2 0 421.585 4.400 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000485781534 901036608 /nfs/dbraw/zinc/03/66/08/901036608.db2.gz YORFPRVLDQZCPP-ILWGZMRPSA-N 2 0 400.611 4.022 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000486192541 901377843 /nfs/dbraw/zinc/37/78/43/901377843.db2.gz OWHIUYWZLHXNCE-OFVILXPXSA-N 2 0 405.586 4.455 20 0 HIADRP COc1cc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(SC)cc1OC ZINC000486504796 901656116 /nfs/dbraw/zinc/65/61/16/901656116.db2.gz KMUISNBSAQDZRC-MJGOQNOKSA-N 2 0 400.588 4.426 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](CC(=O)N2CCCCC[C@@H]2c2ccc(OC)cc2)CC1 ZINC000488296793 902759041 /nfs/dbraw/zinc/75/90/41/902759041.db2.gz SDQPUDQGVQLPLH-XMMPIXPASA-N 2 0 415.622 4.193 20 0 HIADRP O=C([C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccc1)N1CCCCC1 ZINC000488499618 902856700 /nfs/dbraw/zinc/85/67/00/902856700.db2.gz ZRJVXSCXQNZZAZ-QHCPKHFHSA-N 2 0 411.615 4.304 20 0 HIADRP c1cc(C[NH+]2CCCC3(CCOCC3)C2)cc(C[N@@H+]2CCCC3(CCOCC3)C2)c1 ZINC000489287616 903310402 /nfs/dbraw/zinc/31/04/02/903310402.db2.gz FKKBXUSKHXKYGD-UHFFFAOYSA-N 2 0 412.618 4.472 20 0 HIADRP c1ccc(C[N@@H+]2CCC[C@@]3(CCCOC3)C2)c(C[NH+]2CCC[C@@]3(CCCOC3)C2)c1 ZINC000489390512 903361237 /nfs/dbraw/zinc/36/12/37/903361237.db2.gz MMVYXAGKHPYFJH-CLJLJLNGSA-N 2 0 412.618 4.472 20 0 HIADRP c1ccc(C[N@@H+]2CCC[C@@]3(CCCOC3)C2)c(C[NH+]2CCC[C@]3(CCCOC3)C2)c1 ZINC000489390515 903361267 /nfs/dbraw/zinc/36/12/67/903361267.db2.gz MMVYXAGKHPYFJH-WMPKNSHKSA-N 2 0 412.618 4.472 20 0 HIADRP Cc1ccc(-c2noc([C@@H](C)[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)n2)cc1F ZINC000506027557 914710138 /nfs/dbraw/zinc/71/01/38/914710138.db2.gz MPMWVDGPNGANRH-GOSISDBHSA-N 2 0 416.541 4.070 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000489436808 903383784 /nfs/dbraw/zinc/38/37/84/903383784.db2.gz MKENPEJVFZAHNP-BWKNWUBXSA-N 2 0 422.617 4.238 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000489539826 903451180 /nfs/dbraw/zinc/45/11/80/903451180.db2.gz SHOAJPNFBBXFIH-FQEVSTJZSA-N 2 0 408.590 4.080 20 0 HIADRP CC(C)N(Cc1ccccc1)C(=O)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000489658083 903523557 /nfs/dbraw/zinc/52/35/57/903523557.db2.gz IPTHVTCIMOFELN-UHFFFAOYSA-N 2 0 407.602 4.268 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)cc1 ZINC000489917934 903673978 /nfs/dbraw/zinc/67/39/78/903673978.db2.gz YQFSGLGTWYADFW-UHFFFAOYSA-N 2 0 422.617 4.334 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)c1ccccc1 ZINC000489920547 903676121 /nfs/dbraw/zinc/67/61/21/903676121.db2.gz YWLJDFCRHDZGDI-VWLOTQADSA-N 2 0 422.617 4.376 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000490138600 903785761 /nfs/dbraw/zinc/78/57/61/903785761.db2.gz VYBJEAQLAJBHGJ-XMMPIXPASA-N 2 0 416.009 4.445 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000490172704 903810721 /nfs/dbraw/zinc/81/07/21/903810721.db2.gz QCMCKQUSZHNBLO-XMSQKQJNSA-N 2 0 416.407 4.154 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCn2cc(Br)cn2)CC1 ZINC000490366299 903959467 /nfs/dbraw/zinc/95/94/67/903959467.db2.gz KNWWKEDEAIXOJG-UHFFFAOYSA-N 2 0 405.384 4.069 20 0 HIADRP C[C@@H](NC(=O)c1oc2ccccc2c1C[NH+](C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000490802106 904248379 /nfs/dbraw/zinc/24/83/79/904248379.db2.gz XWOCOJDBTOAFJL-QUCCMNQESA-N 2 0 405.542 4.135 20 0 HIADRP C[C@H](NC(=O)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000490828619 904271929 /nfs/dbraw/zinc/27/19/29/904271929.db2.gz QKCCSFCKMWUQHF-OYDLWJJNSA-N 2 0 423.576 4.065 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000491021357 904372897 /nfs/dbraw/zinc/37/28/97/904372897.db2.gz NWJYMGIJVDQHPQ-DVECYGJZSA-N 2 0 416.009 4.301 20 0 HIADRP Cc1ccc([C@H]([NH2+]CCC2CC[NH+](C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000491020192 904373465 /nfs/dbraw/zinc/37/34/65/904373465.db2.gz LZAJDYWZRHFQQD-XMMPIXPASA-N 2 0 414.615 4.118 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000491021356 904373890 /nfs/dbraw/zinc/37/38/90/904373890.db2.gz NWJYMGIJVDQHPQ-CYFREDJKSA-N 2 0 416.009 4.301 20 0 HIADRP CSc1cccc([C@@H]([NH2+]CC2CC[NH+](CCO)CC2)c2cc(F)ccc2F)c1 ZINC000491037788 904390948 /nfs/dbraw/zinc/39/09/48/904390948.db2.gz ORNZNZDDXNAOAS-JOCHJYFZSA-N 2 0 406.542 4.070 20 0 HIADRP Cc1ccc([C@@H]([NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c2ccccc2)cc1 ZINC000491056629 904400065 /nfs/dbraw/zinc/40/00/65/904400065.db2.gz BXQIWZGPJHGRNO-VWLOTQADSA-N 2 0 401.554 4.166 20 0 HIADRP CSc1cccc([C@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2cc(F)ccc2F)c1 ZINC000493077891 905012043 /nfs/dbraw/zinc/01/20/43/905012043.db2.gz IQBMEZDBDCZSJT-QHCPKHFHSA-N 2 0 419.585 4.392 20 0 HIADRP COc1ccc([C@H]([NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)c2ccccc2)cc1 ZINC000493202613 905047745 /nfs/dbraw/zinc/04/77/45/905047745.db2.gz HDNYEUHEUHLYEV-RUZDIDTESA-N 2 0 423.601 4.001 20 0 HIADRP CC[NH+]1CCC(CC[NH2+][C@@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000493276402 905073975 /nfs/dbraw/zinc/07/39/75/905073975.db2.gz JFRCZFFFLAGYAS-DEOSSOPVSA-N 2 0 414.615 4.200 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2)CC1 ZINC000493543886 905156234 /nfs/dbraw/zinc/15/62/34/905156234.db2.gz KIBAFHBNVUVPBK-BVAGGSTKSA-N 2 0 419.613 4.077 20 0 HIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)CC2 ZINC000493968088 905316611 /nfs/dbraw/zinc/31/66/11/905316611.db2.gz JCSSHRFVSZBICH-IBGZPJMESA-N 2 0 403.364 4.475 20 0 HIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)ccc1F ZINC000494581009 905847778 /nfs/dbraw/zinc/84/77/78/905847778.db2.gz SRUPEUJUBUDWKD-UHFFFAOYSA-N 2 0 420.454 4.441 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000494598791 905856510 /nfs/dbraw/zinc/85/65/10/905856510.db2.gz FSMKQMOYWDXFFA-VWLOTQADSA-N 2 0 420.601 4.136 20 0 HIADRP Cc1noc(C2CCC([NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)CC2)n1 ZINC000495075053 906222622 /nfs/dbraw/zinc/22/26/22/906222622.db2.gz OSVGANAMQSSIOU-UHFFFAOYSA-N 2 0 412.578 4.065 20 0 HIADRP Cc1ccc([C@@H](OC[C@@H](O)C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c2ccccc2)cc1 ZINC000512581659 921247954 /nfs/dbraw/zinc/24/79/54/921247954.db2.gz JGYVEMOWZHUNNL-ABVWSBSUSA-N 2 0 408.586 4.019 20 0 HIADRP OCC[NH+]1CCC(C[NH2+][C@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)CC1 ZINC000512634527 921269148 /nfs/dbraw/zinc/26/91/48/921269148.db2.gz DCMCXAXURUHYIH-NRFANRHFSA-N 2 0 410.455 4.228 20 0 HIADRP O=C(C1CCC1)N(CCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21)C1CC1 ZINC000512641952 921270841 /nfs/dbraw/zinc/27/08/41/921270841.db2.gz LJNZZGLHIDGWHQ-QLBJFCOMSA-N 2 0 409.618 4.058 20 0 HIADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000497394034 906876665 /nfs/dbraw/zinc/87/66/65/906876665.db2.gz WMICOPZSGZTLLN-UHFFFAOYSA-N 2 0 408.011 4.414 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NC1CC[NH+](CC2CCCC2)CC1)c1ccccc1 ZINC000497566156 907052333 /nfs/dbraw/zinc/05/23/33/907052333.db2.gz LZLFITXVYUZFCH-IBGZPJMESA-N 2 0 400.611 4.070 20 0 HIADRP CC[NH+](CC)CCN(Cc1cccs1)C(=O)N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512702305 921292555 /nfs/dbraw/zinc/29/25/55/921292555.db2.gz DMQXDUJYRJCXPP-PMACEKPBSA-N 2 0 420.667 4.255 20 0 HIADRP CCCN(CC[NH+]1CCCCC1)C(=O)NC1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000497610849 907089171 /nfs/dbraw/zinc/08/91/71/907089171.db2.gz KOBPRZGSOQDUEK-OAQYLSRUSA-N 2 0 400.611 4.120 20 0 HIADRP C[C@@H](NC(=O)[C@H](C)[NH+]1CCC(CC[NH+](C)C)CC1)c1ccc(Cl)cc1Cl ZINC000512706484 921293382 /nfs/dbraw/zinc/29/33/82/921293382.db2.gz ANLXVWMTEHEBMQ-CABCVRRESA-N 2 0 400.394 4.223 20 0 HIADRP C[C@H](NC(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)[C@@H](c1ccccc1)[NH+](C)C ZINC000498024367 907523340 /nfs/dbraw/zinc/52/33/40/907523340.db2.gz CSUWSBGPYVUENH-XODARUQUSA-N 2 0 414.619 4.122 20 0 HIADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)c1cc2sc3ccccc3c2s1 ZINC000498340672 907847784 /nfs/dbraw/zinc/84/77/84/907847784.db2.gz MQMQFOBVUOJCLS-UHFFFAOYSA-N 2 0 403.617 4.462 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)c3cccc(C[NH+]4CCCC4)c3)cc2)C1 ZINC000498584671 908038746 /nfs/dbraw/zinc/03/87/46/908038746.db2.gz RZQSADHUNLPZEX-NRFANRHFSA-N 2 0 405.586 4.444 20 0 HIADRP Cc1cccc([C@@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N2CCOCC2)c1 ZINC000499148389 908505709 /nfs/dbraw/zinc/50/57/09/908505709.db2.gz SULNXTWLNBLLMD-HVWQDESWSA-N 2 0 419.613 4.154 20 0 HIADRP FC(F)(F)c1ccc(OCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)nc1 ZINC000499212725 908567321 /nfs/dbraw/zinc/56/73/21/908567321.db2.gz QPNZNLNUMPFZHC-OWZKRDHZSA-N 2 0 405.464 4.264 20 0 HIADRP COc1cc(OC)cc(N2CC[C@H]([NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499238027 908601763 /nfs/dbraw/zinc/60/17/63/908601763.db2.gz QGVUSXNWAJDLCQ-GPJHCHHRSA-N 2 0 421.585 4.068 20 0 HIADRP CSc1ccc([C@H](C)[NH2+]CC(=O)Nc2cccc(C[NH+]3CCSCC3)c2)cc1 ZINC000500225576 909717447 /nfs/dbraw/zinc/71/74/47/909717447.db2.gz LBCBGISRXNSSOP-KRWDZBQOSA-N 2 0 415.628 4.247 20 0 HIADRP CSc1ccc([C@H](C)[NH2+][C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000500242626 909730695 /nfs/dbraw/zinc/73/06/95/909730695.db2.gz AFRWSWGADUBUON-RBUKOAKNSA-N 2 0 411.615 4.228 20 0 HIADRP C[N@H+](CCOc1cccc(CNc2cc[nH+]c3cc(F)ccc23)c1)C1CCOCC1 ZINC000500396934 909834682 /nfs/dbraw/zinc/83/46/82/909834682.db2.gz LILBUBQVLUMZQJ-UHFFFAOYSA-N 2 0 409.505 4.476 20 0 HIADRP CC(C)C[NH+]1CCC(NC(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)CC1 ZINC000500647096 909990306 /nfs/dbraw/zinc/99/03/06/909990306.db2.gz HOYFTONYLLUPMP-NHCUHLMSSA-N 2 0 414.638 4.084 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1cccs1 ZINC000501012218 910234292 /nfs/dbraw/zinc/23/42/92/910234292.db2.gz VHWHDKJRTAOJKV-RBUKOAKNSA-N 2 0 421.010 4.141 20 0 HIADRP Cc1cc(C(=O)C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c(C)n1Cc1ccco1 ZINC000501018777 910236462 /nfs/dbraw/zinc/23/64/62/910236462.db2.gz GPGRNQUCUPNWRI-UHFFFAOYSA-N 2 0 420.557 4.172 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCC[C@@H]2c2nc(-c3cccc(F)c3)c[nH]2)CC1 ZINC000501029842 910245984 /nfs/dbraw/zinc/24/59/84/910245984.db2.gz RXJLGLMLACGTJL-HSZRJFAPSA-N 2 0 413.585 4.159 20 0 HIADRP C[N@@H+](CC(=O)N(Cc1ccccc1)C(C)(C)C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501031273 910248003 /nfs/dbraw/zinc/24/80/03/910248003.db2.gz NIUNOIVBVGYSNI-UHFFFAOYSA-N 2 0 408.590 4.057 20 0 HIADRP Cc1sc2nc([C@H](C)[N@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)[nH]c(=O)c2c1C ZINC000501043790 910257386 /nfs/dbraw/zinc/25/73/86/910257386.db2.gz GKVGAYDWUKSOSW-HNNXBMFYSA-N 2 0 411.575 4.318 20 0 HIADRP C[C@@H](OC[C@@H](O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000501052591 910263910 /nfs/dbraw/zinc/26/39/10/910263910.db2.gz PCQSYHLDBAUUIK-JPYJTQIMSA-N 2 0 417.981 4.022 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000501054298 910265664 /nfs/dbraw/zinc/26/56/64/910265664.db2.gz XUTHZHLKZCLQTN-KNQAVFIVSA-N 2 0 421.029 4.431 20 0 HIADRP C[C@@H](C(=O)Nc1ccc(F)cc1Cl)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501064358 910272825 /nfs/dbraw/zinc/27/28/25/910272825.db2.gz VXNNPDXTUSRAEQ-HNNXBMFYSA-N 2 0 404.917 4.050 20 0 HIADRP C[C@H](C(=O)Nc1ccc(C(F)(F)F)cc1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501080947 910281669 /nfs/dbraw/zinc/28/16/69/910281669.db2.gz WJSZTHIWFSXUQL-MRXNPFEDSA-N 2 0 420.479 4.276 20 0 HIADRP C[C@H](CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)[N@@H+]1CCC[C@H](C)C1 ZINC000501488827 910605030 /nfs/dbraw/zinc/60/50/30/910605030.db2.gz CQPUCZQHPQDABY-LEWJYISDSA-N 2 0 422.617 4.335 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2c(C)cc(C)cc2C)CC1 ZINC000501767871 910824074 /nfs/dbraw/zinc/82/40/74/910824074.db2.gz ZIHUNVZDNVWYHJ-OAQYLSRUSA-N 2 0 403.611 4.009 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)NC[C@@H](c3cccs3)[NH+]3CCCC3)CC2)CC1 ZINC000502787723 911810699 /nfs/dbraw/zinc/81/06/99/911810699.db2.gz DHDNVNGGCRVRDO-CBNMVNINSA-N 2 0 418.651 4.227 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NCC(C)(C)[NH2+][C@@H](C)c1ccccc1 ZINC000502936925 911923029 /nfs/dbraw/zinc/92/30/29/911923029.db2.gz BAMPFOAOEPFPDB-FQEVSTJZSA-N 2 0 410.606 4.455 20 0 HIADRP CCC(CC)[C@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCCC1 ZINC000502965886 911946164 /nfs/dbraw/zinc/94/61/64/911946164.db2.gz RFWOGEREBBQDFT-DEOSSOPVSA-N 2 0 414.638 4.193 20 0 HIADRP CCC(CC)[C@@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCCC1 ZINC000502965887 911946544 /nfs/dbraw/zinc/94/65/44/911946544.db2.gz RFWOGEREBBQDFT-XMMPIXPASA-N 2 0 414.638 4.193 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)NCc2ccc(C[NH+](C)C)cc2)CCCC1)c1ccccc1 ZINC000503133222 912093688 /nfs/dbraw/zinc/09/36/88/912093688.db2.gz SHFRFYBHVMYXLO-HXUWFJFHSA-N 2 0 408.590 4.211 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000506913732 915714219 /nfs/dbraw/zinc/71/42/19/915714219.db2.gz BVICHYAIJXCALY-QHAWAJNXSA-N 2 0 418.651 4.181 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC000506938476 915741972 /nfs/dbraw/zinc/74/19/72/915741972.db2.gz DSEFJWWSQAODKD-ACESQOTJSA-N 2 0 406.659 4.041 20 0 HIADRP C[NH+](C/C=C/C[N@@H+](C)C[C@@H]1OCCc2ccccc21)C[C@@H]1OCCc2ccccc21 ZINC000507263149 916025496 /nfs/dbraw/zinc/02/54/96/916025496.db2.gz YSECPBDTHDZMHN-LCEHABPXSA-N 2 0 406.570 4.034 20 0 HIADRP Clc1cccc(-c2noc(CC[NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)n2)c1 ZINC000507471367 916240282 /nfs/dbraw/zinc/24/02/82/916240282.db2.gz PAOPTEIEVVJKMF-KSEOMHKRSA-N 2 0 422.960 4.433 20 0 HIADRP Clc1cccc(-c2noc(CC[NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@H]34)n2)c1 ZINC000507471354 916241263 /nfs/dbraw/zinc/24/12/63/916241263.db2.gz PAOPTEIEVVJKMF-BAGYTPMASA-N 2 0 422.960 4.433 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](CC(c2ccccc2)c2ccccc2)CC1 ZINC000507746865 916536205 /nfs/dbraw/zinc/53/62/05/916536205.db2.gz INAYJFHXQXXONN-UHFFFAOYSA-N 2 0 421.629 4.235 20 0 HIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000507890400 916738252 /nfs/dbraw/zinc/73/82/52/916738252.db2.gz VZKJHBVQHQHKJT-QFIPXVFZSA-N 2 0 421.564 4.147 20 0 HIADRP CC(C)[C@H](N[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1nc(-c2ccncc2)no1 ZINC000508696354 917456537 /nfs/dbraw/zinc/45/65/37/917456537.db2.gz HRVQYTGCRFDTQP-BWAGFHJFSA-N 2 0 405.546 4.329 20 0 HIADRP C[C@@H]([NH2+]CCc1nc(-c2ccc(Cl)cc2)no1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703106 917464602 /nfs/dbraw/zinc/46/46/02/917464602.db2.gz XMFYZJYAYYWMPR-XLIONFOSSA-N 2 0 410.949 4.433 20 0 HIADRP COc1ccc([C@H](CN[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)cc1 ZINC000508714414 917475229 /nfs/dbraw/zinc/47/52/29/917475229.db2.gz HBGQDZNIZCBGCK-NZJKTDFXSA-N 2 0 407.602 4.332 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@@H](C)[C@H](c2ccccc2C)[NH+](C)C)CC1 ZINC000508856855 917609333 /nfs/dbraw/zinc/60/93/33/917609333.db2.gz WPMSKCJZKHLNQS-NZQKXSOJSA-N 2 0 402.627 4.140 20 0 HIADRP C[C@@H](NC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H](c1ccccc1)[NH+](C)C ZINC000508913345 917670209 /nfs/dbraw/zinc/67/02/09/917670209.db2.gz BZUPRKVNPLESNZ-YKSBVNFPSA-N 2 0 423.605 4.021 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000509132188 917862030 /nfs/dbraw/zinc/86/20/30/917862030.db2.gz OHGZRIVMKBYMIX-JTHBVZDNSA-N 2 0 424.589 4.016 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]Cc3ccc(-c4cnn(C)c4)s3)cc2)C[C@H](C)O1 ZINC000509533243 918181419 /nfs/dbraw/zinc/18/14/19/918181419.db2.gz POMOBFWZUGRBDU-HDICACEKSA-N 2 0 410.587 4.048 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)c1ccco1 ZINC000509595397 918244495 /nfs/dbraw/zinc/24/44/95/918244495.db2.gz HGHCAAWYLMTIIN-PZJWPPBQSA-N 2 0 404.599 4.006 20 0 HIADRP C[C@H]1C[C@H](CCNC(=O)C2CC[NH+](Cc3ccccc3)CC2)C[N@@H+]1Cc1ccccc1 ZINC000510165541 918717095 /nfs/dbraw/zinc/71/70/95/918717095.db2.gz INNHAJYVJONTNG-DHLKQENFSA-N 2 0 419.613 4.316 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)[NH+]2CCCC2)cc1 ZINC000511251967 919853511 /nfs/dbraw/zinc/85/35/11/919853511.db2.gz RGQZTYKLLVOMCM-SSPYTLHUSA-N 2 0 412.622 4.084 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)[NH+]2CCCC2)cc1 ZINC000511251964 919853826 /nfs/dbraw/zinc/85/38/26/919853826.db2.gz RGQZTYKLLVOMCM-BKULYWANSA-N 2 0 412.622 4.084 20 0 HIADRP O=C(NCC1([NH+]2CCCCC2)CCCCC1)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000511568173 920211292 /nfs/dbraw/zinc/21/12/92/920211292.db2.gz XTBXZGKSORCTOE-UHFFFAOYSA-N 2 0 415.647 4.154 20 0 HIADRP C[N@@H+]1CC[C@H](NC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)CC2(C)C)[C@@H]1c1ccccc1 ZINC000511742009 920416065 /nfs/dbraw/zinc/41/60/65/920416065.db2.gz JOJGVJAXVFCANC-VXNXHJTFSA-N 2 0 420.601 4.032 20 0 HIADRP C[N@@H+]1CC[C@H](NC(=O)N[C@H]2CC[NH+](Cc3ccccc3)CC2(C)C)[C@H]1c1ccccc1 ZINC000511742007 920416184 /nfs/dbraw/zinc/41/61/84/920416184.db2.gz JOJGVJAXVFCANC-KMDXXIMOSA-N 2 0 420.601 4.032 20 0 HIADRP C[NH+](C)Cc1ccc(C(=O)N[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2c2ccccc2)cc1 ZINC000511747324 920424508 /nfs/dbraw/zinc/42/45/08/920424508.db2.gz YOYZOXCWNVWRQL-IZZNHLLZSA-N 2 0 413.565 4.146 20 0 HIADRP C[C@@H]1C[NH+](CC2CC[NH+](Cc3c[nH]nc3-c3ccc(Cl)cc3)CC2)C[C@@H](C)O1 ZINC000512188412 920932344 /nfs/dbraw/zinc/93/23/44/920932344.db2.gz YEZVCNRJYSZJRM-IAGOWNOFSA-N 2 0 402.970 4.051 20 0 HIADRP c1csc(-c2noc(CCC[N@@H+]3CC[C@@]4(CC[NH+](Cc5ccccc5)C4)C3)n2)c1 ZINC000512236989 920992838 /nfs/dbraw/zinc/99/28/38/920992838.db2.gz LBKUENPWJWDURY-HSZRJFAPSA-N 2 0 408.571 4.329 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC[NH+](Cc3ccccc3C)CC2)cc1)C1CC1 ZINC000512252039 921010992 /nfs/dbraw/zinc/01/09/92/921010992.db2.gz GXJSTXZNHQQFDJ-UHFFFAOYSA-N 2 0 405.586 4.374 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512321193 921071289 /nfs/dbraw/zinc/07/12/89/921071289.db2.gz DDHBBBYMJFPUMO-GVDBMIGSSA-N 2 0 407.986 4.308 20 0 HIADRP C[C@@H]1C[C@H](CC[NH2+][C@H](C(=O)NC2CC2)c2ccc(F)cc2)C[N@@H+]1Cc1ccccc1 ZINC000512323590 921074091 /nfs/dbraw/zinc/07/40/91/921074091.db2.gz CYVHJMJDBUIPSF-WWEVIYMKSA-N 2 0 409.549 4.036 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@@H](Cc3ccccn3)c3cccnc3)cc2)C[C@@H](C)O1 ZINC000513500354 921849690 /nfs/dbraw/zinc/84/96/90/921849690.db2.gz MCNMPNBCFVRFCV-YPCDYVTLSA-N 2 0 416.569 4.159 20 0 HIADRP Cc1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000513588095 921920215 /nfs/dbraw/zinc/92/02/15/921920215.db2.gz HTDHRCJPVQRDEO-PWRODBHTSA-N 2 0 409.574 4.111 20 0 HIADRP CCOc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc(Cl)c1O ZINC000513612921 921941989 /nfs/dbraw/zinc/94/19/89/921941989.db2.gz KEPYGRUFPKIQNW-IAGOWNOFSA-N 2 0 418.965 4.343 20 0 HIADRP FC(F)(F)CN1CCC([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000513665840 921988310 /nfs/dbraw/zinc/98/83/10/921988310.db2.gz HSPHEWHCGSNUJW-CEMLEFRQSA-N 2 0 409.540 4.294 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[N@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC000513713604 922032920 /nfs/dbraw/zinc/03/29/20/922032920.db2.gz QMRCGFDBPDLGNT-UHFFFAOYSA-N 2 0 418.585 4.381 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000513747537 922068600 /nfs/dbraw/zinc/06/86/00/922068600.db2.gz QTVMBRMHHFUBMM-UHFFFAOYSA-N 2 0 411.615 4.006 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H](CN2CCCC2=O)c2ccccc2)CC1 ZINC000514105328 922435373 /nfs/dbraw/zinc/43/53/73/922435373.db2.gz QPGBYQULAHBDAQ-STEQJIOHSA-N 2 0 405.586 4.383 20 0 HIADRP CC(C)[C@H](CNC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1)[NH+]1CCC(C)CC1 ZINC000514221822 922556255 /nfs/dbraw/zinc/55/62/55/922556255.db2.gz KBNKIMJSSNVQJF-IRLDBZIGSA-N 2 0 420.667 4.016 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1)c1ccccc1 ZINC000515290611 923036457 /nfs/dbraw/zinc/03/64/57/923036457.db2.gz AGTYZKNZWFWFLN-LEWJYISDSA-N 2 0 414.619 4.267 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(=O)NCCc1ccc(F)cc1 ZINC000515518115 923149574 /nfs/dbraw/zinc/14/95/74/923149574.db2.gz QLVCCTUHATWMHQ-UXHICEINSA-N 2 0 411.565 4.037 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(=O)Nc1ccc(F)c(F)c1 ZINC000515519019 923151314 /nfs/dbraw/zinc/15/13/14/923151314.db2.gz BMLQTPZNTREJDU-DLBZAZTESA-N 2 0 401.501 4.456 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)NC3CC[NH+](C(C)(C)C)CC3)cc2)C1 ZINC000515820260 923373889 /nfs/dbraw/zinc/37/38/89/923373889.db2.gz FUXXTPJTCMFASX-PMACEKPBSA-N 2 0 414.638 4.227 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1Cl ZINC000517104059 923998923 /nfs/dbraw/zinc/99/89/23/923998923.db2.gz PDXICXQYWXGZOQ-GHTZIAJQSA-N 2 0 409.018 4.143 20 0 HIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000517782537 926833808 /nfs/dbraw/zinc/83/38/08/926833808.db2.gz QAHNKAYVJLEADD-OAQYLSRUSA-N 2 0 400.998 4.365 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2cnc(-c3ccccc3)s2)[C@@H](c2ccccc2)C1 ZINC000518269504 927125851 /nfs/dbraw/zinc/12/58/51/927125851.db2.gz FOTAXHDJZSNTJZ-HSZRJFAPSA-N 2 0 406.599 4.279 20 0 HIADRP CC[N@H+](C)[C@@H](C(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccccc1 ZINC000518587753 927365081 /nfs/dbraw/zinc/36/50/81/927365081.db2.gz BMJDMSHVWXFGMZ-HSZRJFAPSA-N 2 0 413.993 4.361 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NCC2CC[NH+](Cc3cccs3)CC2)CC1 ZINC000519935756 928169170 /nfs/dbraw/zinc/16/91/70/928169170.db2.gz QSLHGUZXHIEIFF-UHFFFAOYSA-N 2 0 420.667 4.114 20 0 HIADRP Cc1ccccc1[C@@H]1C[C@@H](C)[N@@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000524593618 929703435 /nfs/dbraw/zinc/70/34/35/929703435.db2.gz JDGLRIXJVYLEHU-ZJSXRUAMSA-N 2 0 405.586 4.085 20 0 HIADRP O[C@@]1(CNCc2ccc(-c3nc4ccccc4s3)o2)CC[N@H+](Cc2ccccc2)C1 ZINC000524637773 929748148 /nfs/dbraw/zinc/74/81/48/929748148.db2.gz TUGWWJYDASAIIG-XMMPIXPASA-N 2 0 419.550 4.283 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000524737454 929814249 /nfs/dbraw/zinc/81/42/49/929814249.db2.gz XIUPJAHOWZCLMI-KKSFZXQISA-N 2 0 411.571 4.369 20 0 HIADRP C[NH+](C)CCn1ccc2ccc(NC(=O)[C@@H]3CCC[N@H+](Cc4ccccc4)C3)cc21 ZINC000524812419 929839751 /nfs/dbraw/zinc/83/97/51/929839751.db2.gz ITVWEFRNFZDXFD-JOCHJYFZSA-N 2 0 404.558 4.054 20 0 HIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC1 ZINC000525636184 930376099 /nfs/dbraw/zinc/37/60/99/930376099.db2.gz JHJICCRXXMXYJE-MRXNPFEDSA-N 2 0 413.528 4.182 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(OC)c(Cl)c2)CC1 ZINC000525695018 930407089 /nfs/dbraw/zinc/40/70/89/930407089.db2.gz HMOFDYHEXWGRHN-INIZCTEOSA-N 2 0 405.945 4.480 20 0 HIADRP COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000525709149 930412264 /nfs/dbraw/zinc/41/22/64/930412264.db2.gz WARWUMDQUYYUES-ICSRJNTNSA-N 2 0 420.557 4.129 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000526945018 930554273 /nfs/dbraw/zinc/55/42/73/930554273.db2.gz KSTLHYIDFSFANV-MOPGFXCFSA-N 2 0 400.588 4.173 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NCc1ccccc1C[NH+]1CCCC1)c1ccc(Cl)cc1 ZINC000530839340 930837762 /nfs/dbraw/zinc/83/77/62/930837762.db2.gz ONYSZEPBWPILBS-QFIPXVFZSA-N 2 0 414.981 4.038 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+]Cc2ccc(OCc3c(F)cccc3Cl)cc2)CC1 ZINC000531141807 930941634 /nfs/dbraw/zinc/94/16/34/930941634.db2.gz GYRKFTDSNFXVJF-UHFFFAOYSA-N 2 0 419.972 4.174 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+]Cc2ccc(-c3ccc(Br)cc3)s2)CC1 ZINC000531380434 931037345 /nfs/dbraw/zinc/03/73/45/931037345.db2.gz SYYJITUXFQTRGX-UHFFFAOYSA-N 2 0 422.436 4.293 20 0 HIADRP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000531723812 931174083 /nfs/dbraw/zinc/17/40/83/931174083.db2.gz HXYCUSMOONIOBC-GCJKJVERSA-N 2 0 406.014 4.435 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]Cc1ccc(Cn2ccnc2)cc1 ZINC000531939656 931254102 /nfs/dbraw/zinc/25/41/02/931254102.db2.gz IFBGBRXZKUBVOU-GOSISDBHSA-N 2 0 410.949 4.112 20 0 HIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000531941767 931255120 /nfs/dbraw/zinc/25/51/20/931255120.db2.gz ZWIFJACDXJKKFQ-QFIPXVFZSA-N 2 0 406.599 4.277 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531967839 931269440 /nfs/dbraw/zinc/26/94/40/931269440.db2.gz WEIBLEOMBYJYOR-AWEZNQCLSA-N 2 0 422.342 4.157 20 0 HIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 ZINC000531980518 931275132 /nfs/dbraw/zinc/27/51/32/931275132.db2.gz KGZWTBFPJGBMLT-HNNXBMFYSA-N 2 0 401.473 4.014 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccc(OC)c(Cl)c2)CC1 ZINC000532193392 931343160 /nfs/dbraw/zinc/34/31/60/931343160.db2.gz NQXUZZMLSOGNDF-GOSISDBHSA-N 2 0 401.982 4.337 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000532200350 931347364 /nfs/dbraw/zinc/34/73/64/931347364.db2.gz JKXIZWXLOUYTLC-OAHLLOKOSA-N 2 0 404.352 4.018 20 0 HIADRP CSc1ccc([C@H](C)[NH2+]Cc2cccc(OCCN3CCOCC3)c2)cc1F ZINC000532211954 931354153 /nfs/dbraw/zinc/35/41/53/931354153.db2.gz ILFFFTCTMGMCLY-KRWDZBQOSA-N 2 0 404.551 4.109 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(Br)s1 ZINC000532215198 931357392 /nfs/dbraw/zinc/35/73/92/931357392.db2.gz ZIHFSOHLWCCLCD-CQSZACIVSA-N 2 0 409.393 4.318 20 0 HIADRP CC[C@H]([NH2+][C@@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Cl)ccc1OC ZINC000532221227 931359607 /nfs/dbraw/zinc/35/96/07/931359607.db2.gz DOKGDEJRDQIBTN-VXKWHMMOSA-N 2 0 401.982 4.378 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cc1 ZINC000532248745 931371393 /nfs/dbraw/zinc/37/13/93/931371393.db2.gz IVYLFSAAZYIEKD-IBGZPJMESA-N 2 0 424.589 4.024 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@@H](c1cccs1)N1CCCC1)C1CC[NH+](C)CC1 ZINC000532361505 931409229 /nfs/dbraw/zinc/40/92/29/931409229.db2.gz VNPZHBBQZWXJAH-QHCPKHFHSA-N 2 0 412.647 4.205 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccc(OC2CCCC2)nc1)C1CC[NH+](C)CC1 ZINC000532362171 931409438 /nfs/dbraw/zinc/40/94/38/931409438.db2.gz QZENEVIBODRIGX-UHFFFAOYSA-N 2 0 408.590 4.223 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(OCc2ccccc2)cc1 ZINC000532451535 931439931 /nfs/dbraw/zinc/43/99/31/931439931.db2.gz DYDSHLBZTYLYBT-NRFANRHFSA-N 2 0 416.569 4.263 20 0 HIADRP O=C(CC[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)Nc1ccccc1Br ZINC000532539800 931515371 /nfs/dbraw/zinc/51/53/71/931515371.db2.gz XWZZFECTQDXQKS-GOSISDBHSA-N 2 0 422.411 4.366 20 0 HIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(OCc4ccc(F)cc4)cc3)C2)CC1 ZINC000532565521 931526413 /nfs/dbraw/zinc/52/64/13/931526413.db2.gz IHKZIEUCRQSEHD-DEOSSOPVSA-N 2 0 411.565 4.005 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2ccc(Sc3ccccc3)cc2)cc1 ZINC000533149749 931787839 /nfs/dbraw/zinc/78/78/39/931787839.db2.gz NPIWKCVKRYCDGJ-UHFFFAOYSA-N 2 0 419.594 4.419 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCc3c2c(Br)ccc3F)cc1 ZINC000534058385 932236104 /nfs/dbraw/zinc/23/61/04/932236104.db2.gz APMPXCWYABURGY-LJQANCHMSA-N 2 0 407.327 4.306 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCc3c2cc(Br)cc3Cl)CC1 ZINC000534058727 932236631 /nfs/dbraw/zinc/23/66/31/932236631.db2.gz MXTRYNOTGWIGEE-IBGZPJMESA-N 2 0 414.819 4.097 20 0 HIADRP Cc1c(Br)cccc1C[N@@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000534872218 932817239 /nfs/dbraw/zinc/81/72/39/932817239.db2.gz UQKWXQJWVJXWNX-UHFFFAOYSA-N 2 0 422.455 4.386 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@H]2CCc3c2c(Br)ccc3F)(N2CCCCC2)CC1 ZINC000535508444 933201836 /nfs/dbraw/zinc/20/18/36/933201836.db2.gz SQNMKHNMCGAJAI-IBGZPJMESA-N 2 0 424.402 4.115 20 0 HIADRP COc1cc(C[NH+]2CCC(OC(C)C)CC2)cc(C[NH+]2CCC(OC(C)C)CC2)c1 ZINC000562418680 945072436 /nfs/dbraw/zinc/07/24/36/945072436.db2.gz JDOSBPUWOKVOBT-UHFFFAOYSA-N 2 0 418.622 4.474 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cn(Cc3ccccc3)nc2-c2cccnc2)[C@@H](C)C1 ZINC000537615074 938333138 /nfs/dbraw/zinc/33/31/38/938333138.db2.gz KSFYPAPDKRVVKF-RDPSFJRHSA-N 2 0 403.574 4.156 20 0 HIADRP c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2N2CCOCC2)CC3)cc1 ZINC000537622871 938337361 /nfs/dbraw/zinc/33/73/61/938337361.db2.gz NZQBCVKJYLVFMH-UHFFFAOYSA-N 2 0 405.586 4.011 20 0 HIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]C[C@@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000537737123 938366177 /nfs/dbraw/zinc/36/61/77/938366177.db2.gz QPDUMBZWLGVKPI-RDPSFJRHSA-N 2 0 413.993 4.349 20 0 HIADRP CC(C)CNC(=O)c1cccc(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000537843997 938388109 /nfs/dbraw/zinc/38/81/09/938388109.db2.gz XOVUNCFCTCDAMW-UHFFFAOYSA-N 2 0 408.590 4.206 20 0 HIADRP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000537969265 938439662 /nfs/dbraw/zinc/43/96/62/938439662.db2.gz RMBOJTPPXKQVRI-UUOWRZLLSA-N 2 0 409.549 4.065 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)NC[C@H]2CCC[NH+](CC(C)C)C2)CC1)CC(C)C ZINC000538076513 938496636 /nfs/dbraw/zinc/49/66/36/938496636.db2.gz BJSFKHLUBUPVEL-HSZRJFAPSA-N 2 0 408.675 4.144 20 0 HIADRP C[C@H](CCc1ccc2c(c1)OCO2)[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538275577 938581220 /nfs/dbraw/zinc/58/12/20/938581220.db2.gz HKSVJVPWVYNNGR-NQIIRXRSSA-N 2 0 408.542 4.314 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c(Br)c1 ZINC000538397212 938610524 /nfs/dbraw/zinc/61/05/24/938610524.db2.gz UUWPOOXGEKJOER-OAHLLOKOSA-N 2 0 407.352 4.249 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c(Br)c1 ZINC000538397091 938610565 /nfs/dbraw/zinc/61/05/65/938610565.db2.gz PNHJUVDYPCUTOV-HNNXBMFYSA-N 2 0 407.352 4.249 20 0 HIADRP Cc1nc(COc2ccc(C[NH+]3CCC(CC[N@H+]4CCCC[C@H]4C)CC3)cc2)no1 ZINC000538721341 938690633 /nfs/dbraw/zinc/69/06/33/938690633.db2.gz CSALIASEJSMEOS-LJQANCHMSA-N 2 0 412.578 4.434 20 0 HIADRP CCn1c2ccccc2c2cc(C[N@@H+]3CC[C@@H](N4CC[NH+](C)CC4)[C@H](C)C3)ccc21 ZINC000538724191 938691798 /nfs/dbraw/zinc/69/17/98/938691798.db2.gz XDNXJWQEHCYYBS-HYBUGGRVSA-N 2 0 404.602 4.272 20 0 HIADRP CCn1c2ccccc2c2cc(C[N@@H+]3CC[C@H](N4CC[NH+](C)CC4)[C@H](C)C3)ccc21 ZINC000538724193 938692272 /nfs/dbraw/zinc/69/22/72/938692272.db2.gz XDNXJWQEHCYYBS-YKSBVNFPSA-N 2 0 404.602 4.272 20 0 HIADRP C[NH+](C)CCOC1CC[NH+](Cc2cn(-c3ccccc3Cl)nc2C(C)(C)C)CC1 ZINC000538732322 938695949 /nfs/dbraw/zinc/69/59/49/938695949.db2.gz CHBGWEQSMCNZCF-UHFFFAOYSA-N 2 0 419.013 4.366 20 0 HIADRP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000538888942 938730978 /nfs/dbraw/zinc/73/09/78/938730978.db2.gz YCDULGXHFMMQFG-DEOSSOPVSA-N 2 0 420.601 4.059 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H](O)Cc1ccc(C(F)(F)F)cc1 ZINC000538947066 938744656 /nfs/dbraw/zinc/74/46/56/938744656.db2.gz RLHDBOSISZVNBW-QFIPXVFZSA-N 2 0 421.507 4.242 20 0 HIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000539292404 938835090 /nfs/dbraw/zinc/83/50/90/938835090.db2.gz KHHNTWKPEOQFRY-IBGZPJMESA-N 2 0 421.585 4.284 20 0 HIADRP CC[C@H]([NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1ccc2c(c1)OCCO2 ZINC000539393257 938853687 /nfs/dbraw/zinc/85/36/87/938853687.db2.gz LJWNVOAIIKVVJW-SFTDATJTSA-N 2 0 408.542 4.487 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1N[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000539394757 938854068 /nfs/dbraw/zinc/85/40/68/938854068.db2.gz ZDWDHAXQGIAQNM-IEZKXTBUSA-N 2 0 419.613 4.475 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@H]1CCN(c3cccc(Cl)c3)C1)c1ccccc1O2 ZINC000539400507 938855205 /nfs/dbraw/zinc/85/52/05/938855205.db2.gz LXTZMALDTMEYLP-UGKGYDQZSA-N 2 0 411.977 4.497 20 0 HIADRP C[N@H+]1CC=C(CNC(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000539459737 938864020 /nfs/dbraw/zinc/86/40/20/938864020.db2.gz XNGNNMRTUDDVFJ-UHFFFAOYSA-N 2 0 418.585 4.011 20 0 HIADRP CC(C)[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc2ccccc2o1 ZINC000539546603 938877822 /nfs/dbraw/zinc/87/78/22/938877822.db2.gz HZUPZFCXVJCHTP-HSZRJFAPSA-N 2 0 407.562 4.112 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2cccc(Br)c2OC(F)F)C[C@H](C)O1 ZINC000539634054 938891240 /nfs/dbraw/zinc/89/12/40/938891240.db2.gz CHOMJVXWMKNEJS-OKILXGFUSA-N 2 0 421.326 4.030 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+](Cc2cc3ccccc3s2)CC1)Cc1ccccc1 ZINC000539835584 938953094 /nfs/dbraw/zinc/95/30/94/938953094.db2.gz NNLCMENOBFIDME-UHFFFAOYSA-N 2 0 421.610 4.362 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[NH+]4CC[C@H]5[C@H](CCC[N@H+]5C)C4)cc3)nc12 ZINC000539897991 938971371 /nfs/dbraw/zinc/97/13/71/938971371.db2.gz GFGGMEJLRZYGDG-QPPBQGQZSA-N 2 0 404.558 4.138 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000540043825 939047232 /nfs/dbraw/zinc/04/72/32/939047232.db2.gz HFCMENQREJOVTA-JOCHJYFZSA-N 2 0 412.965 4.079 20 0 HIADRP c1c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(-c2cccnc2)nn1-c1ccccc1 ZINC000540067619 939057366 /nfs/dbraw/zinc/05/73/66/939057366.db2.gz KWDZYZUNXUPKQG-UHFFFAOYSA-N 2 0 424.552 4.336 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1 ZINC000540143018 939089102 /nfs/dbraw/zinc/08/91/02/939089102.db2.gz BEHURRLPEIJVTC-NLMOZGTASA-N 2 0 407.624 4.142 20 0 HIADRP c1cn(-c2ccccc2)nc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000540202844 939125919 /nfs/dbraw/zinc/12/59/19/939125919.db2.gz MMYWLIUNRFJNCM-UHFFFAOYSA-N 2 0 404.558 4.033 20 0 HIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)CN1Cc1ccccc1 ZINC000540494351 939274760 /nfs/dbraw/zinc/27/47/60/939274760.db2.gz XSDPYBDZBDYTMQ-KIFXHHALSA-N 2 0 405.586 4.227 20 0 HIADRP CC(C)C(=O)Nc1ccc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000540495117 939275953 /nfs/dbraw/zinc/27/59/53/939275953.db2.gz FCDNOFWWAQKAAH-JOCHJYFZSA-N 2 0 407.558 4.359 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)c2cccc(Cn3ccnc3)c2)c2ccccc2)CC1 ZINC000540509645 939281831 /nfs/dbraw/zinc/28/18/31/939281831.db2.gz SFZWMVHGDVIMEL-XMMPIXPASA-N 2 0 402.542 4.134 20 0 HIADRP CCOc1cccc2cc([C@H](C)[NH2+]Cc3ccc(N4CC[NH+](CC)CC4)nc3)oc21 ZINC000540597091 939314883 /nfs/dbraw/zinc/31/48/83/939314883.db2.gz HPZOCZCNBXKSOV-SFHVURJKSA-N 2 0 408.546 4.219 20 0 HIADRP CC[NH+]1CCN(c2ccc(N[C@@H](C)c3cccc(OCC[NH+](C)C)c3)c(C)c2)CC1 ZINC000540707421 939344895 /nfs/dbraw/zinc/34/48/95/939344895.db2.gz AKYNMZDHTPXUAX-NRFANRHFSA-N 2 0 410.606 4.250 20 0 HIADRP CCC[NH+]1CCC(NC(=O)N[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000540711753 939345533 /nfs/dbraw/zinc/34/55/33/939345533.db2.gz AHYFXNJCPXYMKY-NHCUHLMSSA-N 2 0 424.992 4.177 20 0 HIADRP CC(C)N1CC[C@H](NC(=O)NCCC2CC[NH+](C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000540718669 939347730 /nfs/dbraw/zinc/34/77/30/939347730.db2.gz URUCWTRGOLYVAY-LEWJYISDSA-N 2 0 424.992 4.034 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1cccc(C[NH+]2CCC(CO)CC2)c1 ZINC000540749971 939358634 /nfs/dbraw/zinc/35/86/34/939358634.db2.gz RRMFHMMRLYMXET-RLWLMLJZSA-N 2 0 407.602 4.213 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cc(Br)ccc3F)cc2)CC1 ZINC000563676921 945248678 /nfs/dbraw/zinc/24/86/78/945248678.db2.gz VYMGKYMZBIOSRE-UHFFFAOYSA-N 2 0 407.327 4.351 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(OCC(F)(F)F)cc1 ZINC000540991128 939426840 /nfs/dbraw/zinc/42/68/40/939426840.db2.gz XZXOIPRFNBAXHR-UWJYYQICSA-N 2 0 422.491 4.435 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1OC(F)(F)F ZINC000540991041 939426862 /nfs/dbraw/zinc/42/68/62/939426862.db2.gz WZUVRKGDUYPSBL-APWZRJJASA-N 2 0 408.464 4.393 20 0 HIADRP O=C(NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)N(c1ccccc1)c1ccccc1 ZINC000541118991 939467109 /nfs/dbraw/zinc/46/71/09/939467109.db2.gz XWRWEEVTSMIXBT-UHFFFAOYSA-N 2 0 415.541 4.142 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000541543226 939548433 /nfs/dbraw/zinc/54/84/33/939548433.db2.gz FVNPFNSZUIORKS-FQEVSTJZSA-N 2 0 410.558 4.321 20 0 HIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCCc3nc(-c4ccc(F)cc4)no3)CC2)C1 ZINC000541553718 939553656 /nfs/dbraw/zinc/55/36/56/939553656.db2.gz MFWSHWHCJJKNQD-DYESRHJHSA-N 2 0 400.542 4.441 20 0 HIADRP C[C@H]1C[N@H+](CCOc2ccc(CC[NH2+][C@@H]3CCC(=O)Nc4ccccc43)cc2)C[C@H]1C ZINC000541564472 939556026 /nfs/dbraw/zinc/55/60/26/939556026.db2.gz RFBZAEVDQAFTPX-JXALWOEJSA-N 2 0 421.585 4.259 20 0 HIADRP C[C@H](CCN[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)[NH2+][C@@H](C)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000541602865 939565996 /nfs/dbraw/zinc/56/59/96/939565996.db2.gz BZHRZFIHKPMYKJ-SJSRKZJXSA-N 3 0 418.714 4.250 20 0 HIADRP CC(C)(C)[NH+]1CCC(Nc2ccccc2N2CC[NH+](CCc3ccncc3)CC2)CC1 ZINC000541901861 939650190 /nfs/dbraw/zinc/65/01/90/939650190.db2.gz PLPZMOXHICUMLK-UHFFFAOYSA-N 2 0 421.633 4.121 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(F)c(Br)c1 ZINC000541913975 939652219 /nfs/dbraw/zinc/65/22/19/939652219.db2.gz FTCBWAREEFCMNT-HNAYVOBHSA-N 2 0 421.354 4.396 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000542144326 939729180 /nfs/dbraw/zinc/72/91/80/939729180.db2.gz HZAYQYSJQBYMMY-SFHVURJKSA-N 2 0 406.014 4.321 20 0 HIADRP Cc1ccc(COc2ccc(C[NH+]3CCC(C)(C[NH+]4CCN(C)CC4)CC3)cc2)cc1 ZINC000542689315 939854408 /nfs/dbraw/zinc/85/44/08/939854408.db2.gz XPILWAIGMGEQJJ-UHFFFAOYSA-N 2 0 421.629 4.424 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(C)[C@@H](C)C1CC[NH+](C)CC1)c1ccccc1Cl ZINC000542726007 939857110 /nfs/dbraw/zinc/85/71/10/939857110.db2.gz HLBMBOJTPADVDW-LAUBAEHRSA-N 2 0 409.018 4.095 20 0 HIADRP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000542846345 939862647 /nfs/dbraw/zinc/86/26/47/939862647.db2.gz JMAIZSKNODMRKK-IRLDBZIGSA-N 2 0 400.950 4.219 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccccc1Br ZINC000542848312 939862851 /nfs/dbraw/zinc/86/28/51/939862851.db2.gz XOCLSNIFUQHDRB-GHTZIAJQSA-N 2 0 403.364 4.257 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000542851059 939863054 /nfs/dbraw/zinc/86/30/54/939863054.db2.gz FSMYKFHGDYPHCK-SIKLNZKXSA-N 2 0 420.475 4.319 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](CCc1ccccn1)Cc1ccc(F)cc1 ZINC000543397131 940051262 /nfs/dbraw/zinc/05/12/62/940051262.db2.gz VRKKFTWKGJZAME-UHFFFAOYSA-N 2 0 401.489 4.355 20 0 HIADRP COc1cc(-c2ccccc2)ccc1C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000543618250 940135011 /nfs/dbraw/zinc/13/50/11/940135011.db2.gz MZFUCYHBCUNFIO-UHFFFAOYSA-N 2 0 407.602 4.212 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000543775263 940182555 /nfs/dbraw/zinc/18/25/55/940182555.db2.gz QTJXXKZYFBIWEX-VGSWGCGISA-N 2 0 422.598 4.321 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2Br ZINC000543777216 940183517 /nfs/dbraw/zinc/18/35/17/940183517.db2.gz PWAMWXGUQJWVOA-PGRDOPGGSA-N 2 0 415.375 4.183 20 0 HIADRP CC[N@@H+]1CCCN(C(=O)Nc2ccc(C[NH+](C[C@H]3CCCCO3)C(C)C)cc2)CC1 ZINC000543818800 940197291 /nfs/dbraw/zinc/19/72/91/940197291.db2.gz LQZWLODUGMTGOQ-HSZRJFAPSA-N 2 0 416.610 4.026 20 0 HIADRP O=C(C[NH2+][C@H](c1ccc(Cl)cc1)C1CC1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000543989240 940285433 /nfs/dbraw/zinc/28/54/33/940285433.db2.gz AQMMMDODQHKTPS-DEOSSOPVSA-N 2 0 411.977 4.293 20 0 HIADRP COc1ccc(Oc2ccc(C[NH2+]Cc3ccccc3C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000544178254 940345175 /nfs/dbraw/zinc/34/51/75/940345175.db2.gz HMOIEQNSSGBLAP-HSZRJFAPSA-N 2 0 418.537 4.344 20 0 HIADRP C[NH+](C)Cc1cccc(C(=O)N[C@H](c2ccc(F)c(F)c2)C(C)(C)[NH+]2CCCC2)c1 ZINC000544365235 940402754 /nfs/dbraw/zinc/40/27/54/940402754.db2.gz JKHYDBZLNDPHCG-JOCHJYFZSA-N 2 0 415.528 4.372 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1)N1CC[NH+](C)CC1 ZINC000544366709 940403122 /nfs/dbraw/zinc/40/31/22/940403122.db2.gz TYOUQQNSJIXEFA-UIOOFZCWSA-N 2 0 420.576 4.325 20 0 HIADRP C[C@H]1[NH+](Cc2cccc(C[N@@H+]3CCC4(CCOCC4)[C@H]3C)c2)CCC12CCOCC2 ZINC000544549947 940477126 /nfs/dbraw/zinc/47/71/26/940477126.db2.gz NZTSCWZKCURXKQ-FGZHOGPDSA-N 2 0 412.618 4.469 20 0 HIADRP C[C@@H](CS(=O)(=O)c1ccccc1)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000544576628 940483154 /nfs/dbraw/zinc/48/31/54/940483154.db2.gz QYCKGGNBRITWAF-FQEVSTJZSA-N 2 0 414.615 4.403 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)N(C)[C@@H](C)C2CC[NH+](C)CC2)CCCC1)c1ccccc1 ZINC000544657700 940499253 /nfs/dbraw/zinc/49/92/53/940499253.db2.gz ZOOJOLCKGMCNPN-UXHICEINSA-N 2 0 400.611 4.022 20 0 HIADRP c1ccc2c(c1)CO[C@]21CC[NH+](CCCC[N@@H+]2CC[C@]3(C2)OCc2ccccc23)C1 ZINC000545329012 940562004 /nfs/dbraw/zinc/56/20/04/940562004.db2.gz QVQKYAJOMMIYIF-WMPKNSHKSA-N 2 0 404.554 4.029 20 0 HIADRP CC[C@@H]1CN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000546151397 940714971 /nfs/dbraw/zinc/71/49/71/940714971.db2.gz BWLJTTKOMSAAJF-RUZDIDTESA-N 2 0 405.586 4.022 20 0 HIADRP COc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)CC3 ZINC000546606679 940860632 /nfs/dbraw/zinc/86/06/32/940860632.db2.gz JOQGVMWSQPXTFZ-SFTDATJTSA-N 2 0 403.570 4.188 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@@H](Cc2ccc(Cl)cc2)C(N)=O)cc1 ZINC000546886479 940901877 /nfs/dbraw/zinc/90/18/77/940901877.db2.gz VPRITHOXPJVIHY-DEOSSOPVSA-N 2 0 421.972 4.255 20 0 HIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000547395944 941060427 /nfs/dbraw/zinc/06/04/27/941060427.db2.gz ZLQZYWVZYWBWAY-GCJKJVERSA-N 2 0 405.508 4.215 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000547505036 941065947 /nfs/dbraw/zinc/06/59/47/941065947.db2.gz POBMDQAPNVTKPP-BKMJKUGQSA-N 3 0 421.629 4.407 20 0 HIADRP C[C@H]([NH2+]C1(CN[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCOCC1)c1ccccc1 ZINC000547503074 941066007 /nfs/dbraw/zinc/06/60/07/941066007.db2.gz CADBTYNOXCSKBC-JCYRPKCISA-N 2 0 421.629 4.387 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccncc2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547505541 941066187 /nfs/dbraw/zinc/06/61/87/941066187.db2.gz RGJGHTHQCAYLKY-YKSBVNFPSA-N 2 0 414.553 4.334 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483446 941108108 /nfs/dbraw/zinc/10/81/08/941108108.db2.gz MEIFUGFPOAAPHP-GBXCKJPGSA-N 2 0 414.553 4.334 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)N[C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[NH+]3C)CC[N@@H+]1C ZINC000548970937 941135834 /nfs/dbraw/zinc/13/58/34/941135834.db2.gz KIWNMOQHKPYGQE-OBFGGOEXSA-N 2 0 419.013 4.036 20 0 HIADRP C[NH+](C)C[C@@H](NC(=O)NCc1ccccc1C[NH+]1CCCC1)c1ccc(Cl)cc1 ZINC000549104248 941159261 /nfs/dbraw/zinc/15/92/61/941159261.db2.gz QXAUYOMYIVMREK-JOCHJYFZSA-N 2 0 414.981 4.038 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)CN2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000549192409 941170055 /nfs/dbraw/zinc/17/00/55/941170055.db2.gz UAYCAZHDNSMXCH-UHFFFAOYSA-N 2 0 421.560 4.004 20 0 HIADRP CC[NH+](CC)CCCNC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549454110 941191735 /nfs/dbraw/zinc/19/17/35/941191735.db2.gz LFESMFBGPUTGDN-ZXJUBJKJSA-N 2 0 421.029 4.285 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(C(=O)OC)cc1 ZINC000550605949 941345627 /nfs/dbraw/zinc/34/56/27/941345627.db2.gz IJZHPLVCEZWCFF-IECBHUPTSA-N 2 0 410.558 4.323 20 0 HIADRP CN1CC[C@@H]([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)C[C@@H]1c1ccccc1 ZINC000550700359 941355560 /nfs/dbraw/zinc/35/55/60/941355560.db2.gz GCXDOGODEGCMCP-AOYPEHQESA-N 2 0 407.602 4.129 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(OCc4ccncc4)cc3)cc2)CC1 ZINC000551219370 941429909 /nfs/dbraw/zinc/42/99/09/941429909.db2.gz KCYLPJKDKYGFRD-UHFFFAOYSA-N 2 0 417.553 4.423 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H](Cc2ccccc2)C(=O)N2CCCC2)CC1 ZINC000551271797 941441128 /nfs/dbraw/zinc/44/11/28/941441128.db2.gz ZWFRVWYTIOWUNJ-NRUKRLKBSA-N 2 0 419.613 4.253 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+][C@@H](c2sccc2Br)C2CCCCC2)CC1 ZINC000551790908 941545521 /nfs/dbraw/zinc/54/55/21/941545521.db2.gz KLLCADMAOYISSH-MRXNPFEDSA-N 2 0 401.414 4.178 20 0 HIADRP c1ccc(CSCC[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000552113642 941587294 /nfs/dbraw/zinc/58/72/94/941587294.db2.gz BXSWJPAZCZEDMI-XMMPIXPASA-N 2 0 410.627 4.438 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000552332048 941634429 /nfs/dbraw/zinc/63/44/29/941634429.db2.gz ZGMGITULLPQLHC-XUZZJYLKSA-N 2 0 412.622 4.221 20 0 HIADRP COc1cc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)c(-c2ccccc2)cc1OC ZINC000552497687 941688712 /nfs/dbraw/zinc/68/87/12/941688712.db2.gz UHQHZOFAYJOBEK-YMPZKCBVSA-N 2 0 410.558 4.054 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000552905187 941801178 /nfs/dbraw/zinc/80/11/78/941801178.db2.gz RTJWXOKKMQNGBW-XMMPIXPASA-N 2 0 412.622 4.223 20 0 HIADRP O=C(CCC(F)(F)F)N1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000554094868 942035174 /nfs/dbraw/zinc/03/51/74/942035174.db2.gz LKPJUBYCFXFGMC-NCYKPQTJSA-N 2 0 423.523 4.105 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000554809789 942252745 /nfs/dbraw/zinc/25/27/45/942252745.db2.gz DDCQTMWLTYJNBC-ZWKOTPCHSA-N 2 0 422.411 4.364 20 0 HIADRP CC[N@H+](CCNC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C)C(C)C ZINC000554915865 942318046 /nfs/dbraw/zinc/31/80/46/942318046.db2.gz BUKDSBDHGZMZMA-VCWGRIPDSA-N 2 0 421.029 4.283 20 0 HIADRP C[NH+](C)C[C@H](NC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Cl)cc1 ZINC000555113592 942388661 /nfs/dbraw/zinc/38/86/61/942388661.db2.gz VHLRZESVZDWNQV-QFIPXVFZSA-N 2 0 414.981 4.038 20 0 HIADRP C[C@H]1C[N@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000555341343 942485026 /nfs/dbraw/zinc/48/50/26/942485026.db2.gz AFSXGMOAOLWJHI-UQBPGWFLSA-N 2 0 413.556 4.055 20 0 HIADRP Fc1ccc(/C=C\C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c(F)c1 ZINC000555612622 942670299 /nfs/dbraw/zinc/67/02/99/942670299.db2.gz WLOMNVXEKIWVSQ-VWTGBZJHSA-N 2 0 412.524 4.496 20 0 HIADRP c1nc(C2CCC2)sc1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000555618981 942673612 /nfs/dbraw/zinc/67/36/12/942673612.db2.gz UGVJUQYFKKUUGV-NRFANRHFSA-N 2 0 411.615 4.429 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccccc3N3CCO[C@@H](C)C3)cc2)C1 ZINC000555908780 942771058 /nfs/dbraw/zinc/77/10/58/942771058.db2.gz OSDPKTSVJSNSBX-YADHBBJMSA-N 2 0 407.602 4.433 20 0 HIADRP COc1ccc(C[C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000556233802 942824442 /nfs/dbraw/zinc/82/44/42/942824442.db2.gz SVNGKMDRCHVFGJ-URXFXBBRSA-N 2 0 408.586 4.145 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(OC[C@H]4CCCO4)cc3)cc2)CC1 ZINC000556405994 942858455 /nfs/dbraw/zinc/85/84/55/942858455.db2.gz JYZVODGOSCTROG-RUZDIDTESA-N 2 0 410.558 4.007 20 0 HIADRP COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(C)c1OC ZINC000556887486 942951889 /nfs/dbraw/zinc/95/18/89/942951889.db2.gz XVMIKFIDKOZPQV-GOSISDBHSA-N 2 0 412.574 4.206 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2nc(-c3ccccc3)c(C)s2)[C@H](C)C1 ZINC000557278194 943065207 /nfs/dbraw/zinc/06/52/07/943065207.db2.gz YWTYFFULVYUSHC-NQIIRXRSSA-N 2 0 401.620 4.388 20 0 HIADRP c1ncc(NC2CC[NH+](C3CCCC3)CC2)nc1NC1CC[NH+](C2CCCC2)CC1 ZINC000557630518 943239076 /nfs/dbraw/zinc/23/90/76/943239076.db2.gz ROJXJOOUTRFBAR-UHFFFAOYSA-N 2 0 412.626 4.114 20 0 HIADRP O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000557640688 943244141 /nfs/dbraw/zinc/24/41/41/943244141.db2.gz SLLOBDXMZDDKDT-HHHXNRCGSA-N 2 0 417.597 4.023 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCc4c5cc(C)ccc5[nH]c43)cn2)CC1 ZINC000558152815 943398114 /nfs/dbraw/zinc/39/81/14/943398114.db2.gz XUYHHTUMDLZGSP-QHCPKHFHSA-N 2 0 403.574 4.180 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1ccc(Cl)cc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000558482673 943571150 /nfs/dbraw/zinc/57/11/50/943571150.db2.gz ZMOLJYHXGDIOJT-QRFRQXIXSA-N 2 0 423.384 4.233 20 0 HIADRP COc1cc(C[NH2+]CC2(SC)CC[NH+](C)CC2)c(-c2ccccc2)cc1OC ZINC000558494205 943575812 /nfs/dbraw/zinc/57/58/12/943575812.db2.gz GNOYUJIHDBQTDF-UHFFFAOYSA-N 2 0 400.588 4.288 20 0 HIADRP Fc1cc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)ccc1Cl ZINC000559332124 943897645 /nfs/dbraw/zinc/89/76/45/943897645.db2.gz XVFKXTQSIPATSO-FQEVSTJZSA-N 2 0 402.941 4.498 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)[C@@H]2C[NH+](C(C)(C)C)C[C@H]2C(F)(F)F)C1 ZINC000559825870 944062064 /nfs/dbraw/zinc/06/20/64/944062064.db2.gz YWJFYZDASKXZAB-WJFTUGDTSA-N 2 0 417.560 4.008 20 0 HIADRP COc1cccc2c1CC[C@H]2[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000559892324 944078060 /nfs/dbraw/zinc/07/80/60/944078060.db2.gz ICGREYYMYZHYPB-XUZZJYLKSA-N 2 0 406.570 4.201 20 0 HIADRP COc1cc(Br)ccc1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000560094645 944157158 /nfs/dbraw/zinc/15/71/58/944157158.db2.gz IXTZBOORBJNFMX-UHFFFAOYSA-N 2 0 419.363 4.221 20 0 HIADRP CCC[NH+](C)[C@@H](CNC(=O)N1CC[C@H](C[N@@H+](C)CCC)C1)c1ccc(Cl)cc1 ZINC000561872224 944829578 /nfs/dbraw/zinc/82/95/78/944829578.db2.gz ZPEDLAYDJAOEHD-NQIIRXRSSA-N 2 0 409.018 4.096 20 0 HIADRP CC(C)Oc1ccc([C@@H](CNC2CC[NH+](CCc3ccccc3)CC2)[NH+](C)C)cc1 ZINC000562057568 944914796 /nfs/dbraw/zinc/91/47/96/944914796.db2.gz XJTFKDXWTHGIKM-AREMUKBSSA-N 2 0 409.618 4.373 20 0 HIADRP CSC1(C[NH2+][C@@H](C)c2cccc(OCc3cn4ccccc4n3)c2)CC[NH+](C)CC1 ZINC000562104040 944940390 /nfs/dbraw/zinc/94/03/90/944940390.db2.gz OZTJBWFUNQXCTG-IBGZPJMESA-N 2 0 424.614 4.391 20 0 HIADRP CC[NH+]1CCC(C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc(OC)cc2)CC1 ZINC000564108726 945381455 /nfs/dbraw/zinc/38/14/55/945381455.db2.gz FJRLCANSTUYRFQ-UHFFFAOYSA-N 2 0 404.558 4.369 20 0 HIADRP CC(C)[NH+](Cc1ccc(NC(=O)N[C@@H](C)C[N@H+](C)C(C)C)cc1)C[C@H]1CCCCO1 ZINC000564370799 945536934 /nfs/dbraw/zinc/53/69/34/945536934.db2.gz OCKCBJXVNFFJRN-NZQKXSOJSA-N 2 0 418.626 4.316 20 0 HIADRP CC(C)[N@@H+](C)C[C@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000565630780 945858950 /nfs/dbraw/zinc/85/89/50/945858950.db2.gz NHYYIJZWJKGNFP-NGMPGZOMSA-N 2 0 421.029 4.282 20 0 HIADRP CC(C)[N@@H+](C)C[C@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000565630789 945859144 /nfs/dbraw/zinc/85/91/44/945859144.db2.gz NHYYIJZWJKGNFP-PHASAHSISA-N 2 0 421.029 4.282 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](c3ccccc3)c3cncnc3)CC2)cc1 ZINC000565801479 945887284 /nfs/dbraw/zinc/88/72/84/945887284.db2.gz PYKVZQFYFJQHKH-VWLOTQADSA-N 2 0 402.542 4.076 20 0 HIADRP Brc1ccn2cc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)nc2c1 ZINC000566040995 945991270 /nfs/dbraw/zinc/99/12/70/945991270.db2.gz KPEMVLFUMGJYAP-UHFFFAOYSA-N 2 0 405.384 4.185 20 0 HIADRP C[NH+](C)CCOc1ccc(-c2noc([C@@H]3CCC[N@H+](Cc4cccc(F)c4)C3)n2)cc1 ZINC000567005296 946213626 /nfs/dbraw/zinc/21/36/26/946213626.db2.gz WNFZKHKYQGXWCJ-HXUWFJFHSA-N 2 0 424.520 4.196 20 0 HIADRP CN(CC[N@H+](C)Cc1cn(-c2ccccc2)nc1-c1cccs1)C1CC[NH+](C)CC1 ZINC000567172716 946259651 /nfs/dbraw/zinc/25/96/51/946259651.db2.gz ZCIJYXQZLSVNQS-UHFFFAOYSA-N 2 0 423.630 4.059 20 0 HIADRP Cc1cc(C[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cc(C)c1O ZINC000568328552 946510256 /nfs/dbraw/zinc/51/02/56/946510256.db2.gz BUXBTBLSYXQYAG-UHFFFAOYSA-N 2 0 407.480 4.069 20 0 HIADRP COc1cc(C[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)ccc1C ZINC000568353972 946523336 /nfs/dbraw/zinc/52/33/36/946523336.db2.gz LDIOGFBABYHMRZ-UHFFFAOYSA-N 2 0 407.480 4.064 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccc(S(C)(=O)=O)cc1 ZINC000569036412 946804000 /nfs/dbraw/zinc/80/40/00/946804000.db2.gz CMBZCLINEUTHTO-IBGZPJMESA-N 2 0 400.588 4.173 20 0 HIADRP CCc1ccc([C@@H]([NH2+]C2CCC([NH+](C)C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000569271066 946846519 /nfs/dbraw/zinc/84/65/19/946846519.db2.gz XABRUHBPDMGSBV-UBVWURDFSA-N 2 0 414.615 4.204 20 0 HIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(C)c1 ZINC000570349784 947209211 /nfs/dbraw/zinc/20/92/11/947209211.db2.gz WEYWUXGCZAZCFJ-FQEVSTJZSA-N 2 0 409.574 4.283 20 0 HIADRP CC[C@H](C(=O)Nc1cc(C[NH+]2CCSCC2)ccc1C)[N@H+](C)Cc1ccccc1 ZINC000574305537 948407515 /nfs/dbraw/zinc/40/75/15/948407515.db2.gz QSMOSSWNQDRBKK-HSZRJFAPSA-N 2 0 411.615 4.393 20 0 HIADRP O=C(C[NH2+][C@H](Cc1ccc(Cl)cc1)C1CCCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000574423132 948436181 /nfs/dbraw/zinc/43/61/81/948436181.db2.gz KERFKKXSFLNJQY-HSZRJFAPSA-N 2 0 418.025 4.164 20 0 HIADRP CSC1(CNC(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)CC[NH+](C)CC1 ZINC000574962112 948566139 /nfs/dbraw/zinc/56/61/39/948566139.db2.gz KPRKNNOPTXYHSS-UHFFFAOYSA-N 2 0 418.651 4.400 20 0 HIADRP Cc1nc(C[N@@H+]2CCCC23CCN(c2ccc(C[NH+]4CCCC4)cn2)CC3)cs1 ZINC001164691602 719813381 /nfs/dbraw/zinc/81/33/81/719813381.db2.gz ILNOBRFNGUXSKS-UHFFFAOYSA-N 2 0 411.619 4.077 20 0 HIADRP c1cn(Cc2ccccc2)c2cc[nH+]c(N3CC[C@@H]4[C@@H]3CC[N@@H+]4Cc3cccnc3)c12 ZINC001164724725 720397406 /nfs/dbraw/zinc/39/74/06/720397406.db2.gz LFWAEJCPLJUOBT-RPBOFIJWSA-N 2 0 409.537 4.333 20 0 HIADRP CC(C)[N@H+](C)Cc1cnc2n1CCN(c1[nH+]c(N3CCCC3)cc3ccccc31)[C@H]2C ZINC001164858812 721007392 /nfs/dbraw/zinc/00/73/92/721007392.db2.gz HIJPAQDKSFXTRV-IBGZPJMESA-N 2 0 418.589 4.453 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3CCC[C@]4(C[C@@H](c5ccccc5)CO4)C3)c2)CC1 ZINC001164774580 721061242 /nfs/dbraw/zinc/06/12/42/721061242.db2.gz WSTZWXGNOSHWLE-BWKNWUBXSA-N 2 0 407.558 4.098 20 0 HIADRP CC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[NH+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1 ZINC001164910688 721564273 /nfs/dbraw/zinc/56/42/73/721564273.db2.gz XFIZAXFSKRLLSS-QPTUXGOLSA-N 2 0 424.564 4.110 20 0 HIADRP COc1ccc2c(cc[nH+]c2N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)c1 ZINC001165023343 721805666 /nfs/dbraw/zinc/80/56/66/721805666.db2.gz JNWHBTPEMDRGQT-WUMKDDEVSA-N 2 0 402.542 4.375 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3C[C@@H]4[C@@H](OCC5CC5)c5ccccc5[C@H]4C3)c2)CC1 ZINC001164975186 722171641 /nfs/dbraw/zinc/17/16/41/722171641.db2.gz HUCCNYMLULUTOI-USZFVNFHSA-N 2 0 419.569 4.256 20 0 HIADRP CC(C)CN1c2ccccc2[C@@H]2CN(c3cc(OC4CC[NH+](C)CC4)cc[nH+]3)CC[C@@H]21 ZINC001165004002 722245602 /nfs/dbraw/zinc/24/56/02/722245602.db2.gz MEBSAVDKDAZUQX-ZCYQVOJMSA-N 2 0 420.601 4.393 20 0 HIADRP COc1ccc(C(=O)Nc2cccc(C[NH2+]Cc3cccc(C[NH+](C)C)c3)c2)cc1 ZINC000027219655 847268428 /nfs/dbraw/zinc/26/84/28/847268428.db2.gz PWVOPSJJJOPJFQ-UHFFFAOYSA-N 2 0 403.526 4.299 20 0 HIADRP C[NH+]1CCN(C(C)(C)C[NH2+]Cc2ccc(-c3ccccc3Br)s2)CC1 ZINC000030664122 847755238 /nfs/dbraw/zinc/75/52/38/847755238.db2.gz FSKAFIBDRXNOPZ-UHFFFAOYSA-N 2 0 422.436 4.293 20 0 HIADRP Cc1cc(O)c(C(C)C)cc1C(=O)N(C)[C@H]1CCCC[C@@H]1[N@H+](C)C1CCN(C)CC1 ZINC000436632178 861875823 /nfs/dbraw/zinc/87/58/23/861875823.db2.gz VRUNLBBZKKBJMD-GOTSBHOMSA-N 2 0 415.622 4.233 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NCc1cccc(C[NH+]2CCCC2)c1 ZINC000048828783 849272949 /nfs/dbraw/zinc/27/29/49/849272949.db2.gz YKEREFSUZXXMSZ-UHFFFAOYSA-N 2 0 408.590 4.122 20 0 HIADRP Cc1c(O)ccc2c(C[NH2+]Cc3ccccc3C[N@H+]3CCCC[C@H]3C)cc(=O)oc12 ZINC000056156213 850261133 /nfs/dbraw/zinc/26/11/33/850261133.db2.gz ZGIFKVJMSNWJOU-QGZVFWFLSA-N 2 0 406.526 4.471 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)CC1 ZINC000056846250 850500140 /nfs/dbraw/zinc/50/01/40/850500140.db2.gz ITDJDTRIVUATCC-NRFANRHFSA-N 2 0 414.638 4.180 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2csc(-c3cccs3)n2)[C@@H](c2ccccc2)C1 ZINC000058179059 850777667 /nfs/dbraw/zinc/77/76/67/850777667.db2.gz AKIHXGQCJBYJHY-HXUWFJFHSA-N 2 0 412.628 4.340 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)N3CCC[N@@H+](C(C)(C)C)CC3)cc2)C1 ZINC000060545618 851141118 /nfs/dbraw/zinc/14/11/18/851141118.db2.gz YZMUWWHOBCYMGO-SFTDATJTSA-N 2 0 414.638 4.180 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC000060566593 851149274 /nfs/dbraw/zinc/14/92/74/851149274.db2.gz RVOLNMQIWZPFMJ-UHFFFAOYSA-N 2 0 414.638 4.324 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2cc(Cl)ccc2OC(F)F)CC1 ZINC000061070249 851287473 /nfs/dbraw/zinc/28/74/73/851287473.db2.gz OPZZHFBAXYGYTD-UHFFFAOYSA-N 2 0 423.935 4.369 20 0 HIADRP CC(C)[NH+]1CCN(c2ccc(C(=O)Nc3cccc(C[NH+]4CCCCC4)c3)cc2)CC1 ZINC000061158876 851307043 /nfs/dbraw/zinc/30/70/43/851307043.db2.gz CJOGMFUELMIBDJ-UHFFFAOYSA-N 2 0 420.601 4.455 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)NCc2cccc(C[NH+](C)C)c2)C1 ZINC000061928555 851473205 /nfs/dbraw/zinc/47/32/05/851473205.db2.gz HYFQSKLTMRFYCB-SFTDATJTSA-N 2 0 422.617 4.226 20 0 HIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2ccc(OCc3ccccc3F)cc2)C[C@H](C)O1 ZINC000062252891 851517275 /nfs/dbraw/zinc/51/72/75/851517275.db2.gz JPKAELRXYUMODV-PMACEKPBSA-N 2 0 400.538 4.384 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCC1)NC1CC[NH+](CC2CCCCC2)CC1 ZINC000062529801 851571811 /nfs/dbraw/zinc/57/18/11/851571811.db2.gz PFYIDPKWVWIRBC-UHFFFAOYSA-N 2 0 412.622 4.126 20 0 HIADRP CCc1cc[n+](C(C(=O)c2cc(C)c(C)cc2C)C(=S)NC2CC[NH+](C)CC2)cc1 ZINC000063441421 851691008 /nfs/dbraw/zinc/69/10/08/851691008.db2.gz BKZWYQMFFMGGLK-UHFFFAOYSA-O 2 0 424.634 4.084 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)C1 ZINC000064237838 851855139 /nfs/dbraw/zinc/85/51/39/851855139.db2.gz YABIVCXQLPZCMJ-JOCHJYFZSA-N 2 0 414.638 4.374 20 0 HIADRP C[NH+](C)Cc1cccc(CNC(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)c1 ZINC000064238565 851855429 /nfs/dbraw/zinc/85/54/29/851855429.db2.gz SBDHJMBRPKSUQK-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2ccc(CN3CC[NH+](C)CC3)cc2)cc1 ZINC000065072302 852053732 /nfs/dbraw/zinc/05/37/32/852053732.db2.gz FVCZYJGOJBDWKY-OAQYLSRUSA-N 2 0 420.601 4.061 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CCC[NH+](Cc3ccc(OC)cc3)CC2)cc1)C(C)C ZINC000110171014 853068370 /nfs/dbraw/zinc/06/83/70/853068370.db2.gz VIIKTACBRBROQU-UHFFFAOYSA-N 2 0 423.601 4.274 20 0 HIADRP C[C@@H]([NH2+]C1CCN(c2ccccn2)CC1)c1ccc(I)cc1 ZINC000195616216 853716252 /nfs/dbraw/zinc/71/62/52/853716252.db2.gz QDUXCYYTUFCNIW-CQSZACIVSA-N 2 0 407.299 4.006 20 0 HIADRP c1cn(-c2ccccc2C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccncc2)cn1 ZINC000236584468 853900478 /nfs/dbraw/zinc/90/04/78/853900478.db2.gz NLWRNXXKEIXMDZ-UHFFFAOYSA-N 2 0 406.493 4.410 20 0 HIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000236621833 853903823 /nfs/dbraw/zinc/90/38/23/853903823.db2.gz AYTLTTDEQFPXFF-JOCHJYFZSA-N 2 0 403.574 4.203 20 0 HIADRP c1[nH]nc(-c2cccnc2)c1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000236697517 853913296 /nfs/dbraw/zinc/91/32/96/853913296.db2.gz ORVZZSVEBWKVTF-UHFFFAOYSA-N 2 0 403.574 4.296 20 0 HIADRP CC(C)(C)n1cc(C[NH2+]CCCC[NH+]2CCOCC2)c(-c2ccccc2Cl)n1 ZINC000236781839 853922409 /nfs/dbraw/zinc/92/24/09/853922409.db2.gz VFQLRHKHYCNEMQ-UHFFFAOYSA-N 2 0 404.986 4.161 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)C1(c2ccccc2)CC[NH2+]CC1)c1ccccc1Cl ZINC000236874359 853930882 /nfs/dbraw/zinc/93/08/82/853930882.db2.gz UPVYUTRKIIZCAP-JOCHJYFZSA-N 2 0 413.993 4.161 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 ZINC000236953139 853941615 /nfs/dbraw/zinc/94/16/15/853941615.db2.gz QAPYBUXEKLVJTR-QGZVFWFLSA-N 2 0 409.496 4.329 20 0 HIADRP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000237157665 853974578 /nfs/dbraw/zinc/97/45/78/853974578.db2.gz BHIOUOWAPQYYBN-UHFFFAOYSA-N 2 0 405.384 4.073 20 0 HIADRP Cc1ccccc1-c1cccc(C[NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c1 ZINC000237178022 853976304 /nfs/dbraw/zinc/97/63/04/853976304.db2.gz BIGLUAUUIBSTLH-UHFFFAOYSA-N 2 0 401.554 4.243 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2cc(F)c(F)c(F)c2)CC1 ZINC000237232820 853987921 /nfs/dbraw/zinc/98/79/21/853987921.db2.gz GQMVCNQEOYZMRX-UHFFFAOYSA-N 2 0 417.397 4.164 20 0 HIADRP Cc1cc(C[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)cc(C)c1OCc1ccccn1 ZINC000237403972 854024756 /nfs/dbraw/zinc/02/47/56/854024756.db2.gz SPLJLNGPFGIGJC-FGZHOGPDSA-N 2 0 411.590 4.256 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000237561485 854055212 /nfs/dbraw/zinc/05/52/12/854055212.db2.gz BSFJIHCNKAZGSR-HNNXBMFYSA-N 2 0 404.352 4.018 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Br)cc2)C[C@H](C)O1 ZINC000237621298 854063753 /nfs/dbraw/zinc/06/37/53/854063753.db2.gz ITJUMPWYGFVFMG-IRXDYDNUSA-N 2 0 403.364 4.348 20 0 HIADRP Cc1ccc(-c2ccc(C[NH2+]Cc3ccc(C(=O)NCC[NH+]4CCCC4)cc3)o2)cc1 ZINC000237725898 854083740 /nfs/dbraw/zinc/08/37/40/854083740.db2.gz XXCISQOOFDZXAO-UHFFFAOYSA-N 2 0 417.553 4.370 20 0 HIADRP C[NH+]1CCN(c2ccc(CNc3cc[nH+]c4cc(C(F)(F)F)ccc34)cn2)CC1 ZINC000301805451 854468438 /nfs/dbraw/zinc/46/84/38/854468438.db2.gz VLLXOCKGNBQULU-UHFFFAOYSA-N 2 0 401.436 4.013 20 0 HIADRP CC(C)c1cc(NC2CC[NH+](C(C)C)CC2)nc(NC2CC[NH+](C(C)C)CC2)n1 ZINC000302765572 854627108 /nfs/dbraw/zinc/62/71/08/854627108.db2.gz LLXNZBSKERMNNX-UHFFFAOYSA-N 2 0 402.631 4.169 20 0 HIADRP CC[NH+]1CCN([C@H]2CCN(c3cc[nH+]c4ccc(Oc5ccccc5)cc43)C2)CC1 ZINC000302914437 854677510 /nfs/dbraw/zinc/67/75/10/854677510.db2.gz VDWAXQTTXQVFCD-FQEVSTJZSA-N 2 0 402.542 4.243 20 0 HIADRP O=C(Nc1cccc(C[NH+]2CCSCC2)c1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000303017958 854724894 /nfs/dbraw/zinc/72/48/94/854724894.db2.gz LBTCFCLAWIOSPA-QFIPXVFZSA-N 2 0 409.599 4.086 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)c1ccccc1 ZINC000303249599 854835212 /nfs/dbraw/zinc/83/52/12/854835212.db2.gz MSKHEYPZRQLHTH-SIKLNZKXSA-N 2 0 411.565 4.283 20 0 HIADRP C[C@@H](CNC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+](C)Cc1ccccc1 ZINC000303489357 854980694 /nfs/dbraw/zinc/98/06/94/854980694.db2.gz RVOJGXXMNABGCH-HTIDIIIKSA-N 2 0 420.601 4.002 20 0 HIADRP CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000303524884 855012168 /nfs/dbraw/zinc/01/21/68/855012168.db2.gz ZWEGNJQHUOXJAW-IBGZPJMESA-N 2 0 420.667 4.160 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NC2CC[NH+]([C@H](C)c3ccccc3)CC2)[NH+]2CCCC2)o1 ZINC000303623609 855083923 /nfs/dbraw/zinc/08/39/23/855083923.db2.gz DOUCMQVIJGALDX-NFBKMPQASA-N 2 0 424.589 4.250 20 0 HIADRP C[C@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309712031 855364362 /nfs/dbraw/zinc/36/43/62/855364362.db2.gz JQRLETARHARGBN-FCEUIQTBSA-N 2 0 401.595 4.276 20 0 HIADRP CC(C)(C)OC(=O)N[C@H]1C[C@@H]([NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)C1(C)C ZINC000404887186 855481812 /nfs/dbraw/zinc/48/18/12/855481812.db2.gz GAFZOHLXMTVYHB-JXALWOEJSA-N 2 0 401.595 4.180 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)cc1 ZINC000410342752 855939244 /nfs/dbraw/zinc/93/92/44/855939244.db2.gz BBTUKEYTSUUZGI-REWPJTCUSA-N 2 0 424.589 4.290 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000410347099 855941364 /nfs/dbraw/zinc/94/13/64/855941364.db2.gz YSGFTJGLCYOVMN-PXDATVDWSA-N 2 0 420.601 4.135 20 0 HIADRP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)NCCCC[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC000410357902 855947742 /nfs/dbraw/zinc/94/77/42/855947742.db2.gz GLNFJVYNMUOCJT-FGZHOGPDSA-N 2 0 414.638 4.230 20 0 HIADRP Cc1nc2ccc(C[N@@H+](C)CCC3CC[NH+](C4CCN(C)CC4)CC3)cc2s1 ZINC000426418847 856281487 /nfs/dbraw/zinc/28/14/87/856281487.db2.gz IFGAUOVWBZVFAL-UHFFFAOYSA-N 2 0 400.636 4.233 20 0 HIADRP Cc1oc(-c2ccsc2)nc1C[NH+]1CCC(CC[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000426789717 856478953 /nfs/dbraw/zinc/47/89/53/856478953.db2.gz XDCKJDOHWPNCAX-IRXDYDNUSA-N 2 0 403.592 4.423 20 0 HIADRP Cc1cc2c(cc1C)[C@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c1)CCS2 ZINC000427693760 856911606 /nfs/dbraw/zinc/91/16/06/856911606.db2.gz GTOHOGAYHCNSFD-JTHBVZDNSA-N 2 0 423.626 4.327 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCc2ncc(C(F)(F)F)cc21 ZINC000427847279 856980209 /nfs/dbraw/zinc/98/02/09/856980209.db2.gz JVJAQBKNVNBYFJ-FPOVZHCZSA-N 2 0 419.491 4.224 20 0 HIADRP FC(F)(F)CN1CC[C@H](C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000428216372 857115014 /nfs/dbraw/zinc/11/50/14/857115014.db2.gz FKXXOTDFUKPQNJ-GXRSIYKFSA-N 2 0 409.540 4.151 20 0 HIADRP CN(C)C(=O)c1cccc(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000428229574 857120244 /nfs/dbraw/zinc/12/02/44/857120244.db2.gz OZGIDQPMDQTTNR-JIMJEQGWSA-N 2 0 419.613 4.211 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000428312800 857148771 /nfs/dbraw/zinc/14/87/71/857148771.db2.gz XCSSMNGKMWOKEF-BWKNWUBXSA-N 2 0 422.617 4.381 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[NH+]2CCCC2)o1 ZINC000428688189 857297087 /nfs/dbraw/zinc/29/70/87/857297087.db2.gz ZJOPVQDGEWNJDL-OIBXWCBGSA-N 2 0 424.589 4.077 20 0 HIADRP Cn1c2ccccc2nc1C[NH+](C)CCCCC[N@@H+](C)Cc1nc2ccccc2n1C ZINC000428711599 857306528 /nfs/dbraw/zinc/30/65/28/857306528.db2.gz QRKDXPYYQQZBAZ-UHFFFAOYSA-N 2 0 418.589 4.194 20 0 HIADRP C[C@@H](c1ccc(OC(F)F)cc1)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430939949 858376227 /nfs/dbraw/zinc/37/62/27/858376227.db2.gz NBNKSAOIWFNPIB-SFHVURJKSA-N 2 0 409.565 4.477 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000431674339 858731141 /nfs/dbraw/zinc/73/11/41/858731141.db2.gz DBYKWSFYJWRMQE-OFVILXPXSA-N 2 0 422.617 4.333 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000431677860 858734407 /nfs/dbraw/zinc/73/44/07/858734407.db2.gz FPIYIDGZXIACFF-ZJSXRUAMSA-N 2 0 414.638 4.193 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000431678963 858734548 /nfs/dbraw/zinc/73/45/48/858734548.db2.gz OBXOSDXPDWBDHR-SDUSCBPUSA-N 2 0 420.601 4.176 20 0 HIADRP COCCC[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(Br)cc1 ZINC000432439423 859165015 /nfs/dbraw/zinc/16/50/15/859165015.db2.gz GMWAGWPSGZQEKW-XLIONFOSSA-N 2 0 413.400 4.007 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)CC1 ZINC000432800595 859367547 /nfs/dbraw/zinc/36/75/47/859367547.db2.gz OLHWUPNHBCVYRW-RPBOFIJWSA-N 2 0 405.586 4.002 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC000433077566 859512055 /nfs/dbraw/zinc/51/20/55/859512055.db2.gz ORJHTAUXDCGILV-QPPBQGQZSA-N 2 0 405.586 4.035 20 0 HIADRP C[C@H]1CN(c2cc[nH+]c3ccc(Oc4ccccc4)cc32)CC[C@H]1[NH+]1CCN(C)CC1 ZINC000433756416 859877875 /nfs/dbraw/zinc/87/78/75/859877875.db2.gz CCMXRAHVXDMMAW-NBGIEHNGSA-N 2 0 416.569 4.489 20 0 HIADRP CN(C(=O)c1oc2ccccc2c1C[NH+](C)C)c1ccc(OCC[NH+]2CCCC2)cc1 ZINC000434144757 860143017 /nfs/dbraw/zinc/14/30/17/860143017.db2.gz NTWHLEAASRPVPM-UHFFFAOYSA-N 2 0 421.541 4.246 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)c1)C1CCOCC1 ZINC000438196150 863625234 /nfs/dbraw/zinc/62/52/34/863625234.db2.gz CQAHWPSXBFMPGD-RTBURBONSA-N 2 0 414.512 4.387 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2ccc(Cl)cc2F)c1)C1CCOCC1 ZINC000438204934 863636312 /nfs/dbraw/zinc/63/63/12/863636312.db2.gz KRXLJLWGMODVCO-UHFFFAOYSA-N 2 0 406.929 4.259 20 0 HIADRP Cc1ccc(NC(=O)N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)c(OCC[NH+](C)C)c1 ZINC000438296364 863772561 /nfs/dbraw/zinc/77/25/61/863772561.db2.gz DANRRYQTSQZWNA-LEWJYISDSA-N 2 0 416.610 4.054 20 0 HIADRP COc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1OC ZINC000467856983 881705824 /nfs/dbraw/zinc/70/58/24/881705824.db2.gz UCHSKQQZWPQGIG-IAGOWNOFSA-N 2 0 401.526 4.007 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc(F)c(F)c1 ZINC000467874958 881736298 /nfs/dbraw/zinc/73/62/98/881736298.db2.gz NRKGAVJITUAYHZ-KRWDZBQOSA-N 2 0 404.501 4.305 20 0 HIADRP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1ccccc1C[NH+](C)C1CCCCC1 ZINC000439225566 864643385 /nfs/dbraw/zinc/64/33/85/864643385.db2.gz RRPCMVVXTWQXHR-RPWUZVMVSA-N 2 0 412.622 4.219 20 0 HIADRP CSc1ccc([C@@H](C)[NH2+]CC(=O)N2CCC[N@H+](Cc3ccccc3C)CC2)cc1 ZINC000439479088 864846696 /nfs/dbraw/zinc/84/66/96/864846696.db2.gz RHRBUIXXBBUUOC-HXUWFJFHSA-N 2 0 411.615 4.102 20 0 HIADRP Cc1ccc(NC2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)cc1NC(=O)CC[NH+](C)C ZINC000468041853 881871576 /nfs/dbraw/zinc/87/15/76/881871576.db2.gz ZGKQREVTTWHHNZ-PGRDOPGGSA-N 2 0 400.611 4.340 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(CCC(F)(F)F)cc1 ZINC000440286710 865538128 /nfs/dbraw/zinc/53/81/28/865538128.db2.gz XNIAPPYOXXZJOI-IBGZPJMESA-N 2 0 414.516 4.061 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)[C@H](C)C1 ZINC000440689187 865867013 /nfs/dbraw/zinc/86/70/13/865867013.db2.gz HSNQBEWIEXPGDD-NDEVUPSOSA-N 2 0 410.602 4.124 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)NC2CCC(C[NH+](C)C)CC2)cc1 ZINC000440835088 865949341 /nfs/dbraw/zinc/94/93/41/865949341.db2.gz TZRGBBZFGZUQIN-UHFFFAOYSA-N 2 0 422.617 4.335 20 0 HIADRP CC(C)[NH+]1CCC(N2CC[NH+](CCCOc3ccc(C(C)(C)C)cc3)CC2)CC1 ZINC000441055700 866131690 /nfs/dbraw/zinc/13/16/90/866131690.db2.gz NYSWQJXYAVOKKE-UHFFFAOYSA-N 2 0 401.639 4.243 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2CCCCOc1ccccc1C(F)(F)F ZINC000441188412 866261273 /nfs/dbraw/zinc/26/12/73/866261273.db2.gz KISKDRSLQPZLTB-YVWKXTFCSA-N 2 0 400.485 4.048 20 0 HIADRP O[C@H](COc1ccc(-c2ccccc2)cc1)C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441408719 866481707 /nfs/dbraw/zinc/48/17/07/866481707.db2.gz XOEDILFAFKTFSF-LLZJGCNPSA-N 2 0 406.570 4.042 20 0 HIADRP Cc1ccc([C@H](OC[C@@H](O)C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c2ccccc2)cc1 ZINC000441460633 866535647 /nfs/dbraw/zinc/53/56/47/866535647.db2.gz YYVDASFUOPACJL-MSLLRLGPSA-N 2 0 422.613 4.270 20 0 HIADRP C[C@H](OC[C@H](O)C[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(Cl)cc1 ZINC000441623167 866721670 /nfs/dbraw/zinc/72/16/70/866721670.db2.gz SVKBSZYIJJJSIJ-XZDHIHRUSA-N 2 0 416.993 4.232 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000446575793 870486149 /nfs/dbraw/zinc/48/61/49/870486149.db2.gz LNZKMQPGYPNAQI-NQIIRXRSSA-N 2 0 400.592 4.057 20 0 HIADRP COC[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)C1CCOCC1 ZINC000446757849 870670573 /nfs/dbraw/zinc/67/05/73/870670573.db2.gz XBHUSMSMIBRJGT-SANMLTNESA-N 2 0 408.586 4.481 20 0 HIADRP CC[C@@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Br)cc1Cl ZINC000446816203 870730359 /nfs/dbraw/zinc/73/03/59/870730359.db2.gz AIEZUCLHKIAPEG-RDTXWAMCSA-N 2 0 402.808 4.027 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccc(Br)cc1Cl)C1CC1 ZINC000446820313 870734466 /nfs/dbraw/zinc/73/44/66/870734466.db2.gz BGLCYVLGKDTURV-VQIMIIECSA-N 2 0 415.803 4.380 20 0 HIADRP CCCOc1c(Br)cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1OC ZINC000446885622 870805273 /nfs/dbraw/zinc/80/52/73/870805273.db2.gz AEMJFRCNHHQRLG-UHFFFAOYSA-N 2 0 411.384 4.211 20 0 HIADRP C[NH+](C)[C@@H]1CCOc2c(NC(=O)[C@H]3CCC[N@H+](Cc4cccc(F)c4)C3)cccc21 ZINC000447728759 871677090 /nfs/dbraw/zinc/67/70/90/871677090.db2.gz MIQZPMXJHDOIEG-PGRDOPGGSA-N 2 0 411.521 4.062 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000448211749 872113364 /nfs/dbraw/zinc/11/33/64/872113364.db2.gz FAAADLDHVQNQHR-XRODADMRSA-N 2 0 424.633 4.219 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)N3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2)C1 ZINC000448216634 872122109 /nfs/dbraw/zinc/12/21/09/872122109.db2.gz FFCBSIORTQXZRF-PBXXJUDPSA-N 2 0 424.633 4.077 20 0 HIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000468546641 882586541 /nfs/dbraw/zinc/58/65/41/882586541.db2.gz DOJUDCDFNWPJOG-JTHBVZDNSA-N 2 0 400.607 4.443 20 0 HIADRP CCN(C(=O)NC[C@@H]1CCC[NH+](CC(C)C)C1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000448467169 872440977 /nfs/dbraw/zinc/44/09/77/872440977.db2.gz PKYCLGNBWUQUBV-WPFOTENUSA-N 2 0 414.638 4.221 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N(C)[C@H]2CC[NH+](CC)C[C@H]2C)c1 ZINC000448524494 872516209 /nfs/dbraw/zinc/51/62/09/872516209.db2.gz IOANNEJWNFWKFD-OFNKIYASSA-N 2 0 402.627 4.180 20 0 HIADRP COCCN1CCC([NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000461792644 874907669 /nfs/dbraw/zinc/90/76/69/874907669.db2.gz XPBLFXUDCOPTTP-UHFFFAOYSA-N 2 0 407.602 4.150 20 0 HIADRP CC[C@@H](C(=O)N1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1)[NH+](CC)CC ZINC000462001741 875123625 /nfs/dbraw/zinc/12/36/25/875123625.db2.gz UQQVGLCQSROMOO-FQEVSTJZSA-N 2 0 413.528 4.249 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@H]2CCO[C@@]3(CCOC3)C2)c2ccc(F)cc2)CC1 ZINC000462802428 875850008 /nfs/dbraw/zinc/85/00/08/875850008.db2.gz NDAIDAYYLNXFSM-HJOGWXRNSA-N 2 0 404.570 4.307 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@H]2CCCc3ccc(O)cc32)CC1 ZINC000462802860 875851484 /nfs/dbraw/zinc/85/14/84/875851484.db2.gz HYNYPOBTBYDLIL-NRFANRHFSA-N 2 0 419.491 4.330 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+]C2CCC(S(C)(=O)=O)CC2)c2ccc(F)cc2)CC1 ZINC000462807312 875853394 /nfs/dbraw/zinc/85/33/94/875853394.db2.gz AJSBEUPPBOBLKH-VNXZQDSDSA-N 2 0 424.626 4.324 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+]CCC2CCS(=O)(=O)CC2)c2ccc(F)cc2)CC1 ZINC000462815058 875857743 /nfs/dbraw/zinc/85/77/43/875857743.db2.gz BOWVHVGRENNNBV-QHCPKHFHSA-N 2 0 424.626 4.183 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@H]2CCCc3c(O)cccc32)CC1 ZINC000462823387 875862042 /nfs/dbraw/zinc/86/20/42/875862042.db2.gz UEULYXCZJUQQGY-FQEVSTJZSA-N 2 0 419.491 4.330 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CCN(Cc3ccccc3Cl)CC2)[C@@H](C)C1 ZINC000463126181 876169248 /nfs/dbraw/zinc/16/92/48/876169248.db2.gz YXMWQCLAPKUYQT-WMZHIEFXSA-N 2 0 408.030 4.031 20 0 HIADRP Clc1ccc([C@H](CC2CC2)[NH2+]CCCC[NH+]2CCN(c3ncccn3)CC2)cc1 ZINC000468935749 883001316 /nfs/dbraw/zinc/00/13/16/883001316.db2.gz LJTWGZKRSXJPPI-QFIPXVFZSA-N 2 0 413.997 4.163 20 0 HIADRP COc1ccccc1[C@H](CN[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[NH+]1CCCC1 ZINC000463136381 876185104 /nfs/dbraw/zinc/18/51/04/876185104.db2.gz DJMDGDSBGUFQEW-RSEQLOHWSA-N 2 0 407.602 4.475 20 0 HIADRP O[C@H]1CCC[C@]1(C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1ccc(F)cc1 ZINC000463235072 876289856 /nfs/dbraw/zinc/28/98/56/876289856.db2.gz FPBQKPMFHITXAM-IZZNHLLZSA-N 2 0 410.577 4.196 20 0 HIADRP O=C(C[N@H+](C1CC1)[C@H]1CCCC[C@H]1C1CCCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000464735494 877971843 /nfs/dbraw/zinc/97/18/43/877971843.db2.gz UBCWHLJZFAFDCU-ZEQRLZLVSA-N 2 0 401.639 4.333 20 0 HIADRP C[N@H+](CCCNC(=O)NC[C@@H]1CCC[NH+](C)[C@H]1c1cccs1)C1CCCCC1 ZINC000465541843 879003373 /nfs/dbraw/zinc/00/33/73/879003373.db2.gz MMPSRBABCYNGMW-GHTZIAJQSA-N 2 0 406.640 4.085 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCc1ccccc1C[NH+]1CCCC[C@H]1C)CC2 ZINC000465563985 879036563 /nfs/dbraw/zinc/03/65/63/879036563.db2.gz HQBIYFISZIOABI-HUVFLSCGSA-N 2 0 412.622 4.218 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CC[C@H](C)[NH+](Cc2ccccc2)CC1 ZINC000465564395 879036671 /nfs/dbraw/zinc/03/66/71/879036671.db2.gz HZASANDRZPADTD-QFIPXVFZSA-N 2 0 422.617 4.333 20 0 HIADRP C[C@H]1C[C@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)CC[N@@H+]1C ZINC000465573517 879048425 /nfs/dbraw/zinc/04/84/25/879048425.db2.gz PGTYBGRWFGLMNC-WMZHIEFXSA-N 2 0 408.590 4.039 20 0 HIADRP CC[NH+](CC)[C@@H]1CCN(C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000465580235 879058948 /nfs/dbraw/zinc/05/89/48/879058948.db2.gz YPQYZVOHVUYIBX-HSZRJFAPSA-N 2 0 408.590 4.041 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)CC(C)C ZINC000465581205 879061950 /nfs/dbraw/zinc/06/19/50/879061950.db2.gz ZEFVTHHDMNQUAO-DYXWJJEUSA-N 2 0 408.656 4.187 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CC[C@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000465615254 879115201 /nfs/dbraw/zinc/11/52/01/879115201.db2.gz IKEBBLMQJCLSKJ-QFIPXVFZSA-N 2 0 422.617 4.334 20 0 HIADRP C[NH+](C)C1(CNC(=O)NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CCCCCC1 ZINC000465622992 879129199 /nfs/dbraw/zinc/12/91/99/879129199.db2.gz CGXHJVRVHTYFPL-ICSRJNTNSA-N 2 0 406.640 4.085 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000503431653 912431903 /nfs/dbraw/zinc/43/19/03/912431903.db2.gz GSKOEBMZXSKLOS-QFIPXVFZSA-N 2 0 414.638 4.326 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCC1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000503439570 912453271 /nfs/dbraw/zinc/45/32/71/912453271.db2.gz BIDKDKLPEOTDAT-JOCHJYFZSA-N 2 0 412.622 4.080 20 0 HIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@@H]2CCC[NH+](C)[C@H]2c2cccs2)C1 ZINC000465897126 879555045 /nfs/dbraw/zinc/55/50/45/879555045.db2.gz QIZZNDDSWYKQKN-SVFBPWRDSA-N 2 0 420.667 4.331 20 0 HIADRP CCC(CC)(CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)[NH2+][C@H](C)c1ccccc1 ZINC000465922440 879584598 /nfs/dbraw/zinc/58/45/98/879584598.db2.gz IBOIIMWOLSUNKU-VEEZFSHISA-N 2 0 400.611 4.211 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NCCCCC[NH+]2CCCCC2)[C@H]1c1cccs1 ZINC000465951132 879619013 /nfs/dbraw/zinc/61/90/13/879619013.db2.gz NGNNKYTZFNXESU-CTNGQTDRSA-N 2 0 406.640 4.086 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000503453399 912476966 /nfs/dbraw/zinc/47/69/66/912476966.db2.gz ORTXCZXPXKMYJL-DEOSSOPVSA-N 2 0 414.638 4.182 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000465981049 879653696 /nfs/dbraw/zinc/65/36/96/879653696.db2.gz GEECFUXYAJJLJR-JKSUJKDBSA-N 2 0 415.409 4.112 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)N2CC[NH+](CC3CCCCC3)CC2)[C@@H]1c1cccs1 ZINC000466077474 879789478 /nfs/dbraw/zinc/78/94/78/879789478.db2.gz MAWZYKSWXCDPAT-IFMALSPDSA-N 2 0 418.651 4.039 20 0 HIADRP CC1CC[NH+](C[C@@H]2CCCN(C(=O)NC[C@@H](c3cccs3)[NH+]3CCCC3)C2)CC1 ZINC000503505341 912553162 /nfs/dbraw/zinc/55/31/62/912553162.db2.gz SYZUEZLHJTVSAE-SFTDATJTSA-N 2 0 418.651 4.039 20 0 HIADRP c1ccc(C(OCC[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c2ccccc2)cc1 ZINC000466923062 880691360 /nfs/dbraw/zinc/69/13/60/880691360.db2.gz IBSLURIDRNTGRT-UHFFFAOYSA-N 2 0 408.586 4.369 20 0 HIADRP CCN(C(=O)NCc1ccc(CC[NH+](C)C)cc1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000467096578 880860281 /nfs/dbraw/zinc/86/02/81/880860281.db2.gz ZJPHCVPTIHEGER-PXDATVDWSA-N 2 0 422.617 4.158 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cc2ccccc2o1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000467268637 881008085 /nfs/dbraw/zinc/00/80/85/881008085.db2.gz MVXYLUDATLIVDO-RBUKOAKNSA-N 2 0 405.542 4.253 20 0 HIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000467341313 881093192 /nfs/dbraw/zinc/09/31/92/881093192.db2.gz DLCNQOCWRSGXAZ-QVKFZJNVSA-N 2 0 401.501 4.063 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CCSc4ccc(OC)cc43)cc2)CC1 ZINC000467419275 881207496 /nfs/dbraw/zinc/20/74/96/881207496.db2.gz QHVJMHQHGFTGEU-HSZRJFAPSA-N 2 0 411.615 4.159 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(NC(=O)CCCOc3ccccc3)cc2)[C@@H](C)C1 ZINC000469232645 883331378 /nfs/dbraw/zinc/33/13/78/883331378.db2.gz UMPYULNFPRVXAS-RDPSFJRHSA-N 2 0 409.574 4.304 20 0 HIADRP CC(C)[C@H](C[N@H+](C)Cc1ccccc1)NCc1nc2c(s1)C[NH+](C(C)C)CC2 ZINC000469563687 883815953 /nfs/dbraw/zinc/81/59/53/883815953.db2.gz LWZDMLCZGKSKJW-NRFANRHFSA-N 2 0 400.636 4.156 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000469723636 883887183 /nfs/dbraw/zinc/88/71/83/883887183.db2.gz WJMJVDPJKDVLDJ-XMMPIXPASA-N 2 0 405.586 4.267 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)[C@@H]1c1cccs1 ZINC000469732963 883891763 /nfs/dbraw/zinc/89/17/63/883891763.db2.gz FXKWKFZFKWWGRA-XMSQKQJNSA-N 2 0 406.555 4.122 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000469843788 884026104 /nfs/dbraw/zinc/02/61/04/884026104.db2.gz VWRSPTGYXMSIKV-NLFFAJNJSA-N 2 0 414.553 4.372 20 0 HIADRP CN(C(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470737115 885193689 /nfs/dbraw/zinc/19/36/89/885193689.db2.gz MVDOOOHUFUEYOI-XZOQPEGZSA-N 2 0 424.589 4.113 20 0 HIADRP CN(C(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470747228 885210876 /nfs/dbraw/zinc/21/08/76/885210876.db2.gz ZHRIEEPZCSIAAK-DQEYMECFSA-N 2 0 420.601 4.130 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)N2CC[C@@H](C[N@H+](C)CC3CC3)C2)CCCC1)c1ccccc1 ZINC000470894787 885392811 /nfs/dbraw/zinc/39/28/11/885392811.db2.gz NCHMBTJTSDVJCM-UNMCSNQZSA-N 2 0 412.622 4.023 20 0 HIADRP O=C(C[N@H+]1CCCCC[C@H]1c1ccc(C(F)(F)F)cc1)NC1CC[NH+](C2CC2)CC1 ZINC000470999229 885500940 /nfs/dbraw/zinc/50/09/40/885500940.db2.gz TVPMKTOUUXWRTJ-NRFANRHFSA-N 2 0 423.523 4.366 20 0 HIADRP CCn1nc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c2ccccc21 ZINC000472078054 886880832 /nfs/dbraw/zinc/88/08/32/886880832.db2.gz ZZKIXYLTUABCEQ-UHFFFAOYSA-N 2 0 406.574 4.217 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000472127879 886919275 /nfs/dbraw/zinc/91/92/75/886919275.db2.gz KABBTICEZRYEPW-MRXNPFEDSA-N 2 0 422.436 4.293 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000472127878 886919738 /nfs/dbraw/zinc/91/97/38/886919738.db2.gz KABBTICEZRYEPW-INIZCTEOSA-N 2 0 422.436 4.293 20 0 HIADRP C[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000472601402 887472656 /nfs/dbraw/zinc/47/26/56/887472656.db2.gz YHNXQNWVLFYSJK-NZJKTDFXSA-N 2 0 419.613 4.157 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1CC([NH+]2CCCCC2)C1)c1ccccc1Cl ZINC000473979076 888843106 /nfs/dbraw/zinc/84/31/06/888843106.db2.gz TXGBRDKCRYQUHM-NGICGMGXSA-N 2 0 407.002 4.039 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3nc4ccc(OC)cc4s3)CC2)cc1 ZINC000474359513 889237202 /nfs/dbraw/zinc/23/72/02/889237202.db2.gz ZYWZOWBENIWOBP-UHFFFAOYSA-N 2 0 411.571 4.315 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc(Cl)cc3-n3cncn3)cc2)C1 ZINC000474464132 889328449 /nfs/dbraw/zinc/32/84/49/889328449.db2.gz LBWJBAURSCNXNA-GOSISDBHSA-N 2 0 409.965 4.442 20 0 HIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000474468280 889332544 /nfs/dbraw/zinc/33/25/44/889332544.db2.gz JZPXLVQBIFSGMD-OYRHEFFESA-N 2 0 404.558 4.080 20 0 HIADRP C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)C1CCSCC1 ZINC000474806911 889660249 /nfs/dbraw/zinc/66/02/49/889660249.db2.gz ZSXKTVWMEMZQJP-HNNXBMFYSA-N 2 0 401.542 4.079 20 0 HIADRP CCN(C(=O)NCc1ccccc1C[NH+]1CCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475008010 889860427 /nfs/dbraw/zinc/86/04/27/889860427.db2.gz KOHVVJFVHRSKQJ-VWLOTQADSA-N 2 0 420.601 4.088 20 0 HIADRP FC(F)(F)C1CCN(C2CC([NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)C2)CC1 ZINC000475348132 890272407 /nfs/dbraw/zinc/27/24/07/890272407.db2.gz LZSSEGRLCDTXGN-PWXBYGRASA-N 2 0 421.551 4.292 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000476008853 890937007 /nfs/dbraw/zinc/93/70/07/890937007.db2.gz RJHRLLBWVQZSBY-LJQANCHMSA-N 2 0 400.611 4.212 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)NCc1ccccc1C[NH+]1CCCCC1)c1ccco1 ZINC000476948859 891886660 /nfs/dbraw/zinc/88/66/60/891886660.db2.gz CZZHPYBDAPVTAZ-SIKLNZKXSA-N 2 0 412.578 4.194 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)[C@H]2CC[NH+](C3CCCCC3)C2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000476977601 891904647 /nfs/dbraw/zinc/90/46/47/891904647.db2.gz ASKXHEPWSUOTAN-FGSXEWAUSA-N 2 0 421.988 4.243 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3cnn(-c4ccc(F)cc4)c3)CC2)c1 ZINC000477216591 892149982 /nfs/dbraw/zinc/14/99/82/892149982.db2.gz JRXWMMYIGWJVLV-UHFFFAOYSA-N 2 0 421.564 4.012 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@@H](c2cccs2)[NH+](C)C)CC1 ZINC000477603821 892685375 /nfs/dbraw/zinc/68/53/75/892685375.db2.gz COKPKSZIUSPCNO-ICSRJNTNSA-N 2 0 406.640 4.037 20 0 HIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)CC1 ZINC000477937774 893027869 /nfs/dbraw/zinc/02/78/69/893027869.db2.gz NDWCOTACWCIQOB-BKMJKUGQSA-N 2 0 406.618 4.314 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479264346 894534307 /nfs/dbraw/zinc/53/43/07/894534307.db2.gz COHXOCYIMRDARN-XMSQKQJNSA-N 2 0 416.407 4.154 20 0 HIADRP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479279853 894555996 /nfs/dbraw/zinc/55/59/96/894555996.db2.gz GEOUGXQAGZWXAN-AWEZNQCLSA-N 2 0 422.333 4.146 20 0 HIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000479748947 895047239 /nfs/dbraw/zinc/04/72/39/895047239.db2.gz TWKKPCUYKINGIU-VQTJNVASSA-N 2 0 409.640 4.022 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480143284 895526010 /nfs/dbraw/zinc/52/60/10/895526010.db2.gz OOXNAKNPVUBMIC-GOSISDBHSA-N 2 0 400.588 4.315 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc(Cl)cn1 ZINC000480225012 895628860 /nfs/dbraw/zinc/62/88/60/895628860.db2.gz MWHRSVOEWGEFES-KRWDZBQOSA-N 2 0 403.954 4.075 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(-n2cccn2)cc1 ZINC000480231700 895636176 /nfs/dbraw/zinc/63/61/76/895636176.db2.gz SQHSPVAZEQIEBA-QHAWAJNXSA-N 2 0 404.558 4.332 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000480236642 895646490 /nfs/dbraw/zinc/64/64/90/895646490.db2.gz VQCRYCWIAPSFIP-VSKRKVRLSA-N 2 0 418.585 4.391 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480241040 895651027 /nfs/dbraw/zinc/65/10/27/895651027.db2.gz MZHVRYSYWDDQRF-GUDVDZBRSA-N 2 0 421.585 4.376 20 0 HIADRP Brc1ccc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000480386807 895793639 /nfs/dbraw/zinc/79/36/39/895793639.db2.gz MQCCCBPFKVJYBX-UHFFFAOYSA-N 2 0 407.352 4.203 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccc(NS(=O)(=O)CC)cc1 ZINC000480417533 895815174 /nfs/dbraw/zinc/81/51/74/895815174.db2.gz OXLQERPMVDRXNY-SFHVURJKSA-N 2 0 403.592 4.141 20 0 HIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@H](C(C)C)N3CC[NH+](C)CC3)s2)cc1 ZINC000480542881 895904035 /nfs/dbraw/zinc/90/40/35/895904035.db2.gz UUODFVGGKAYGKF-LAUBAEHRSA-N 2 0 416.635 4.050 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1)N1CC[NH+](C)CC1 ZINC000480553028 895913385 /nfs/dbraw/zinc/91/33/85/895913385.db2.gz LOCVTRGVZBAGIT-NBGIEHNGSA-N 2 0 413.581 4.327 20 0 HIADRP CSc1ccc([C@H](C[NH2+][C@H]2CC[N@H+](C)C[C@@H]2C)N2CCc3sccc3C2)cc1 ZINC000480615793 895981924 /nfs/dbraw/zinc/98/19/24/895981924.db2.gz SZRVLPUZNJXELL-HSQYWUDLSA-N 2 0 415.672 4.499 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1ccc(NS(C)(=O)=O)cc1 ZINC000480615727 895982375 /nfs/dbraw/zinc/98/23/75/895982375.db2.gz UQLVENUWUIBCGA-MOPGFXCFSA-N 2 0 415.603 4.283 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC[C@H]3C)cc2)[C@@H](C)C1 ZINC000480630954 896000122 /nfs/dbraw/zinc/00/01/22/896000122.db2.gz MCOMCYQFSAPTTF-FBLLAGFSSA-N 3 0 401.639 4.288 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3cccc(OC(F)F)c3)cc2)CC1 ZINC000480687096 896049560 /nfs/dbraw/zinc/04/95/60/896049560.db2.gz DMGNAFZCQZMBOM-SFHVURJKSA-N 2 0 403.517 4.276 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](CCC(C)C)c3ccc(OC)cc3)cn2)CC1 ZINC000480696411 896058774 /nfs/dbraw/zinc/05/87/74/896058774.db2.gz XDCIBZHUQWJVFF-DEOSSOPVSA-N 2 0 410.606 4.499 20 0 HIADRP Cc1cc(C[NH+]2CCSCC2)ccc1NC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000480710810 896072872 /nfs/dbraw/zinc/07/28/72/896072872.db2.gz WKYWECPMXNQZLR-FQEVSTJZSA-N 2 0 401.620 4.137 20 0 HIADRP C[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000480735682 896097631 /nfs/dbraw/zinc/09/76/31/896097631.db2.gz YEPAFRLYMGEUFA-HZPDHXFCSA-N 2 0 423.388 4.086 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)CC1 ZINC000480754288 896115684 /nfs/dbraw/zinc/11/56/84/896115684.db2.gz DBOJAUSZSUHDKJ-IBGZPJMESA-N 2 0 400.636 4.495 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1)c1cncc(F)c1 ZINC000480752096 896115758 /nfs/dbraw/zinc/11/57/58/896115758.db2.gz XFITWXDEVZBWFP-HXUWFJFHSA-N 2 0 404.533 4.394 20 0 HIADRP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000481247662 896598454 /nfs/dbraw/zinc/59/84/54/896598454.db2.gz UHNJHNHLLKVSFO-INIZCTEOSA-N 2 0 424.536 4.339 20 0 HIADRP COc1ccc(Cc2nc(C)c([C@H](C)NC[C@@H](C)C[NH+]3CCCC3)s2)cc1OC ZINC000481344327 896712200 /nfs/dbraw/zinc/71/22/00/896712200.db2.gz WTLKEVQHSWQVDL-SJORKVTESA-N 2 0 417.619 4.442 20 0 HIADRP COc1ccc2cc([C@H](C)[NH2+]Cc3cccc(OCCN4CCOCC4)c3)ccc2c1 ZINC000481415439 896818285 /nfs/dbraw/zinc/81/82/85/896818285.db2.gz FTTGRRBNRKGWHE-FQEVSTJZSA-N 2 0 420.553 4.410 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@@H](c2cccnc2)C2CCC2)CC1 ZINC000481665554 897049676 /nfs/dbraw/zinc/04/96/76/897049676.db2.gz ICVAWVSAAFBQBF-JOCHJYFZSA-N 2 0 418.507 4.483 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@H](c2cccnc2)C2CCC2)CC1 ZINC000481665555 897050287 /nfs/dbraw/zinc/05/02/87/897050287.db2.gz ICVAWVSAAFBQBF-QFIPXVFZSA-N 2 0 418.507 4.483 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3cccc(N4CCCC4=O)c3)CC2)cc1 ZINC000481720546 897114222 /nfs/dbraw/zinc/11/42/22/897114222.db2.gz UCQIZQRDJFKJAE-HXUWFJFHSA-N 2 0 421.585 4.385 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)[C@H](C)C1 ZINC000481736368 897131197 /nfs/dbraw/zinc/13/11/97/897131197.db2.gz NRCRMXPWPSQDJV-RCZVLFRGSA-N 3 0 401.639 4.289 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)[C@@H](C)C1 ZINC000481736370 897131562 /nfs/dbraw/zinc/13/15/62/897131562.db2.gz NRCRMXPWPSQDJV-WIOPSUGQSA-N 3 0 401.639 4.289 20 0 HIADRP C[N@H+](CC(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)[C@H]1CCSC1 ZINC000481901631 897281080 /nfs/dbraw/zinc/28/10/80/897281080.db2.gz QBIPEBLAOQCOME-QHCPKHFHSA-N 2 0 423.626 4.003 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CCCN(Cc2cccs2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482117130 897569568 /nfs/dbraw/zinc/56/95/68/897569568.db2.gz BLVZTBVZOHWGKV-PMACEKPBSA-N 2 0 401.620 4.251 20 0 HIADRP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000482122506 897577885 /nfs/dbraw/zinc/57/78/85/897577885.db2.gz QLNFQKIHVGXSPQ-QGZVFWFLSA-N 2 0 401.624 4.007 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cc(F)c(F)c(F)c1 ZINC000482229954 897709360 /nfs/dbraw/zinc/70/93/60/897709360.db2.gz INWLRODKHOKSNX-MRXNPFEDSA-N 2 0 422.491 4.444 20 0 HIADRP CC[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc2cc(OC)ccc2c1 ZINC000482242371 897723630 /nfs/dbraw/zinc/72/36/30/897723630.db2.gz MOKDWIFLWGXVBH-RUZDIDTESA-N 2 0 419.569 4.381 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(-c2ccccc2)cc1 ZINC000482253951 897734827 /nfs/dbraw/zinc/73/48/27/897734827.db2.gz HTCYWCUOMXHMSH-FQEVSTJZSA-N 2 0 401.554 4.496 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)c1 ZINC000482253818 897735292 /nfs/dbraw/zinc/73/52/92/897735292.db2.gz RRWCCBBVBWITLG-HXUWFJFHSA-N 2 0 418.006 4.348 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000482455310 898024281 /nfs/dbraw/zinc/02/42/81/898024281.db2.gz XZPZRTAUHYHPOO-PZJWPPBQSA-N 2 0 406.574 4.186 20 0 HIADRP CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1OCC ZINC000482544968 898135131 /nfs/dbraw/zinc/13/51/31/898135131.db2.gz VQGCFWQGSNWALD-IBGZPJMESA-N 2 0 412.574 4.292 20 0 HIADRP OCC[NH+]1CCC(C[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000482548484 898138544 /nfs/dbraw/zinc/13/85/44/898138544.db2.gz CRLHPXYTFYVMNZ-SFHVURJKSA-N 2 0 405.995 4.135 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482550227 898140358 /nfs/dbraw/zinc/14/03/58/898140358.db2.gz BHNBYQIERUBWRS-IBGZPJMESA-N 2 0 415.603 4.141 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cc(Br)ccc1F ZINC000482551144 898142009 /nfs/dbraw/zinc/14/20/09/898142009.db2.gz AWRCKJKSDOBSLE-OAHLLOKOSA-N 2 0 421.354 4.396 20 0 HIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(-c2ccc(Br)cc2)s1)N1CC[NH+](C)CC1 ZINC000482560552 898152792 /nfs/dbraw/zinc/15/27/92/898152792.db2.gz QFLGUFSHQPNSKF-CVEARBPZSA-N 2 0 422.436 4.464 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000482567417 898161534 /nfs/dbraw/zinc/16/15/34/898161534.db2.gz VHGUTRZOIDRRHJ-KRWDZBQOSA-N 2 0 422.491 4.435 20 0 HIADRP C[C@H](C[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)N1CC[NH+](C)CC1 ZINC000482570443 898165442 /nfs/dbraw/zinc/16/54/42/898165442.db2.gz WUXUHQZKPXZDAI-QAPCUYQASA-N 2 0 405.011 4.066 20 0 HIADRP CC(C)COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000482627442 898230530 /nfs/dbraw/zinc/23/05/30/898230530.db2.gz HJLCZWMWNXFMDP-HYBUGGRVSA-N 2 0 423.601 4.270 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](CCSc1ccc(F)cc1)c1ccc(F)cc1 ZINC000482644948 898248356 /nfs/dbraw/zinc/24/83/56/898248356.db2.gz UUGGAEYASFAHCS-WZONZLPQSA-N 2 0 419.585 4.414 20 0 HIADRP Cc1cc(C)c2c(c1)[C@@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c1)CCCO2 ZINC000482809034 898419602 /nfs/dbraw/zinc/41/96/02/898419602.db2.gz CADWMCOYUULFEP-VWNXMTODSA-N 2 0 421.585 4.004 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1 ZINC000482864345 898476096 /nfs/dbraw/zinc/47/60/96/898476096.db2.gz ARPQYKDORNZSPY-NRFANRHFSA-N 2 0 418.589 4.048 20 0 HIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)CCC3)cc1 ZINC000482866639 898479986 /nfs/dbraw/zinc/47/99/86/898479986.db2.gz FZPXUXZSEPAYMS-ICSRJNTNSA-N 2 0 415.603 4.023 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc(COC2CCOCC2)c1 ZINC000482876798 898490440 /nfs/dbraw/zinc/49/04/40/898490440.db2.gz PRPDGDNJUOUKQZ-RLWLMLJZSA-N 2 0 408.586 4.382 20 0 HIADRP CCc1nc(CN2CCC(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)cs1 ZINC000482893600 898511276 /nfs/dbraw/zinc/51/12/76/898511276.db2.gz BHJIZXVODHJQCY-UHFFFAOYSA-N 2 0 404.668 4.304 20 0 HIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000483218599 898864935 /nfs/dbraw/zinc/86/49/35/898864935.db2.gz PXDZZDLKDOCJPL-NLFFAJNJSA-N 2 0 412.549 4.209 20 0 HIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000483218598 898865129 /nfs/dbraw/zinc/86/51/29/898865129.db2.gz PXDZZDLKDOCJPL-NBGIEHNGSA-N 2 0 412.549 4.209 20 0 HIADRP C[C@H]1[C@H]([NH+]2CCCC2)CCN1C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000483301656 898932973 /nfs/dbraw/zinc/93/29/73/898932973.db2.gz UPVHOJDFXAPNST-GBXCKJPGSA-N 2 0 412.622 4.219 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@@H](c2cccs2)[NH+]2CCC(C)CC2)C[C@H]1C ZINC000483518619 899180023 /nfs/dbraw/zinc/18/00/23/899180023.db2.gz MYIFGNCHWWFXTQ-AABGKKOBSA-N 2 0 406.640 4.035 20 0 HIADRP CCCCOc1ccc([C@@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1OC ZINC000483519690 899181399 /nfs/dbraw/zinc/18/13/99/899181399.db2.gz REMYIISMMZZMJL-OAQYLSRUSA-N 2 0 417.638 4.475 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(C)[C@H]1CC[N@H+](CC)[C@@H](C)C1)c1ccccc1Cl ZINC000483521499 899183604 /nfs/dbraw/zinc/18/36/04/899183604.db2.gz YJCMXOYVCIDHTG-WFXMLNOXSA-N 2 0 409.018 4.237 20 0 HIADRP CCOc1ccc([C@@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1OCC ZINC000483529972 899192311 /nfs/dbraw/zinc/19/23/11/899192311.db2.gz IXHXIRJDWOHDEU-HXUWFJFHSA-N 2 0 403.611 4.085 20 0 HIADRP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000483598041 899248495 /nfs/dbraw/zinc/24/84/95/899248495.db2.gz YEYUUFNIUAAQKX-FTJBHMTQSA-N 2 0 417.597 4.409 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@H]2CCCOc3ccccc32)CC1 ZINC000483724975 899384149 /nfs/dbraw/zinc/38/41/49/899384149.db2.gz CZDSQXQRTYNTSE-FQEVSTJZSA-N 2 0 419.491 4.461 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)C[C@H]1C ZINC000483765954 899426868 /nfs/dbraw/zinc/42/68/68/899426868.db2.gz ZUVPOCWXVVEFJO-OFNKIYASSA-N 2 0 400.611 4.077 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCN(C(=O)c2ccccc2)CC1 ZINC000484165862 899784922 /nfs/dbraw/zinc/78/49/22/899784922.db2.gz VPGCGQPEGQLRFQ-OFVILXPXSA-N 2 0 405.586 4.039 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1nc(-c2ccccc2)cs1 ZINC000484272697 899844876 /nfs/dbraw/zinc/84/48/76/899844876.db2.gz BDQBSRRVFXCAJS-QGZVFWFLSA-N 2 0 414.619 4.087 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000484482167 899974079 /nfs/dbraw/zinc/97/40/79/899974079.db2.gz IBAWHZNMKDUVIO-LJQANCHMSA-N 2 0 419.038 4.457 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccccc1OC(F)(F)F ZINC000484485693 899977021 /nfs/dbraw/zinc/97/70/21/899977021.db2.gz JNZPBWOEFQBLHX-MRXNPFEDSA-N 2 0 408.464 4.393 20 0 HIADRP C[C@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)c1cccc(N2CCOCC2)c1 ZINC000484500675 899991434 /nfs/dbraw/zinc/99/14/34/899991434.db2.gz NIKVVWCYZAEDON-VSKRKVRLSA-N 2 0 407.602 4.330 20 0 HIADRP C[C@H](NC(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000485398662 900695852 /nfs/dbraw/zinc/69/58/52/900695852.db2.gz BYRVPEPVJIBVJM-GPUOULLFSA-N 2 0 420.601 4.033 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N[C@@H](C)[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000486325040 901501615 /nfs/dbraw/zinc/50/16/15/901501615.db2.gz UEKYQQVXTWGDIO-PEARBKPGSA-N 2 0 420.601 4.032 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486386136 901550454 /nfs/dbraw/zinc/55/04/54/901550454.db2.gz GUQMVEVWIMTZLO-DHLKQENFSA-N 3 0 407.602 4.161 20 0 HIADRP C[C@H]([NH2+]Cc1cnc(-c2ccco2)s1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000487293322 902138698 /nfs/dbraw/zinc/13/86/98/902138698.db2.gz ZHJLZAVBGIQXLO-HNNXBMFYSA-N 2 0 400.523 4.145 20 0 HIADRP C[C@@H](NC(=O)c1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487296030 902140039 /nfs/dbraw/zinc/14/00/39/902140039.db2.gz GSBGCHGFXVNNOA-BWKNWUBXSA-N 2 0 405.586 4.313 20 0 HIADRP c1cc(C[NH+]2CCC[C@H]([C@H]3CCOC3)C2)cc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000487904960 902441149 /nfs/dbraw/zinc/44/11/49/902441149.db2.gz CZSUZPGGZRMYBW-ASDGIDEWSA-N 2 0 412.618 4.184 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C)cc1)C1CC1 ZINC000488531352 902871914 /nfs/dbraw/zinc/87/19/14/902871914.db2.gz LZGRQNPTOLUEDD-NBGIEHNGSA-N 2 0 405.586 4.311 20 0 HIADRP C[NH+](C)CCC1CC[NH+](Cc2cccc(C[NH+]3CCC(CC[NH+](C)C)CC3)c2)CC1 ZINC000488757385 902982041 /nfs/dbraw/zinc/98/20/41/902982041.db2.gz HBGMUYCSICWTHB-UHFFFAOYSA-N 4 0 414.682 4.014 20 0 HIADRP O=C(C[NH+]1CCC(CCC[NH+]2CCOCC2)CC1)Nc1ccccc1-c1ccccc1 ZINC000506009103 914681682 /nfs/dbraw/zinc/68/16/82/914681682.db2.gz TUMDWLBPKGBKFW-UHFFFAOYSA-N 2 0 421.585 4.117 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)[NH+]2CCCC2)o1 ZINC000489131363 903220380 /nfs/dbraw/zinc/22/03/80/903220380.db2.gz DOEJTGKVQOIJPG-QHCPKHFHSA-N 2 0 424.589 4.031 20 0 HIADRP Cc1cc(-c2noc([C@H](C)[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)n2)ccc1F ZINC000506027518 914710185 /nfs/dbraw/zinc/71/01/85/914710185.db2.gz MAQNWFHQPOIEOX-SFHVURJKSA-N 2 0 416.541 4.070 20 0 HIADRP c1cc(C[NH+]2CCC[C@@]3(CCCOC3)C2)cc(C[N@@H+]2CCC[C@]3(CCCOC3)C2)c1 ZINC000489400193 903368409 /nfs/dbraw/zinc/36/84/09/903368409.db2.gz ZGNKHSVQYRRUIH-WMPKNSHKSA-N 2 0 412.618 4.472 20 0 HIADRP Cc1cccc(C(C)C)c1NC(=O)[C@H](C)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506028527 914710928 /nfs/dbraw/zinc/71/09/28/914710928.db2.gz VETMOBLGSQPGKG-NRFANRHFSA-N 2 0 415.622 4.270 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000489520325 903433874 /nfs/dbraw/zinc/43/38/74/903433874.db2.gz YOSOCIQECMJZHY-ZJSXRUAMSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H](CCNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[N@H+](C)Cc1ccccc1 ZINC000489533783 903443651 /nfs/dbraw/zinc/44/36/51/903443651.db2.gz ZTGPGHIWZJHGKC-QFIPXVFZSA-N 2 0 422.617 4.203 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000489837690 903622517 /nfs/dbraw/zinc/62/25/17/903622517.db2.gz TZRHPUCUZCCFPG-SQJMNOBHSA-N 2 0 422.617 4.238 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489908505 903666324 /nfs/dbraw/zinc/66/63/24/903666324.db2.gz FQYLNSAJNIXYDF-SZPZYZBQSA-N 2 0 414.638 4.051 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H](c1ccccc1)c1ccc(OC(F)F)cc1)N1CC[NH+](C)CC1 ZINC000490163840 903805023 /nfs/dbraw/zinc/80/50/23/903805023.db2.gz HVOIIKDJQOCCBI-XZOQPEGZSA-N 2 0 417.544 4.239 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000490172702 903810354 /nfs/dbraw/zinc/81/03/54/903810354.db2.gz QCMCKQUSZHNBLO-GCJKJVERSA-N 2 0 416.407 4.154 20 0 HIADRP CSc1cccc([C@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2cc(F)ccc2F)c1 ZINC000491002096 904361953 /nfs/dbraw/zinc/36/19/53/904361953.db2.gz BAMVANJJBQHOOC-QHCPKHFHSA-N 2 0 419.585 4.393 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 ZINC000491019795 904371723 /nfs/dbraw/zinc/37/17/23/904371723.db2.gz LRDYMCWAJLXKEY-MBSDFSHPSA-N 2 0 403.973 4.432 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H](O)CO[C@@H]2CCCc3ccccc32)CC1 ZINC000491029211 904380501 /nfs/dbraw/zinc/38/05/01/904380501.db2.gz QLWXEPMJSNFGON-XNMGPUDCSA-N 2 0 422.613 4.286 20 0 HIADRP OCC[NH+]1CCC(C[NH2+][C@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CC1 ZINC000491051550 904397926 /nfs/dbraw/zinc/39/79/26/904397926.db2.gz KDCRANBEAAQXRA-OAQYLSRUSA-N 2 0 424.919 4.325 20 0 HIADRP CCOc1ccc([C@H]([NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000491062832 904405054 /nfs/dbraw/zinc/40/50/54/904405054.db2.gz XKAZDEOCSLFSGO-DVECYGJZSA-N 2 0 416.009 4.301 20 0 HIADRP O=C(Nc1cccc(C[NH+]2CCCCC2)c1)c1ccc(C[NH+]2CCC(CO)CC2)cc1 ZINC000491444696 904600160 /nfs/dbraw/zinc/60/01/60/904600160.db2.gz MKDGBZKDBLOKGW-UHFFFAOYSA-N 2 0 421.585 4.129 20 0 HIADRP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000506157945 914827736 /nfs/dbraw/zinc/82/77/36/914827736.db2.gz LPRHUKUPELZAKN-NRFANRHFSA-N 2 0 418.651 4.183 20 0 HIADRP COc1ccc([C@@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)c2ccccc2Cl)cc1 ZINC000492255000 904824602 /nfs/dbraw/zinc/82/46/02/904824602.db2.gz XRYIUEGLCQWICK-WMZHIEFXSA-N 2 0 402.966 4.265 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C(=O)NCc2ccco2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492582771 904872851 /nfs/dbraw/zinc/87/28/51/904872851.db2.gz XREZRWALZCYAOU-GBXCKJPGSA-N 2 0 417.553 4.210 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+][C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000493078478 905011871 /nfs/dbraw/zinc/01/18/71/905011871.db2.gz JTRJJYXURYAIEZ-QFIPXVFZSA-N 2 0 416.407 4.154 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+][C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000493078477 905013267 /nfs/dbraw/zinc/01/32/67/905013267.db2.gz JTRJJYXURYAIEZ-JOCHJYFZSA-N 2 0 416.407 4.154 20 0 HIADRP Cc1ccc([C@H]([NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)c2ccccc2)cc1 ZINC000493206256 905051142 /nfs/dbraw/zinc/05/11/42/905051142.db2.gz PYRZOLACJGCPNE-RUZDIDTESA-N 2 0 407.602 4.301 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cc(Br)cs1 ZINC000493734924 905205408 /nfs/dbraw/zinc/20/54/08/905205408.db2.gz GSPIIGYSMKHOOR-OAHLLOKOSA-N 2 0 408.409 4.109 20 0 HIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)CC2 ZINC000493968089 905317187 /nfs/dbraw/zinc/31/71/87/905317187.db2.gz JCSSHRFVSZBICH-LJQANCHMSA-N 2 0 403.364 4.475 20 0 HIADRP COc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OCc1cccnc1 ZINC000512402240 921136683 /nfs/dbraw/zinc/13/66/83/921136683.db2.gz XSENEPZCMRBBLQ-KNQAVFIVSA-N 2 0 409.574 4.412 20 0 HIADRP c1ccc(CSCCC[NH+]2CCN([C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000512438529 921161695 /nfs/dbraw/zinc/16/16/95/921161695.db2.gz GNODNYAITVXGAZ-RUZDIDTESA-N 2 0 409.643 4.202 20 0 HIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)CC2 ZINC000494743769 905942761 /nfs/dbraw/zinc/94/27/61/905942761.db2.gz CQDRKIARRUAVBW-RTWAWAEBSA-N 2 0 415.375 4.101 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc2C1 ZINC000494945573 906116367 /nfs/dbraw/zinc/11/63/67/906116367.db2.gz ATHJIRBXYBANPZ-SEIBCYHCSA-N 2 0 405.586 4.370 20 0 HIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccc(C(=O)N(C)C)cc1 ZINC000495074759 906222156 /nfs/dbraw/zinc/22/21/56/906222156.db2.gz NMMAVUQFLYPMNN-OAQYLSRUSA-N 2 0 423.601 4.110 20 0 HIADRP CC[N@H+](CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)[C@@H](C)Cc1ccsc1 ZINC000495250753 906338391 /nfs/dbraw/zinc/33/83/91/906338391.db2.gz QWGQBVPOEIMMLQ-SFHVURJKSA-N 2 0 417.644 4.189 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc2ccccc2c1 ZINC000495466306 906468852 /nfs/dbraw/zinc/46/88/52/906468852.db2.gz XLYCPLWJNDYCMP-DFBJGRDBSA-N 2 0 401.554 4.388 20 0 HIADRP Cc1ccccc1[C@@H](OC[C@H](O)C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1ccccc1 ZINC000512582117 921249097 /nfs/dbraw/zinc/24/90/97/921249097.db2.gz LAPXAKURYMIOOX-DTCOUFMGSA-N 2 0 408.586 4.019 20 0 HIADRP C[C@H](c1ccncc1)N1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000512613305 921260967 /nfs/dbraw/zinc/26/09/67/921260967.db2.gz RNTCBOSOJSSRQO-GABCFMIKSA-N 2 0 418.629 4.497 20 0 HIADRP COc1ccc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1NC(C)=O ZINC000512618013 921263927 /nfs/dbraw/zinc/26/39/27/921263927.db2.gz HKHMVVLBPINYGS-RJGXRXQPSA-N 2 0 407.558 4.044 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)N1CCc2sccc2C1 ZINC000497275975 906827265 /nfs/dbraw/zinc/82/72/65/906827265.db2.gz MIRXPLFFCLAAAF-IBGZPJMESA-N 2 0 411.615 4.187 20 0 HIADRP CCC(CC)(CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[NH2+][C@H](C)c1ccccc1 ZINC000497445947 906921521 /nfs/dbraw/zinc/92/15/21/906921521.db2.gz VCHMJNNQNXYPGW-VMSMKEMKSA-N 2 0 400.611 4.163 20 0 HIADRP CC(C)Oc1ccc2ccccc2c1C[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000497511253 907001068 /nfs/dbraw/zinc/00/10/68/907001068.db2.gz SEJSVCYKFYAJGV-AIZNXBIQSA-N 2 0 407.602 4.370 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000497701507 907206729 /nfs/dbraw/zinc/20/67/29/907206729.db2.gz SPVACHQWDJZDRT-DEOSSOPVSA-N 2 0 412.622 4.223 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc(F)cn1 ZINC000497843486 907323613 /nfs/dbraw/zinc/32/36/13/907323613.db2.gz QYNFMUAPDDUWRG-XMMPIXPASA-N 2 0 415.553 4.197 20 0 HIADRP CCN(CC[NH+]1CCCCCC1)C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000498042424 907552615 /nfs/dbraw/zinc/55/26/15/907552615.db2.gz BGCLJNBFUMIXMJ-PZJWPPBQSA-N 2 0 406.640 4.039 20 0 HIADRP Cc1ccccc1[C@@H]([C@@H](C)NC(=O)NC1CC[NH+](C2CCCCC2)CC1)[NH+](C)C ZINC000498613837 908062383 /nfs/dbraw/zinc/06/23/83/908062383.db2.gz GWVITIOHRPIJSJ-AUSIDOKSSA-N 2 0 400.611 4.083 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1ccc(F)cn1 ZINC000498916516 908326959 /nfs/dbraw/zinc/32/69/59/908326959.db2.gz DJJTXIMULQLHKD-NRFANRHFSA-N 2 0 424.486 4.478 20 0 HIADRP COc1cc(OC)c(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(OC)c1 ZINC000499235792 908598897 /nfs/dbraw/zinc/59/88/97/908598897.db2.gz SBGQYHYTFWCBIP-MZADTFQBSA-N 2 0 410.558 4.040 20 0 HIADRP COc1cc(OC)cc(N2CC[C@@H]([NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499238028 908602172 /nfs/dbraw/zinc/60/21/72/908602172.db2.gz QGVUSXNWAJDLCQ-ODAXIHTASA-N 2 0 421.585 4.068 20 0 HIADRP COc1ccc(C[N@H+](CCCN2CC[NH+](C(C)C)CC2)C2CCCCC2)cc1OC ZINC000500098952 909578080 /nfs/dbraw/zinc/57/80/80/909578080.db2.gz OEHGOJDNLAGFQT-UHFFFAOYSA-N 2 0 417.638 4.255 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NCc1cccc(C[NH+]2CCCC2)c1)c1ccccc1 ZINC000500130852 909611589 /nfs/dbraw/zinc/61/15/89/909611589.db2.gz GOWBXTSSHUUXRT-XMMPIXPASA-N 2 0 408.590 4.165 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccc(OC)cc2)cc1)C1CC1 ZINC000500391076 909830194 /nfs/dbraw/zinc/83/01/94/909830194.db2.gz SPEVXGJXWVFFQG-VWLOTQADSA-N 2 0 421.585 4.246 20 0 HIADRP C[C@H](C(=O)Nc1cccc2ccccc21)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501022794 910241431 /nfs/dbraw/zinc/24/14/31/910241431.db2.gz JCPWDSJVGBVLRE-LJQANCHMSA-N 2 0 402.542 4.410 20 0 HIADRP C[C@@H](NC(=O)[C@@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1cc2ccccc2o1 ZINC000501024852 910242485 /nfs/dbraw/zinc/24/24/85/910242485.db2.gz OBXIDQJJSAGRHR-RTBURBONSA-N 2 0 420.557 4.242 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1ccsc1 ZINC000501124697 910306349 /nfs/dbraw/zinc/30/63/49/910306349.db2.gz GGUXPDIHFHQAPF-VXKWHMMOSA-N 2 0 414.619 4.267 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1)c1ccsc1 ZINC000501177246 910344253 /nfs/dbraw/zinc/34/42/53/910344253.db2.gz VSOHRQHUNIXCOS-RTBURBONSA-N 2 0 420.648 4.329 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+]CC(c3ccc(F)cc3)c3ccc(F)cc3)ccn2)CC1 ZINC000501405066 910535641 /nfs/dbraw/zinc/53/56/41/910535641.db2.gz IMAMVTJDJORCGV-UHFFFAOYSA-N 2 0 422.523 4.033 20 0 HIADRP C[NH+](C)CCCC1CC[NH+](CCC(=O)N[C@H](c2cccs2)c2ccccc2)CC1 ZINC000501773210 910827896 /nfs/dbraw/zinc/82/78/96/910827896.db2.gz HINAOHQQSOUCFL-DEOSSOPVSA-N 2 0 413.631 4.398 20 0 HIADRP CC[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1cc(F)cc(Br)c1 ZINC000501946474 910932631 /nfs/dbraw/zinc/93/26/31/910932631.db2.gz LUMNBIRVPQYLBF-IBGZPJMESA-N 2 0 400.380 4.045 20 0 HIADRP CCC[NH+]1CCC(NC(=O)NCc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000502119081 911047230 /nfs/dbraw/zinc/04/72/30/911047230.db2.gz HGRLIOUJRYKOKW-UHFFFAOYSA-N 2 0 400.611 4.125 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000502600253 911605950 /nfs/dbraw/zinc/60/59/50/911605950.db2.gz MIZLDGQVIBRMEK-UHFFFAOYSA-N 2 0 414.638 4.369 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCC1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000502646474 911683042 /nfs/dbraw/zinc/68/30/42/911683042.db2.gz CAZIITNQVDXRDD-UHFFFAOYSA-N 2 0 412.622 4.080 20 0 HIADRP CCC[NH+]1CCC(CNC(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)CC1 ZINC000502813055 911829526 /nfs/dbraw/zinc/82/95/26/911829526.db2.gz NDNXCVRZYCHASN-FQEVSTJZSA-N 2 0 400.611 4.071 20 0 HIADRP CN(c1ccccc1C[NH+]1CCC(c2nc3ccccc3[nH]2)CC1)C1CC[NH+](C)CC1 ZINC000506624080 915286176 /nfs/dbraw/zinc/28/61/76/915286176.db2.gz MYLKUMLDHVKUNJ-UHFFFAOYSA-N 2 0 417.601 4.473 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000506920287 915720328 /nfs/dbraw/zinc/72/03/28/915720328.db2.gz ZVJQQMWYEINFCF-YPAWHYETSA-N 2 0 416.610 4.103 20 0 HIADRP c1sc(CC[NH2+][C@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)nc1-c1ccncc1 ZINC000507464743 916233854 /nfs/dbraw/zinc/23/38/54/916233854.db2.gz YNVVLMYTDQNQLB-BDTNDASRSA-N 2 0 404.583 4.248 20 0 HIADRP Clc1cccc(-c2n[nH]cc2C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)c1 ZINC000507722612 916515810 /nfs/dbraw/zinc/51/58/10/916515810.db2.gz JZBOFDHZAPPLBO-UHFFFAOYSA-N 2 0 402.970 4.055 20 0 HIADRP COc1cccc([C@@H]2[C@H]([NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CCN2C2CC2)c1 ZINC000508696301 917456774 /nfs/dbraw/zinc/45/67/74/917456774.db2.gz JLBLCDKXWHZDNR-RECWDRPOSA-N 2 0 419.613 4.473 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703062 917464536 /nfs/dbraw/zinc/46/45/36/917464536.db2.gz XHQDFFLKBJVNGK-OFVILXPXSA-N 2 0 405.586 4.313 20 0 HIADRP Cc1ccccc1[C@H]([C@@H](C)NC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000508882005 917636774 /nfs/dbraw/zinc/63/67/74/917636774.db2.gz OWJGWFGTGLNGHW-VTZPFEBOSA-N 2 0 422.617 4.150 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@H](C)[C@H](c1ccccc1C)[NH+](C)C ZINC000508915796 917671937 /nfs/dbraw/zinc/67/19/37/917671937.db2.gz GKQOPWIKINKVSO-HYBUGGRVSA-N 2 0 410.606 4.280 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N1CCC(CC[NH+](C)C)CC1)c1ccc(Cl)cc1 ZINC000509028468 917783635 /nfs/dbraw/zinc/78/36/35/917783635.db2.gz BEEYATNZFVOEAG-OAQYLSRUSA-N 2 0 409.018 4.096 20 0 HIADRP C[C@@H]1C[C@H](CCNC(=O)NCCCC[NH+]2CCC(C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000509772528 918385176 /nfs/dbraw/zinc/38/51/76/918385176.db2.gz AXOSESZQIJHHGR-VWNXMTODSA-N 2 0 414.638 4.098 20 0 HIADRP COc1cccc([C@H](CNC(=O)c2oc3ccccc3c2C[NH+](C)C)[NH+]2CCCC2)c1 ZINC000510332540 918837742 /nfs/dbraw/zinc/83/77/42/918837742.db2.gz KASPUZGKYLLCAF-QFIPXVFZSA-N 2 0 421.541 4.070 20 0 HIADRP CN(c1ccccc1C[NH+]1CCC(OCCc2ccccc2)CC1)C1CC[NH+](C)CC1 ZINC000510368691 918857241 /nfs/dbraw/zinc/85/72/41/918857241.db2.gz FGMFIGNANXBDAK-UHFFFAOYSA-N 2 0 421.629 4.441 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+]([C@H]2CCCc3ccc(F)cc32)CC1)Cc1ccccc1 ZINC000510374247 918859481 /nfs/dbraw/zinc/85/94/81/918859481.db2.gz HJYSESKPRFUHTO-VWLOTQADSA-N 2 0 423.576 4.163 20 0 HIADRP C[C@H]1C[C@@H](CCNC(=O)Nc2cccc(OCC[NH+](C)C)c2)C[N@@H+]1Cc1ccccc1 ZINC000510658545 919098707 /nfs/dbraw/zinc/09/87/07/919098707.db2.gz UNKHRDQJDCYPLV-RBBKRZOGSA-N 2 0 424.589 4.049 20 0 HIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000510952597 919486980 /nfs/dbraw/zinc/48/69/80/919486980.db2.gz RSNDLWSWRMSDPB-VGOFRKELSA-N 2 0 406.492 4.383 20 0 HIADRP O=C(Nc1ccccc1)N1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000511030418 919608400 /nfs/dbraw/zinc/60/84/00/919608400.db2.gz LGYAWUNXQBXKNG-NEWJYFPISA-N 2 0 404.558 4.078 20 0 HIADRP CC(C)Sc1ccc(C[NH+]2CCC(C(=O)NCCC[NH+]3CCCCC3)CC2)cc1 ZINC000511160920 919782360 /nfs/dbraw/zinc/78/23/60/919782360.db2.gz LDFLGHMUWXNUKQ-UHFFFAOYSA-N 2 0 417.663 4.391 20 0 HIADRP C[C@H](NC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000511399472 920012407 /nfs/dbraw/zinc/01/24/07/920012407.db2.gz JJZCRIWXSMXYNG-DMANZJGFSA-N 2 0 424.633 4.134 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)N[C@H]2CC[NH+](Cc3ccccc3)CC2(C)C)C1 ZINC000512137932 920883973 /nfs/dbraw/zinc/88/39/73/920883973.db2.gz JPNYTCVVNFELKW-GGAORHGYSA-N 2 0 414.638 4.098 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000512199805 920944801 /nfs/dbraw/zinc/94/48/01/920944801.db2.gz DOSINKSQXKZCIK-PKTZIBPZSA-N 2 0 412.666 4.303 20 0 HIADRP COc1ccc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c(OC)c1OC ZINC000512287611 921042762 /nfs/dbraw/zinc/04/27/62/921042762.db2.gz IYXZJXLGPDMLLX-DNVJHFABSA-N 2 0 424.585 4.145 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512318877 921070127 /nfs/dbraw/zinc/07/01/27/921070127.db2.gz UHFIJCIBLIXRMX-HBFSDRIKSA-N 2 0 406.014 4.320 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512337857 921083390 /nfs/dbraw/zinc/08/33/90/921083390.db2.gz UZRCHEVCKTXFCG-GPQLQYNLSA-N 2 0 423.601 4.227 20 0 HIADRP Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513495271 921845235 /nfs/dbraw/zinc/84/52/35/921845235.db2.gz NMTZSMCJFWAREQ-LPHOPBHVSA-N 2 0 424.511 4.060 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCc3c2c(F)ccc3F)cc1OC ZINC000513531061 921872933 /nfs/dbraw/zinc/87/29/33/921872933.db2.gz DQTSDPBKBMNVIY-FQEVSTJZSA-N 2 0 404.501 4.471 20 0 HIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)c(C)c1 ZINC000513589559 921921904 /nfs/dbraw/zinc/92/19/04/921921904.db2.gz XKXJTSOWLXXCTP-BHDDXSALSA-N 2 0 423.601 4.420 20 0 HIADRP c1ncn(Cc2ccc(C[NH2+][C@H]3CCCC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)cc2)n1 ZINC000513761154 922079778 /nfs/dbraw/zinc/07/97/78/922079778.db2.gz MJGRREQINJRLCO-NXCFDTQHSA-N 2 0 415.585 4.107 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC4(CCCCC4)Oc4ccccc43)cn2)CC1 ZINC000513788424 922114168 /nfs/dbraw/zinc/11/41/68/922114168.db2.gz QQRPJYXHRDMLRU-JOCHJYFZSA-N 2 0 406.574 4.150 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H]3CC4(CCCCC4)Oc4ccccc43)ccn2)CC1 ZINC000513787948 922115060 /nfs/dbraw/zinc/11/50/60/922115060.db2.gz HZGGGAWGAJDMDD-JOCHJYFZSA-N 2 0 406.574 4.150 20 0 HIADRP CC(C)[C@H](CNC(=O)NCC1CC[NH+](Cc2cccs2)CC1)[NH+]1CCC(C)CC1 ZINC000514220827 922554897 /nfs/dbraw/zinc/55/48/97/922554897.db2.gz BZJGWUOLWKLOPD-QFIPXVFZSA-N 2 0 420.667 4.016 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(=O)NCCc1ccc(F)cc1 ZINC000515518114 923148649 /nfs/dbraw/zinc/14/86/49/923148649.db2.gz QLVCCTUHATWMHQ-PMACEKPBSA-N 2 0 411.565 4.037 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(=O)Nc1ccc(F)cc1F ZINC000515756202 923329063 /nfs/dbraw/zinc/32/90/63/923329063.db2.gz QPBTZOIEFPYKOP-DLBZAZTESA-N 2 0 401.501 4.314 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)c2ccccc2)CC1 ZINC000516155409 923579465 /nfs/dbraw/zinc/57/94/65/923579465.db2.gz CGMWWPZHFFEMBV-QFIPXVFZSA-N 2 0 400.611 4.022 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2CC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000516790938 923888831 /nfs/dbraw/zinc/88/88/31/923888831.db2.gz WMLGIKUCAIHMBU-YFNKSVMNSA-N 2 0 400.513 4.280 20 0 HIADRP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)C1 ZINC000517111547 924004141 /nfs/dbraw/zinc/00/41/41/924004141.db2.gz AWZMBRAUJGRWJF-NRFANRHFSA-N 2 0 414.638 4.371 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)cc1 ZINC000517422413 924172393 /nfs/dbraw/zinc/17/23/93/924172393.db2.gz UXWSGLHVORPSOC-XUZZJYLKSA-N 2 0 412.622 4.221 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+]Cc2ccc(OCc3c(F)cccc3Cl)cc2)CC1 ZINC000517535567 924251048 /nfs/dbraw/zinc/25/10/48/924251048.db2.gz IVSBFJXBKDLYFM-UHFFFAOYSA-N 2 0 419.972 4.175 20 0 HIADRP CN1CC[NH+](CCCC[NH2+]Cc2ccc(OCc3c(F)cccc3Cl)cc2)CC1 ZINC000517535306 924251181 /nfs/dbraw/zinc/25/11/81/924251181.db2.gz CIUUTNVZULGGGO-UHFFFAOYSA-N 2 0 419.972 4.175 20 0 HIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(OCc3ccccc3)c(Br)c2)C1 ZINC000518285713 927142954 /nfs/dbraw/zinc/14/29/54/927142954.db2.gz UMPGPXOZJHBNPE-LJQANCHMSA-N 2 0 403.364 4.460 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000518629022 927389105 /nfs/dbraw/zinc/38/91/05/927389105.db2.gz YEQNYRIDASVSNS-ZJSXRUAMSA-N 2 0 412.622 4.078 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2csc(-c3ccc(F)cc3)n2)[C@@H](c2ccccc2)C1 ZINC000518768127 927483634 /nfs/dbraw/zinc/48/36/34/927483634.db2.gz IPGLZKYWDGREAW-HSZRJFAPSA-N 2 0 424.589 4.418 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CC[C@]2(C1)CCc1ccccc1O2)C1CC[NH+](C)CC1 ZINC000518848647 927552030 /nfs/dbraw/zinc/55/20/30/927552030.db2.gz RVBYFMBXODGLFU-SANMLTNESA-N 2 0 405.586 4.187 20 0 HIADRP COc1ccccc1NC(=O)C[C@H](C)[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000519674983 928047412 /nfs/dbraw/zinc/04/74/12/928047412.db2.gz VDXMWCXPKXIWOG-UNMCSNQZSA-N 2 0 409.574 4.304 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NC[C@@H](c2ccc(C)cc2)[NH+]2CCCC2)CC1 ZINC000519935956 928170311 /nfs/dbraw/zinc/17/03/11/928170311.db2.gz VCYIWNHYCXFDIT-DEOSSOPVSA-N 2 0 414.638 4.285 20 0 HIADRP C[NH+](C)CCN(Cc1ccccc1)C(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000520209576 928389449 /nfs/dbraw/zinc/38/94/49/928389449.db2.gz HDQTWWGJLQSWCF-UHFFFAOYSA-N 2 0 422.617 4.336 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)N2CCC[N@@H+](C(C)(C)C)CC2)C1 ZINC000520215386 928393467 /nfs/dbraw/zinc/39/34/67/928393467.db2.gz KUYLZZJUXDZIHA-NHCUHLMSSA-N 2 0 414.638 4.180 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)CC1 ZINC000521062534 928969310 /nfs/dbraw/zinc/96/93/10/928969310.db2.gz NFRKOONGAHZVSO-UHFFFAOYSA-N 2 0 400.611 4.301 20 0 HIADRP O=C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccc(C[NH+]2CCCC2)c1 ZINC000521129652 929013436 /nfs/dbraw/zinc/01/34/36/929013436.db2.gz HKTSWOQFCKBJJE-QILAJZQNSA-N 2 0 403.570 4.208 20 0 HIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccc(OC)cc2)C1 ZINC000521813519 929469668 /nfs/dbraw/zinc/46/96/68/929469668.db2.gz WZJWPDCBRUFATR-QFIPXVFZSA-N 2 0 418.585 4.429 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)[NH+]2CCCC2)o1 ZINC000524884770 929871896 /nfs/dbraw/zinc/87/18/96/929871896.db2.gz SUQFRUMTKNWEDH-NFBKMPQASA-N 2 0 424.589 4.031 20 0 HIADRP C[C@H](NC(=O)N(CC[NH+](C)C)CC[NH+](C)C)c1ccccc1-c1ccc(Cl)cc1 ZINC000524922212 929890952 /nfs/dbraw/zinc/89/09/52/929890952.db2.gz YLDIQOVEERGMSU-SFHVURJKSA-N 2 0 416.997 4.203 20 0 HIADRP C[C@H]1C[N@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC[C@H]1c1ccccc1 ZINC000525122901 930049144 /nfs/dbraw/zinc/04/91/44/930049144.db2.gz PYGUGZDEVDALCA-SQJMNOBHSA-N 2 0 405.586 4.024 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000525402060 930220766 /nfs/dbraw/zinc/22/07/66/930220766.db2.gz SJZNFFXHVQCUID-QFIPXVFZSA-N 2 0 422.617 4.334 20 0 HIADRP O=C(NCC1CC[NH+](Cc2cccs2)CC1)[C@@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000525484133 930273422 /nfs/dbraw/zinc/27/34/22/930273422.db2.gz UAZCOPCBDFJFRW-QHCPKHFHSA-N 2 0 411.615 4.131 20 0 HIADRP Cc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(-n2cc(Cl)cn2)n1 ZINC000526049883 930515184 /nfs/dbraw/zinc/51/51/84/930515184.db2.gz DFGLQGTVUQLGIB-NQIIRXRSSA-N 2 0 409.965 4.229 20 0 HIADRP C[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000527223046 930615762 /nfs/dbraw/zinc/61/57/62/930615762.db2.gz LJDIQXPHQPLGOC-GSEOLPGOSA-N 2 0 404.023 4.472 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)CC1 ZINC000530727709 930809358 /nfs/dbraw/zinc/80/93/58/930809358.db2.gz KTUCRHKTOFUQGO-HXUWFJFHSA-N 2 0 420.601 4.155 20 0 HIADRP O=C([C@H]1CCCC[N@@H+]1Cc1ccccc1)N1CCC([NH+]2CCc3ccccc3C2)CC1 ZINC000530816021 930830587 /nfs/dbraw/zinc/83/05/87/930830587.db2.gz PYFQPWNVEUTMOY-AREMUKBSSA-N 2 0 417.597 4.090 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)C[C@@H]1C ZINC000530902273 930854558 /nfs/dbraw/zinc/85/45/58/930854558.db2.gz QTIRHFHPQLYBHA-KYFHRZRWSA-N 2 0 410.602 4.267 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)CC(=O)Nc2ccccc2)CC1 ZINC000530906670 930854922 /nfs/dbraw/zinc/85/49/22/930854922.db2.gz ZCQPGTUOAICIFT-RBUKOAKNSA-N 2 0 412.553 4.036 20 0 HIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3ccc(OCc4ccccn4)cc3)CC2)C[C@H](C)O1 ZINC000530939604 930862863 /nfs/dbraw/zinc/86/28/63/930862863.db2.gz CYJLJWYFZLPEGW-SZPZYZBQSA-N 2 0 423.601 4.372 20 0 HIADRP Cc1ccc(C[NH+]2CCSCC2)cc1NC(=O)C1CCN(c2cc[nH+]cc2C)CC1 ZINC000531204253 930963647 /nfs/dbraw/zinc/96/36/47/930963647.db2.gz IEXWWIFJMQVCPS-UHFFFAOYSA-N 2 0 424.614 4.102 20 0 HIADRP CC[C@@H](C)NC(=O)c1cccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000531598061 931116597 /nfs/dbraw/zinc/11/65/97/931116597.db2.gz YHWBVCZJRAAPLA-HXUWFJFHSA-N 2 0 422.617 4.035 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000531691543 931156108 /nfs/dbraw/zinc/15/61/08/931156108.db2.gz DXFMSYZQJSLMIB-IRXDYDNUSA-N 2 0 410.400 4.268 20 0 HIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CC(=O)Nc2cc(Cl)ccc2OC)c1 ZINC000531702663 931164633 /nfs/dbraw/zinc/16/46/33/931164633.db2.gz MEFXTKPTEFQIJE-MRXNPFEDSA-N 2 0 403.954 4.307 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccccc1OC(F)(F)F)C1CC[NH+](C)CC1 ZINC000531850597 931220536 /nfs/dbraw/zinc/22/05/36/931220536.db2.gz NMLLLPRVLLEREL-UHFFFAOYSA-N 2 0 407.480 4.405 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000531936225 931253130 /nfs/dbraw/zinc/25/31/30/931253130.db2.gz YBRZRRDEQUQSKS-SJORKVTESA-N 2 0 410.400 4.268 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000531945066 931257984 /nfs/dbraw/zinc/25/79/84/931257984.db2.gz KEMUDLKPSBPSQH-HNNXBMFYSA-N 2 0 409.452 4.154 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1 ZINC000531959577 931265535 /nfs/dbraw/zinc/26/55/35/931265535.db2.gz KCOUTLCUCSJBJC-LJQANCHMSA-N 2 0 424.589 4.024 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@@H](c1ccccc1)N1CCCC1)C1CC[NH+](C)CC1 ZINC000532107518 931315350 /nfs/dbraw/zinc/31/53/50/931315350.db2.gz RKIXCWGPXGADMD-SANMLTNESA-N 2 0 406.618 4.144 20 0 HIADRP CC[C@H](C)C(=O)Nc1cccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000532107688 931315368 /nfs/dbraw/zinc/31/53/68/931315368.db2.gz FXHXVUQHAJJPOL-FQEVSTJZSA-N 2 0 422.617 4.491 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2cnc(C3CCC3)s2)c1)C1CCOCC1 ZINC000532123092 931321664 /nfs/dbraw/zinc/32/16/64/931321664.db2.gz VLXSEFHCQGHPKU-UHFFFAOYSA-N 2 0 415.603 4.190 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000532196138 931345297 /nfs/dbraw/zinc/34/52/97/931345297.db2.gz ZDDKAAUVPJJBER-OLZOCXBDSA-N 2 0 403.876 4.150 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@@H](C)c3ccc4c(c3)CCC(=O)N4)CC2)c1 ZINC000532200976 931347206 /nfs/dbraw/zinc/34/72/06/931347206.db2.gz ZDSJTSIGTYPRQO-NRFANRHFSA-N 2 0 420.601 4.133 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(OC)c(Br)c2)[C@H](C)C1 ZINC000532223230 931360736 /nfs/dbraw/zinc/36/07/36/931360736.db2.gz LSAMSZNWOGLLGC-MDZRGWNJSA-N 2 0 413.400 4.245 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000532269857 931378015 /nfs/dbraw/zinc/37/80/15/931378015.db2.gz FLIRNUHOSQAHNC-DHIUTWEWSA-N 2 0 402.485 4.225 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000532451393 931439522 /nfs/dbraw/zinc/43/95/22/931439522.db2.gz WSGGOWQCLYXWKP-HSZRJFAPSA-N 2 0 403.973 4.380 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000532451509 931439642 /nfs/dbraw/zinc/43/96/42/931439642.db2.gz ONHAYBABJKVKPN-HNNXBMFYSA-N 2 0 409.452 4.154 20 0 HIADRP CCC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1cccc(C(F)(F)F)c1 ZINC000532451735 931440743 /nfs/dbraw/zinc/44/07/43/931440743.db2.gz IVHHKSLTDGOGLT-HXUWFJFHSA-N 2 0 406.496 4.483 20 0 HIADRP COc1ccc([C@@H]2CCCCCN2C(=O)C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cc1 ZINC000532537918 931515472 /nfs/dbraw/zinc/51/54/72/931515472.db2.gz WLPIVJAPRNOAAM-DEOSSOPVSA-N 2 0 415.622 4.191 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000532550610 931519057 /nfs/dbraw/zinc/51/90/57/931519057.db2.gz UDFNBUSWKNVESQ-HNNXBMFYSA-N 2 0 413.484 4.299 20 0 HIADRP COc1ccc2cc(CN(C)C(=O)[C@H](C)N3CCC[C@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000532586092 931542989 /nfs/dbraw/zinc/54/29/89/931542989.db2.gz UDGBYEBMNUELKC-RDPSFJRHSA-N 2 0 423.601 4.146 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCC[C@H]2C[C@H](C)[NH+](Cc3ccccc3)C2)CC1 ZINC000532798983 931633609 /nfs/dbraw/zinc/63/36/09/931633609.db2.gz ARLYPOOFUFZKIR-URXFXBBRSA-N 2 0 414.638 4.049 20 0 HIADRP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2ccc(-c3cccc(F)c3)s2)C(C)C)CC1 ZINC000532926229 931698414 /nfs/dbraw/zinc/69/84/14/931698414.db2.gz ATNPJRFGMOBGJH-UHFFFAOYSA-N 2 0 417.594 4.365 20 0 HIADRP C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000532977952 931724091 /nfs/dbraw/zinc/72/40/91/931724091.db2.gz XXSDKFSZELPPDC-SIKLNZKXSA-N 2 0 409.599 4.052 20 0 HIADRP COc1ccc(NC(=O)CC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)cc1 ZINC000533025087 931743434 /nfs/dbraw/zinc/74/34/34/931743434.db2.gz YNSUHCFOXBHQHP-QPPBQGQZSA-N 2 0 407.558 4.010 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000533307268 931835025 /nfs/dbraw/zinc/83/50/25/931835025.db2.gz UFTRPHHBYKZSEC-HSZRJFAPSA-N 2 0 417.601 4.451 20 0 HIADRP Cc1ccc(C[N@H+](CC(=O)NC2CC[NH+](C3CC3)CC2)[C@@H]2CCc3ccccc32)cc1 ZINC000533350381 931845306 /nfs/dbraw/zinc/84/53/06/931845306.db2.gz HAFODGHYWUORFP-AREMUKBSSA-N 2 0 417.597 4.228 20 0 HIADRP CCC[NH+]1CCC(N(C)C(=O)NCC2(CC)CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000533609830 931923047 /nfs/dbraw/zinc/92/30/47/931923047.db2.gz DNZTUDUTYLVWDJ-UHFFFAOYSA-N 2 0 414.638 4.195 20 0 HIADRP CCSc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000533784978 932031526 /nfs/dbraw/zinc/03/15/26/932031526.db2.gz XZNKRKIRSNEWTR-AVRDEDQJSA-N 2 0 411.615 4.347 20 0 HIADRP c1nc([C@@H]2CCCO2)sc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000534467684 932488142 /nfs/dbraw/zinc/48/81/42/932488142.db2.gz MZHZINGDVRPXDE-QFIPXVFZSA-N 2 0 415.603 4.156 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000535176455 932992089 /nfs/dbraw/zinc/99/20/89/932992089.db2.gz ZTOFOPKIKALBRM-AGILITTLSA-N 2 0 414.638 4.125 20 0 HIADRP Clc1cc2c(c(Br)c1)CC[C@H]2NC1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000535509192 933202798 /nfs/dbraw/zinc/20/27/98/933202798.db2.gz VRSAXCFMVZZLHK-ORAYPTAESA-N 2 0 413.787 4.180 20 0 HIADRP C[NH+](C)CCOc1cccc(CN[C@@H]2CCc3c2c(Br)ccc3F)c1 ZINC000535509303 933203671 /nfs/dbraw/zinc/20/36/71/933203671.db2.gz RWGHWFMMDSGXHW-LJQANCHMSA-N 2 0 407.327 4.306 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000537293761 933700795 /nfs/dbraw/zinc/70/07/95/933700795.db2.gz FPCSJLVJGBZQHY-CVEARBPZSA-N 2 0 408.384 4.120 20 0 HIADRP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000537305272 933706368 /nfs/dbraw/zinc/70/63/68/933706368.db2.gz KUHSMMAWIGRJTN-GOSISDBHSA-N 2 0 407.558 4.446 20 0 HIADRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000537631459 938341303 /nfs/dbraw/zinc/34/13/03/938341303.db2.gz NZUNUUFWPPQUNG-UHFFFAOYSA-N 2 0 407.352 4.252 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H](O)CO[C@H]1CCCc2ccccc21 ZINC000537841889 938387114 /nfs/dbraw/zinc/38/71/14/938387114.db2.gz PIRCDXWRKMDDEF-RSXGOPAZSA-N 2 0 423.601 4.075 20 0 HIADRP CN(C(=O)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCCc2ccccc21 ZINC000537843464 938387631 /nfs/dbraw/zinc/38/76/31/938387631.db2.gz QWLUQLFTTASJNI-VWLOTQADSA-N 2 0 420.601 4.156 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)CC(=O)Nc2cccc(Br)c2)C1 ZINC000537950979 938429908 /nfs/dbraw/zinc/42/99/08/938429908.db2.gz UPTRXWFZKCMVJM-DLBZAZTESA-N 2 0 410.400 4.124 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCc3c2cc(Cl)cc3Br)CC1 ZINC000537956873 938432647 /nfs/dbraw/zinc/43/26/47/938432647.db2.gz JJNDEAGOZWCWFM-GBESFXJTSA-N 2 0 413.787 4.057 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(Cn3cnc4ccccc43)c2)[C@@H](C)C1 ZINC000537959286 938434471 /nfs/dbraw/zinc/43/44/71/938434471.db2.gz AKMRVRUJCNXVIY-URXFXBBRSA-N 2 0 420.601 4.311 20 0 HIADRP CCc1ccc([C@H](C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)N(C)C)cc1 ZINC000538268843 938579812 /nfs/dbraw/zinc/57/98/12/938579812.db2.gz OBBWBPAHTTYZCN-RPWUZVMVSA-N 2 0 407.602 4.430 20 0 HIADRP C[C@H](Nc1cccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000538589586 938656772 /nfs/dbraw/zinc/65/67/72/938656772.db2.gz MPMMNFABMIWQIL-HBMCJLEFSA-N 2 0 411.590 4.409 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ccc(F)c(C(F)(F)F)c3)CC2)CC1 ZINC000538724164 938692260 /nfs/dbraw/zinc/69/22/60/938692260.db2.gz WFYBXYFKUQDONW-UHFFFAOYSA-N 2 0 415.519 4.473 20 0 HIADRP CSc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000538942853 938742836 /nfs/dbraw/zinc/74/28/36/938742836.db2.gz HNIMMPROPMUDHG-GOSISDBHSA-N 2 0 412.603 4.369 20 0 HIADRP C[C@H](C(=O)Nc1cccc2ncccc21)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538947064 938744583 /nfs/dbraw/zinc/74/45/83/938744583.db2.gz RIFGHTQXYDHNHX-LJQANCHMSA-N 2 0 417.557 4.195 20 0 HIADRP Cc1sc2nc(C[N@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)nc(N)c2c1C ZINC000539000699 938765101 /nfs/dbraw/zinc/76/51/01/938765101.db2.gz ZDUUGJVEWJIVRL-UHFFFAOYSA-N 2 0 410.591 4.024 20 0 HIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1I ZINC000539038264 938777213 /nfs/dbraw/zinc/77/72/13/938777213.db2.gz TYXRJPUOVXMSRC-OAHLLOKOSA-N 2 0 421.326 4.253 20 0 HIADRP CC[C@H]([NH2+][C@@H](C)c1ccc(S(=O)(=O)NCCC[NH+](C)C)cc1)c1ccc(C)cc1 ZINC000539041147 938778345 /nfs/dbraw/zinc/77/83/45/938778345.db2.gz SOYDDGNNIJMYBA-CVDCTZTESA-N 2 0 417.619 4.027 20 0 HIADRP C[C@H]([NH2+][C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000539044066 938780205 /nfs/dbraw/zinc/78/02/05/938780205.db2.gz IKYILMVSHVQYDF-IRBZQWRBSA-N 2 0 403.517 4.001 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H]2CCc3c2cc(Br)cc3Cl)ccn1 ZINC000539046937 938782040 /nfs/dbraw/zinc/78/20/40/938782040.db2.gz KSDSWFQGZMNOGN-GOSISDBHSA-N 2 0 424.770 4.215 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc(-c2ccccc2)cc1 ZINC000539073841 938794957 /nfs/dbraw/zinc/79/49/57/938794957.db2.gz RPJSCXFRWUPKBN-HXUWFJFHSA-N 2 0 401.554 4.496 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc(-n2cccn2)cc1 ZINC000539091159 938801133 /nfs/dbraw/zinc/80/11/33/938801133.db2.gz SUYKIOBUFYPWBX-QFIPXVFZSA-N 2 0 403.574 4.125 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)C(C)(C)c1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000539254160 938827185 /nfs/dbraw/zinc/82/71/85/938827185.db2.gz NEUAAEZWILLRCF-RTWAWAEBSA-N 2 0 407.602 4.112 20 0 HIADRP COc1ccccc1N1CC[C@H](C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C1 ZINC000539362916 938848796 /nfs/dbraw/zinc/84/87/96/938848796.db2.gz JLBQNCLJULXSTB-IRLDBZIGSA-N 2 0 421.585 4.099 20 0 HIADRP Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000539545823 938877750 /nfs/dbraw/zinc/87/77/50/938877750.db2.gz ZLBDENREMUUTSD-UHFFFAOYSA-N 2 0 406.505 4.464 20 0 HIADRP Cc1c([C@H](C)Nc2ccc(N3CC[C@@H]([NH+](C)C)C3)cn2)cnn1-c1ccc(F)cc1 ZINC000539658516 938895504 /nfs/dbraw/zinc/89/55/04/938895504.db2.gz AVGKFTBYGSYUKU-HRAATJIYSA-N 2 0 408.525 4.028 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Cl)c1)Nc1ccc(N2CCC([NH+](C)C)CC2)cn1 ZINC000539689625 938901871 /nfs/dbraw/zinc/90/18/71/938901871.db2.gz OQVGIEDPQNTCQG-MRXNPFEDSA-N 2 0 415.969 4.095 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000540169025 939100587 /nfs/dbraw/zinc/10/05/87/939100587.db2.gz BOSLSHMJWVSYBO-QGZVFWFLSA-N 2 0 422.598 4.261 20 0 HIADRP C[C@@H](CCN[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000540494676 939274326 /nfs/dbraw/zinc/27/43/26/939274326.db2.gz HDQRYNJFISTBKU-URXFXBBRSA-N 2 0 407.602 4.475 20 0 HIADRP C[N@H+](CCC(=O)NC[C@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1)C1CCCCC1 ZINC000563663022 945243469 /nfs/dbraw/zinc/24/34/69/945243469.db2.gz HRAXJWONTSGJNU-VGSWGCGISA-N 2 0 409.977 4.243 20 0 HIADRP COc1cc(C[NH2+]CC2=CC[N@H+](C)CC2)ccc1OCCOc1ccccc1Cl ZINC000540644768 939328837 /nfs/dbraw/zinc/32/88/37/939328837.db2.gz SKCQSWJGAPFFKO-UHFFFAOYSA-N 2 0 416.949 4.158 20 0 HIADRP C[C@]1([NH2+]CC(=O)Nc2cccc(C[NH+]3CCSCC3)c2)CCCc2ccccc21 ZINC000540906954 939415087 /nfs/dbraw/zinc/41/50/87/939415087.db2.gz ISEDTHKTGOTTFE-DEOSSOPVSA-N 2 0 409.599 4.015 20 0 HIADRP CCOc1ccc([C@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000540908174 939415131 /nfs/dbraw/zinc/41/51/31/939415131.db2.gz DDSLQPHMCAUYSV-DEOSSOPVSA-N 2 0 416.009 4.445 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(SCC(F)F)cc1 ZINC000540987908 939425756 /nfs/dbraw/zinc/42/57/56/939425756.db2.gz BZEZNDKXFDCXGS-JXFKEZNVSA-N 2 0 406.542 4.461 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H](Cc3ccccn3)c3cccnc3)cc2)CC1 ZINC000563683568 945252175 /nfs/dbraw/zinc/25/21/75/945252175.db2.gz VEDLYZTVKLFOQK-RUZDIDTESA-N 2 0 402.542 4.023 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000541548816 939551583 /nfs/dbraw/zinc/55/15/83/939551583.db2.gz IEQPLUMKDCEZQT-PMACEKPBSA-N 2 0 410.558 4.464 20 0 HIADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000541661261 939593074 /nfs/dbraw/zinc/59/30/74/939593074.db2.gz SXCKVNPKYLWZRY-LJQANCHMSA-N 2 0 405.542 4.304 20 0 HIADRP CC[C@@H](c1ccc(Br)cc1)[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000541662976 939595061 /nfs/dbraw/zinc/59/50/61/939595061.db2.gz UALBAYSBUYIICB-FQEVSTJZSA-N 2 0 408.428 4.250 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3ccc(Br)cc32)C1 ZINC000541915105 939652789 /nfs/dbraw/zinc/65/27/89/939652789.db2.gz XYEKEPYSEHHFBS-RBBKRZOGSA-N 2 0 415.375 4.183 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N2CC[NH+](C)[C@H](C)[C@@H]2C)cc1)C[C@H]1CCCCO1 ZINC000542731623 939857692 /nfs/dbraw/zinc/85/76/92/939857692.db2.gz UICQRWMHLJCLSI-ZRCGQRJVSA-N 2 0 416.610 4.022 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000542847227 939862578 /nfs/dbraw/zinc/86/25/78/939862578.db2.gz OPYQYGZEHSIJQQ-UGKGYDQZSA-N 2 0 400.950 4.300 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc(Cl)ccc1OC(F)F ZINC000542850168 939863121 /nfs/dbraw/zinc/86/31/21/939863121.db2.gz UPOUJFNLGXDZNP-KDOFPFPSSA-N 2 0 410.892 4.359 20 0 HIADRP CCOc1ccc(Oc2cc(C[NH2+]Cc3cn(-c4cc[nH+]cc4)nc3C)ccn2)cc1 ZINC000543247363 940007378 /nfs/dbraw/zinc/00/73/78/940007378.db2.gz PBYCHEYSYPGNQB-UHFFFAOYSA-N 2 0 415.497 4.452 20 0 HIADRP CC[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccn(C)n1 ZINC000543603605 940127641 /nfs/dbraw/zinc/12/76/41/940127641.db2.gz JEEIAUFXDUZGKH-HXUWFJFHSA-N 2 0 423.527 4.082 20 0 HIADRP CC[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccn(C)n1 ZINC000543603596 940127790 /nfs/dbraw/zinc/12/77/90/940127790.db2.gz JEEIAUFXDUZGKH-FQEVSTJZSA-N 2 0 423.527 4.082 20 0 HIADRP COc1ccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccccc2)cc1 ZINC000543772702 940181075 /nfs/dbraw/zinc/18/10/75/940181075.db2.gz BKTIIPZZOZNJHZ-AZGAKELHSA-N 2 0 402.538 4.141 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cnn1-c1cccc(Cl)c1 ZINC000543775818 940182236 /nfs/dbraw/zinc/18/22/36/940182236.db2.gz KXPHAGMTVUESGS-GAJHUEQPSA-N 2 0 424.976 4.252 20 0 HIADRP CC[N@@H+]1CCCN(C(=O)Nc2ccc(C[NH+](C[C@@H]3CCCCO3)C(C)C)cc2)CC1 ZINC000543818801 940196720 /nfs/dbraw/zinc/19/67/20/940196720.db2.gz LQZWLODUGMTGOQ-QHCPKHFHSA-N 2 0 416.610 4.026 20 0 HIADRP COC(=O)c1ccc(-c2nc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)co2)cc1 ZINC000543897423 940231924 /nfs/dbraw/zinc/23/19/24/940231924.db2.gz FNGSKPAYFJXCJB-UHFFFAOYSA-N 2 0 411.546 4.216 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000544001839 940293160 /nfs/dbraw/zinc/29/31/60/940293160.db2.gz DYTCEUCGXIEFSO-CQSZACIVSA-N 2 0 407.917 4.056 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000544349303 940396961 /nfs/dbraw/zinc/39/69/61/940396961.db2.gz XGBWVCGQRRJEDQ-UHFFFAOYSA-N 2 0 404.493 4.170 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000544357685 940399642 /nfs/dbraw/zinc/39/96/42/940399642.db2.gz WUSHMHCNFZEEFF-UKILVPOCSA-N 2 0 407.533 4.290 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000544359818 940400977 /nfs/dbraw/zinc/40/09/77/940400977.db2.gz DQDOESBTAKCQOG-VWLOTQADSA-N 2 0 406.549 4.081 20 0 HIADRP Cc1ccc(S(=O)(=O)C[C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000544604863 940489152 /nfs/dbraw/zinc/48/91/52/940489152.db2.gz JQVFPWJEMWEQFM-XJUOHMSHSA-N 2 0 414.615 4.048 20 0 HIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+][C@H]2CCO[C@H](c3ccc(F)cc3)C2)CC1 ZINC000544623473 940492467 /nfs/dbraw/zinc/49/24/67/940492467.db2.gz CPRAANKIKLIPGZ-CVDCTZTESA-N 2 0 417.956 4.241 20 0 HIADRP CC[NH+](CC)C[C@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000563977637 945334071 /nfs/dbraw/zinc/33/40/71/945334071.db2.gz FFBIYQYNOVTPAF-NGMPGZOMSA-N 2 0 421.029 4.283 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000546869827 940898411 /nfs/dbraw/zinc/89/84/11/940898411.db2.gz NCBPSIORRAWBQP-QHCPKHFHSA-N 2 0 400.998 4.026 20 0 HIADRP C[NH+](C)CCOc1ccc(-c2noc([C@@H]3CCC[N@H+](Cc4ccccc4)C3)n2)cc1 ZINC000546993767 940947094 /nfs/dbraw/zinc/94/70/94/940947094.db2.gz DKQSSPVNPMLWBZ-OAQYLSRUSA-N 2 0 406.530 4.057 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547827979 941077302 /nfs/dbraw/zinc/07/73/02/941077302.db2.gz VSSPQUKBCVZYRV-YKSBVNFPSA-N 2 0 414.553 4.334 20 0 HIADRP Cc1nc(CN2CCC(C[NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)oc1C ZINC000548155254 941089305 /nfs/dbraw/zinc/08/93/05/941089305.db2.gz APZGYDWHALYKNK-GBXCKJPGSA-N 2 0 410.606 4.004 20 0 HIADRP C[NH+](C)CCCC1CCN(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000549203951 941170850 /nfs/dbraw/zinc/17/08/50/941170850.db2.gz DNRNRXBKWQDSGU-QHCPKHFHSA-N 2 0 414.638 4.051 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+]Cc3ccnc4ccccc34)C3(C2)CCOCC3)cc1 ZINC000549867963 941221362 /nfs/dbraw/zinc/22/13/62/941221362.db2.gz KLSAZCUNTACDEY-QHCPKHFHSA-N 2 0 401.554 4.253 20 0 HIADRP CCOc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1OC ZINC000549884108 941226784 /nfs/dbraw/zinc/22/67/84/941226784.db2.gz WBUMVWIRFZTKTM-HSZRJFAPSA-N 2 0 424.585 4.112 20 0 HIADRP Fc1ccc(/C=C\C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1F ZINC000550271172 941306581 /nfs/dbraw/zinc/30/65/81/941306581.db2.gz JQJSJLBQBRSWGT-VWTGBZJHSA-N 2 0 412.524 4.496 20 0 HIADRP Fc1ccc(/C=C/C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1F ZINC000550271171 941306663 /nfs/dbraw/zinc/30/66/63/941306663.db2.gz JQJSJLBQBRSWGT-SNXGKTBFSA-N 2 0 412.524 4.496 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1OC ZINC000550881855 941378363 /nfs/dbraw/zinc/37/83/63/941378363.db2.gz DVFXXDGWUBVTNB-OFNKIYASSA-N 2 0 424.585 4.283 20 0 HIADRP COc1ncc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1Cl ZINC000551530207 941496023 /nfs/dbraw/zinc/49/60/23/941496023.db2.gz OZEOGWWUDOGIOW-HUUCEWRRSA-N 2 0 406.933 4.046 20 0 HIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)cc1Cl ZINC000551534617 941497135 /nfs/dbraw/zinc/49/71/35/941497135.db2.gz XRIIZIIVIZYOSO-KRWDZBQOSA-N 2 0 424.029 4.405 20 0 HIADRP CCO[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C12CCOCC2 ZINC000552065706 941577893 /nfs/dbraw/zinc/57/78/93/941577893.db2.gz KMTIJZPSWXYEIL-VCDBXAJLSA-N 2 0 412.618 4.241 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)CC1 ZINC000552205138 941601861 /nfs/dbraw/zinc/60/18/61/941601861.db2.gz QVLNRHCUHDNJDD-AREMUKBSSA-N 2 0 423.576 4.346 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]CCC(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000552390951 941654449 /nfs/dbraw/zinc/65/44/49/941654449.db2.gz RKNCJBFHHBZUOW-UHFFFAOYSA-N 2 0 404.301 4.001 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000553898524 941994267 /nfs/dbraw/zinc/99/42/67/941994267.db2.gz QNSVVTQYORIJDA-VWLOTQADSA-N 2 0 420.601 4.194 20 0 HIADRP CC[NH+](CC)Cc1ccc(-c2nc(-c3ccc(CN4CCOCC4)cc3)no2)cc1 ZINC000554102648 942036434 /nfs/dbraw/zinc/03/64/34/942036434.db2.gz DESBPIXYBKFVEX-UHFFFAOYSA-N 2 0 406.530 4.078 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1c(Cl)cccc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554537824 942165351 /nfs/dbraw/zinc/16/53/51/942165351.db2.gz QEKQCYMCAGZHRB-QXAKKESOSA-N 2 0 423.384 4.233 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@@H](c2ccc(SC)cc2)[NH+](C)C)cc1)C1CC1 ZINC000554706901 942206481 /nfs/dbraw/zinc/20/64/81/942206481.db2.gz XCJIJXYBLQSWMX-QHCPKHFHSA-N 2 0 411.615 4.426 20 0 HIADRP C[C@H]([NH2+]C1CCN(C(=O)CCc2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554858692 942294643 /nfs/dbraw/zinc/29/46/43/942294643.db2.gz UOPQYXCOCPCHLW-DHLKQENFSA-N 2 0 419.613 4.110 20 0 HIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000555000496 942350405 /nfs/dbraw/zinc/35/04/05/942350405.db2.gz YYLDQICHPDNFQU-VPUSJEBWSA-N 2 0 416.565 4.335 20 0 HIADRP C[C@@H]1C[N@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000555341342 942484355 /nfs/dbraw/zinc/48/43/55/942484355.db2.gz AFSXGMOAOLWJHI-KBMIEXCESA-N 2 0 413.556 4.055 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3conc3Cc3ccccc3)CC2)c1 ZINC000555523932 942625063 /nfs/dbraw/zinc/62/50/63/942625063.db2.gz KRBJEHIOMRNGIF-UHFFFAOYSA-N 2 0 418.585 4.266 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3cccc(Br)c3C2)[C@H](C)C1 ZINC000555545776 942636332 /nfs/dbraw/zinc/63/63/32/942636332.db2.gz CQKXDSHOIOMWAZ-MMOPVJDHSA-N 2 0 409.412 4.033 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccccc3N3CCO[C@H](C)C3)cc2)C1 ZINC000555908774 942771381 /nfs/dbraw/zinc/77/13/81/942771381.db2.gz OSDPKTSVJSNSBX-FGZHOGPDSA-N 2 0 407.602 4.433 20 0 HIADRP CN1CC[C@@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000556057914 942797980 /nfs/dbraw/zinc/79/79/80/942797980.db2.gz YMWNGEZPXVDLCB-RSXGOPAZSA-N 3 0 406.618 4.014 20 0 HIADRP COc1ccc2c(c1F)CC[C@H]2[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230705 942823183 /nfs/dbraw/zinc/82/31/83/942823183.db2.gz AGKPVHGSUWZUQT-NZQKXSOJSA-N 2 0 424.560 4.340 20 0 HIADRP Cc1cccc([C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C(=O)N(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000556317125 942839869 /nfs/dbraw/zinc/83/98/69/942839869.db2.gz MVUUTXNATKSWNZ-MYCYEZBNSA-N 2 0 419.613 4.152 20 0 HIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000556608093 942913081 /nfs/dbraw/zinc/91/30/81/942913081.db2.gz KQSAMAHKOOASSV-XUZZJYLKSA-N 3 0 407.602 4.302 20 0 HIADRP COC(=O)[C@H](C)Oc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000556882373 942949002 /nfs/dbraw/zinc/94/90/02/942949002.db2.gz FPBRRHDKZHVKAZ-NRFANRHFSA-N 2 0 422.569 4.115 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000558918874 943746481 /nfs/dbraw/zinc/74/64/81/943746481.db2.gz IEQXYSQAQZSGHB-OAQYLSRUSA-N 2 0 408.428 4.224 20 0 HIADRP CCN(CC)C(=O)C[C@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000558967342 943774355 /nfs/dbraw/zinc/77/43/55/943774355.db2.gz JABPOKFHEWITNM-MYCAQQRTSA-N 2 0 406.014 4.491 20 0 HIADRP CCc1cc(OC)ccc1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000559331902 943897848 /nfs/dbraw/zinc/89/78/48/943897848.db2.gz FBPULMBAWSQCMR-XMMPIXPASA-N 2 0 408.586 4.276 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(OC(F)F)c(F)c2)CC1 ZINC000559334442 943898316 /nfs/dbraw/zinc/89/83/16/943898316.db2.gz XKMFZWVPDVKTAI-UHFFFAOYSA-N 2 0 407.480 4.249 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C3(C2)CCOCC3)cc1 ZINC000559891096 944076700 /nfs/dbraw/zinc/07/67/00/944076700.db2.gz NMAWUJLREXRTMM-LOSJGSFVSA-N 2 0 405.586 4.441 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c(OC)c1 ZINC000559892167 944077814 /nfs/dbraw/zinc/07/78/14/944077814.db2.gz WOLOIPYKMNQNRP-IRLDBZIGSA-N 2 0 424.585 4.283 20 0 HIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1OC ZINC000560266023 944212189 /nfs/dbraw/zinc/21/21/89/944212189.db2.gz UOLZIXMJZNEPDP-OALUTQOASA-N 2 0 412.574 4.459 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C3CCN(c4ccc(F)cc4F)CC3)cc2)CC1 ZINC000560268418 944214235 /nfs/dbraw/zinc/21/42/35/944214235.db2.gz MXTZAZNYRYSHCX-UHFFFAOYSA-N 2 0 415.528 4.196 20 0 HIADRP CC(C)Cc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c1 ZINC000560530490 944244822 /nfs/dbraw/zinc/24/48/22/944244822.db2.gz PKRZKJQMCADKHY-NLFFAJNJSA-N 2 0 407.602 4.433 20 0 HIADRP C[C@@H]1CN(c2ccc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)cn2)C[C@H](C)O1 ZINC000560531956 944244913 /nfs/dbraw/zinc/24/49/13/944244913.db2.gz OQDFUIATYWWLSB-JUJAOGAQSA-N 2 0 422.617 4.228 20 0 HIADRP Cc1ccc([C@H]([NH2+]C2CCC([NH+](C)C)CC2)c2cccc(S(C)(=O)=O)c2)c(C)c1 ZINC000560543235 944249117 /nfs/dbraw/zinc/24/91/17/944249117.db2.gz BLNQFARLUUNQEQ-SLXFGWRHSA-N 2 0 414.615 4.259 20 0 HIADRP O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000560912292 944368369 /nfs/dbraw/zinc/36/83/69/944368369.db2.gz ZCIKEIIGWVGGSI-YADHBBJMSA-N 2 0 423.601 4.228 20 0 HIADRP CC(C)C[C@H]1C[N@H+](CCCc2ccccc2)CCN1C(=O)C1CC[NH+](C2CC2)CC1 ZINC000561545753 944666398 /nfs/dbraw/zinc/66/63/98/944666398.db2.gz DLWGKVMWORGXHJ-VWLOTQADSA-N 2 0 411.634 4.053 20 0 HIADRP CSc1ccccc1NC(=O)CC[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC000562061170 944917910 /nfs/dbraw/zinc/91/79/10/944917910.db2.gz GCANIDHZRKMRTD-RTWAWAEBSA-N 2 0 409.599 4.191 20 0 HIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000564419843 945572633 /nfs/dbraw/zinc/57/26/33/945572633.db2.gz RCMPKIKOWCAUJI-NXCFDTQHSA-N 2 0 408.586 4.337 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)C2CC[NH+](C3CC3)CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000565150722 945789365 /nfs/dbraw/zinc/78/93/65/945789365.db2.gz LBBDJZNHUPKIHS-NQIIRXRSSA-N 2 0 423.523 4.079 20 0 HIADRP FC(F)(F)CC1CC[NH+](CCOCC[NH+]2CCC(CC(F)(F)F)CC2)CC1 ZINC000565530492 945845258 /nfs/dbraw/zinc/84/52/58/945845258.db2.gz HZCXCNLQMZUUGL-UHFFFAOYSA-N 2 0 404.439 4.332 20 0 HIADRP CCOc1cc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc(Br)c1OC ZINC000569507817 946881568 /nfs/dbraw/zinc/88/15/68/946881568.db2.gz HQEJHHRJGKTRJP-QGZVFWFLSA-N 2 0 411.384 4.020 20 0 HIADRP CCC[N@H+](CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)Cc1ccc(F)cc1 ZINC000570186544 947126138 /nfs/dbraw/zinc/12/61/38/947126138.db2.gz OVKKGTJRDPZQPP-UHFFFAOYSA-N 2 0 411.565 4.127 20 0 HIADRP C[C@H]1C[N@H+](CC(Cc2ccccc2)Cc2ccccc2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000570559604 947298132 /nfs/dbraw/zinc/29/81/32/947298132.db2.gz IZCYHWLTJZPRIA-WNCULLNHSA-N 2 0 405.630 4.046 20 0 HIADRP O=C(CC[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)Nc1cccc(Br)c1 ZINC000570855670 947369686 /nfs/dbraw/zinc/36/96/86/947369686.db2.gz ULHLEPQJKDTDLV-UHFFFAOYSA-N 2 0 416.363 4.163 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](NC[C@H]2CCCC[NH+](Cc3ccccc3)C2)[C@@H](C)C1 ZINC000571573404 947707551 /nfs/dbraw/zinc/70/75/51/947707551.db2.gz QRZCYQVJRMADAI-CAOCKLPOSA-N 2 0 401.639 4.015 20 0 HIADRP C[NH+]1CCN(C[C@H]([NH2+][C@@H]2CCc3ccc(Br)cc32)c2ccccc2)CC1 ZINC000571890344 947807147 /nfs/dbraw/zinc/80/71/47/947807147.db2.gz POHRAEZEEJQDGX-YADHBBJMSA-N 2 0 414.391 4.015 20 0 HIADRP C[C@H](C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000572079801 947841168 /nfs/dbraw/zinc/84/11/68/947841168.db2.gz RMVCKSKNYALBFZ-XMSQKQJNSA-N 2 0 405.508 4.387 20 0 HIADRP C[C@@H](C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000572079800 947841489 /nfs/dbraw/zinc/84/14/89/947841489.db2.gz RMVCKSKNYALBFZ-PGRDOPGGSA-N 2 0 405.508 4.387 20 0 HIADRP CC[C@@H](C(=O)N[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000572969985 948049468 /nfs/dbraw/zinc/04/94/68/948049468.db2.gz WQRXTSKHTQFSNE-PKTZIBPZSA-N 2 0 421.585 4.001 20 0 HIADRP CC[NH+]1CCC(C[NH2+][C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000574110162 948366889 /nfs/dbraw/zinc/36/68/89/948366889.db2.gz KRGAJKQECHAGJP-QFIPXVFZSA-N 2 0 421.006 4.154 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@H](c1sccc1Br)C1CCCCC1 ZINC000574386742 948430109 /nfs/dbraw/zinc/43/01/09/948430109.db2.gz HCWDCFXZJDKZMW-YJBOKZPZSA-N 2 0 414.457 4.358 20 0 HIADRP COc1cc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc(OC)c1OCC(F)F ZINC000574481689 948454772 /nfs/dbraw/zinc/45/47/72/948454772.db2.gz ULGLUBRCWBEMPV-RDJZCZTQSA-N 2 0 412.521 4.090 20 0 HIADRP c1csc(-c2noc(CCC[N@@H+]3C[C@@H]4CC[NH+](Cc5ccccc5)C[C@@H]4C3)n2)c1 ZINC000575840376 948734120 /nfs/dbraw/zinc/73/41/20/948734120.db2.gz QRRNJNNXSAUQEJ-PMACEKPBSA-N 2 0 408.571 4.185 20 0 HIADRP c1cn(Cc2ccccc2)c2cc[nH+]c(N3CC[C@H]4[C@H]3CC[N@@H+]4Cc3cccnc3)c12 ZINC001164724724 720398535 /nfs/dbraw/zinc/39/85/35/720398535.db2.gz LFWAEJCPLJUOBT-LOSJGSFVSA-N 2 0 409.537 4.333 20 0 HIADRP CC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[NH+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1 ZINC001164910674 721564741 /nfs/dbraw/zinc/56/47/41/721564741.db2.gz XFIZAXFSKRLLSS-GMKZXUHWSA-N 2 0 424.564 4.110 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3CCC(Oc4ccc(F)cc4Cl)CC3)c2)CC1 ZINC001165033020 721880241 /nfs/dbraw/zinc/88/02/41/721880241.db2.gz KZDFDKMWDCCAQD-UHFFFAOYSA-N 2 0 419.928 4.395 20 0 HIADRP CC(C)CN1c2ccccc2[C@H]2CN(c3cc(OC4CC[NH+](C)CC4)cc[nH+]3)CC[C@@H]21 ZINC001165003998 722245522 /nfs/dbraw/zinc/24/55/22/722245522.db2.gz MEBSAVDKDAZUQX-NOZRDPDXSA-N 2 0 420.601 4.393 20 0 HIADRP O=C([C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1)N1CCCCC1 ZINC000436281192 861589798 /nfs/dbraw/zinc/58/97/98/861589798.db2.gz FXTZHIXROSYBIG-ZLOLNMDISA-N 2 0 409.618 4.058 20 0 HIADRP COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C[NH2+]CCC[NH+]2CCCC2)c1 ZINC000015186002 846016089 /nfs/dbraw/zinc/01/60/89/846016089.db2.gz BOQSWPAERIVYHU-UHFFFAOYSA-N 2 0 420.557 4.132 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)C(=O)Nc1cccc(Br)c1 ZINC000028898998 847473972 /nfs/dbraw/zinc/47/39/72/847473972.db2.gz OGMLEJIUMODBEB-INIZCTEOSA-N 2 0 418.379 4.408 20 0 HIADRP C[C@@H]1C[NH+](CCCNC(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)C[C@@H](C)O1 ZINC000043391171 848417424 /nfs/dbraw/zinc/41/74/24/848417424.db2.gz HZSOLCTYMWOJFM-WOJBJXKFSA-N 2 0 416.610 4.072 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)c1 ZINC000044293648 848540448 /nfs/dbraw/zinc/54/04/48/848540448.db2.gz XRERFZYLKHUZJI-OAQYLSRUSA-N 2 0 400.954 4.360 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc(N3CC[NH+](CC)CC3)cc2C)cc1 ZINC000046912052 848958061 /nfs/dbraw/zinc/95/80/61/848958061.db2.gz WTUOYLZTMJJNFI-UHFFFAOYSA-N 2 0 408.590 4.231 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NCc1ccccc1C[NH+]1CCCC1 ZINC000048215755 849192507 /nfs/dbraw/zinc/19/25/07/849192507.db2.gz XDEJZKHRJDOBPH-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP Cc1ccc(COc2ccc(C[NH2+]C3CCN(C4CC[NH+](C)CC4)CC3)cc2)cc1 ZINC000051189737 849442057 /nfs/dbraw/zinc/44/20/57/849442057.db2.gz SJFIPTKDXAGLOX-UHFFFAOYSA-N 2 0 407.602 4.222 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)cc1 ZINC000058467384 850832596 /nfs/dbraw/zinc/83/25/96/850832596.db2.gz DBCYUTXALOYYEK-NRFANRHFSA-N 2 0 414.619 4.226 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000059037900 850982452 /nfs/dbraw/zinc/98/24/52/850982452.db2.gz NBSOHNVDEWVBCW-OAQYLSRUSA-N 2 0 414.619 4.226 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1)c1ccccc1 ZINC000060566466 851149789 /nfs/dbraw/zinc/14/97/89/851149789.db2.gz VYHDNJRIJLHNPZ-DEOSSOPVSA-N 2 0 408.590 4.165 20 0 HIADRP CC[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Br)cc1Cl ZINC000437031139 862217524 /nfs/dbraw/zinc/21/75/24/862217524.db2.gz VUAWUQNHWPKQNG-KBXCAEBGSA-N 2 0 402.808 4.169 20 0 HIADRP C[N@H+](CCCNC(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1)C1CCCCC1 ZINC000061793443 851455397 /nfs/dbraw/zinc/45/53/97/851455397.db2.gz KWYSWCDTBYPKHE-UHFFFAOYSA-N 2 0 418.651 4.054 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NCc2ccc(C[NH+]3CCC[C@@H](C)C3)cc2)c1 ZINC000061860614 851461785 /nfs/dbraw/zinc/46/17/85/851461785.db2.gz WMABYIXAMJJJPX-OAQYLSRUSA-N 2 0 422.617 4.370 20 0 HIADRP Brc1cc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc2c1OCO2 ZINC000062426808 851550978 /nfs/dbraw/zinc/55/09/78/851550978.db2.gz SWXCSOXJSNZKMA-QGZVFWFLSA-N 2 0 417.347 4.180 20 0 HIADRP CCC(CC)[C@H](CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCCC1 ZINC000063151047 851623345 /nfs/dbraw/zinc/62/33/45/851623345.db2.gz PPZDMEDENIBBAA-QHCPKHFHSA-N 2 0 416.679 4.016 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)CC1 ZINC000071919666 852431411 /nfs/dbraw/zinc/43/14/11/852431411.db2.gz YTBFAAZOGCHDNC-RUZDIDTESA-N 2 0 420.601 4.096 20 0 HIADRP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N1CCC[N@H+](CC2CCCCC2)CC1 ZINC000108413403 852847938 /nfs/dbraw/zinc/84/79/38/852847938.db2.gz BNEVMNBFCHNBJS-NRFANRHFSA-N 2 0 418.651 4.183 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H](c2ccc(OC)cc2)[NH+]2CCCC2)cc1)C(C)C ZINC000110126792 853063991 /nfs/dbraw/zinc/06/39/91/853063991.db2.gz KSMLJLZUEDUFQR-RUZDIDTESA-N 2 0 423.601 4.492 20 0 HIADRP CCCC(=O)Nc1ccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1 ZINC000236755932 853919234 /nfs/dbraw/zinc/91/92/34/853919234.db2.gz XCHCNNWXADNCIX-UHFFFAOYSA-N 2 0 408.590 4.245 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1 ZINC000237166324 853975253 /nfs/dbraw/zinc/97/52/53/853975253.db2.gz PEIVNSUDHPBUIF-UHFFFAOYSA-N 2 0 418.029 4.074 20 0 HIADRP COc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCC2CC[NH+](C)CC2)cc1 ZINC000237402315 854024636 /nfs/dbraw/zinc/02/46/36/854024636.db2.gz DTODLDRYOUHQKE-UHFFFAOYSA-N 2 0 404.558 4.369 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1OC(F)F ZINC000237440595 854033306 /nfs/dbraw/zinc/03/33/06/854033306.db2.gz BBQBUJPHUMUTCE-IAGOWNOFSA-N 2 0 420.500 4.196 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)c(Cl)c1OC ZINC000237440327 854033694 /nfs/dbraw/zinc/03/36/94/854033694.db2.gz UZTGHOONSDUUBM-IAGOWNOFSA-N 2 0 418.965 4.256 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2cccc(Br)c2)C[C@H](C)O1 ZINC000237622875 854063658 /nfs/dbraw/zinc/06/36/58/854063658.db2.gz HALZADLTUNSYOB-CALCHBBNSA-N 2 0 403.364 4.348 20 0 HIADRP Cc1ccc(-c2ccc(C[NH2+]Cc3cccc(C[N@@H+]4CCC[C@@H](C(N)=O)C4)c3)o2)cc1 ZINC000237726949 854084755 /nfs/dbraw/zinc/08/47/55/854084755.db2.gz CBIYDZADSHFXCF-HSZRJFAPSA-N 2 0 417.553 4.242 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(OC[C@H]3CCCO3)cc2)C[C@H](C)O1 ZINC000237778025 854096016 /nfs/dbraw/zinc/09/60/16/854096016.db2.gz WLTDNLNDXIFNIK-YZIHRLCOSA-N 2 0 424.585 4.143 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]C3CCN(Cc4ccccc4)CC3)CC2)c1 ZINC000237855570 854108527 /nfs/dbraw/zinc/10/85/27/854108527.db2.gz OZNPTNWSNZJSSG-UHFFFAOYSA-N 2 0 420.645 4.151 20 0 HIADRP Cc1ncc(C[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)s1 ZINC000237854756 854108654 /nfs/dbraw/zinc/10/86/54/854108654.db2.gz FBMRZPHIMMRHAA-UHFFFAOYSA-N 2 0 412.525 4.162 20 0 HIADRP Cc1nc(C)c(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)s1 ZINC000237953779 854124497 /nfs/dbraw/zinc/12/44/97/854124497.db2.gz ZVFXNLBHGLNTQS-UHFFFAOYSA-N 2 0 406.599 4.372 20 0 HIADRP Cc1[nH+]c2ccc(Br)cc2c(NCCN2CCC([NH+](C)C)CC2)c1C ZINC000301544887 854418208 /nfs/dbraw/zinc/41/82/08/854418208.db2.gz PAZCDLXJXNRZCV-UHFFFAOYSA-N 2 0 405.384 4.052 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2CNc2ccnc3cc(Br)ccc32)C1 ZINC000302043528 854520438 /nfs/dbraw/zinc/52/04/38/854520438.db2.gz JFVLZAWXCXIYHB-GOSISDBHSA-N 2 0 412.331 4.176 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC[C@H](c2ccccc2)[NH+](C)C)c2cccs2)CC1 ZINC000302977702 854705499 /nfs/dbraw/zinc/70/54/99/854705499.db2.gz ULOOTUYBJVGXNJ-RTWAWAEBSA-N 2 0 414.619 4.123 20 0 HIADRP C[C@@H](NC(=O)[C@H](C)[NH+]1CCC(C[NH+]2CCCC2)CC1)c1ccc(Cl)cc1Cl ZINC000303054375 854740322 /nfs/dbraw/zinc/74/03/22/854740322.db2.gz JZKDGQSLSXUGIQ-CVEARBPZSA-N 2 0 412.405 4.367 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)c2cccs2)CC1 ZINC000303276777 854847819 /nfs/dbraw/zinc/84/78/19/854847819.db2.gz IYMZMMWHZFNCIU-LEWJYISDSA-N 2 0 418.651 4.181 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)N3CCC[C@H]3C[NH+]3CCCCC3)c2)CC1 ZINC000303291301 854854705 /nfs/dbraw/zinc/85/47/05/854854705.db2.gz OFLFDHBOSMQFDA-DEOSSOPVSA-N 2 0 412.622 4.078 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)CC(C)C ZINC000303452907 854952607 /nfs/dbraw/zinc/95/26/07/854952607.db2.gz JAWYSGFHDOWHMS-NHYNNZIHSA-N 2 0 414.638 4.238 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[NH+](C)C)cc1 ZINC000303500474 854989233 /nfs/dbraw/zinc/98/92/33/854989233.db2.gz UXCRNXRZCQORFZ-WQYPUDFKSA-N 2 0 420.601 4.093 20 0 HIADRP CC[NH+]1CCN(c2ccc(NC(=O)c3oc4ccccc4c3C[NH+](C)C)c(C)c2)CC1 ZINC000303541937 855027478 /nfs/dbraw/zinc/02/74/78/855027478.db2.gz JVICGXLDTCOXBM-UHFFFAOYSA-N 2 0 420.557 4.197 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)[NH+]2CCCC2)o1 ZINC000303623610 855083956 /nfs/dbraw/zinc/08/39/56/855083956.db2.gz DOUCMQVIJGALDX-NZQKXSOJSA-N 2 0 424.589 4.250 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000303804790 855209273 /nfs/dbraw/zinc/20/92/73/855209273.db2.gz XQLJXQRVRWACML-RCXJIHSJSA-N 2 0 419.613 4.410 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381779476 855431351 /nfs/dbraw/zinc/43/13/51/855431351.db2.gz YKNOPYYLGAHRPP-KSEOMHKRSA-N 2 0 401.595 4.134 20 0 HIADRP OC1(C[NH2+]Cc2ccc(Br)cc2Cl)CC[NH+](Cc2ccccc2)CC1 ZINC000397529588 855472848 /nfs/dbraw/zinc/47/28/48/855472848.db2.gz GQDBOIRGWSOFDS-UHFFFAOYSA-N 2 0 423.782 4.219 20 0 HIADRP OC1(C[NH2+]Cc2ccc(OCc3ccccc3)cc2)CC[NH+](Cc2ccccc2)CC1 ZINC000397564457 855472883 /nfs/dbraw/zinc/47/28/83/855472883.db2.gz BZBJITBZLISEQK-UHFFFAOYSA-N 2 0 416.565 4.382 20 0 HIADRP C[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1Br ZINC000397605747 855472997 /nfs/dbraw/zinc/47/29/97/855472997.db2.gz PPPAHMRMMXPMNE-INIZCTEOSA-N 2 0 421.354 4.266 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc(I)c1 ZINC000398013739 855473945 /nfs/dbraw/zinc/47/39/45/855473945.db2.gz FBZSDXYUCAAEJF-OXJNMPFZSA-N 2 0 420.338 4.291 20 0 HIADRP CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]([NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)C[C@H]2C1 ZINC000401122388 855479740 /nfs/dbraw/zinc/47/97/40/855479740.db2.gz KCNNSGYDLNEPNZ-LDVJMBRRSA-N 2 0 413.606 4.134 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)cc1 ZINC000410336897 855936400 /nfs/dbraw/zinc/93/64/00/855936400.db2.gz KFQLKXVIEZTAME-XMSQKQJNSA-N 2 0 414.619 4.225 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1 ZINC000410344277 855939384 /nfs/dbraw/zinc/93/93/84/855939384.db2.gz JVUUWHWNEXHXBV-SFHVURJKSA-N 2 0 400.611 4.169 20 0 HIADRP C[C@@H]1CCCC[NH+]1CCCCNC(=O)NCc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000410360658 855949599 /nfs/dbraw/zinc/94/95/99/855949599.db2.gz SCYKTYXNNBNJLQ-FCHUYYIVSA-N 2 0 414.638 4.372 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000410366017 855954111 /nfs/dbraw/zinc/95/41/11/855954111.db2.gz FXWIKQNSLOCJJW-NFBKMPQASA-N 2 0 424.589 4.148 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N(CC[NH+](C)C)Cc2ccccc2)C1 ZINC000410391404 855968527 /nfs/dbraw/zinc/96/85/27/855968527.db2.gz HKRMHGQSXKSARD-JOCHJYFZSA-N 2 0 422.617 4.192 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000410394533 855970973 /nfs/dbraw/zinc/97/09/73/855970973.db2.gz ZBPIMSSOAVFNJX-SQJMNOBHSA-N 2 0 420.601 4.135 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000426045279 856069142 /nfs/dbraw/zinc/06/91/42/856069142.db2.gz BSELRTFWVYKRLX-RBZQAINGSA-N 2 0 413.993 4.376 20 0 HIADRP C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000426964011 856565603 /nfs/dbraw/zinc/56/56/03/856565603.db2.gz OBISLZYRBKMJPG-HXUWFJFHSA-N 2 0 406.574 4.023 20 0 HIADRP C[C@@H]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000437463441 862826531 /nfs/dbraw/zinc/82/65/31/862826531.db2.gz SMYPUXNUIFJPOY-RCZVLFRGSA-N 2 0 405.586 4.022 20 0 HIADRP C[C@H]1CCN(C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000437463440 862826927 /nfs/dbraw/zinc/82/69/27/862826927.db2.gz SMYPUXNUIFJPOY-DHLKQENFSA-N 2 0 405.586 4.022 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)CC1 ZINC000427697246 856912490 /nfs/dbraw/zinc/91/24/90/856912490.db2.gz TWXNAKJGBSHJHB-OAQYLSRUSA-N 2 0 419.491 4.224 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1Cc1ccccc1 ZINC000428277220 857136985 /nfs/dbraw/zinc/13/69/85/857136985.db2.gz PKRAQGUAUMAIAB-PXDATVDWSA-N 2 0 420.601 4.135 20 0 HIADRP Cc1noc(C[C@H]([NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c2ccccc2)n1 ZINC000429461033 857682526 /nfs/dbraw/zinc/68/25/26/857682526.db2.gz GKWGWRRCADOMRD-KEZOAJOQSA-N 2 0 402.542 4.162 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](Cc3ccccc3F)c3ccccc3)cn2)CC1 ZINC000429515167 857710877 /nfs/dbraw/zinc/71/08/77/857710877.db2.gz AZEOPLRWPWZCFQ-VWLOTQADSA-N 2 0 418.560 4.436 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1 ZINC000429694482 857838064 /nfs/dbraw/zinc/83/80/64/857838064.db2.gz BSXIRAPMFCRLSB-HHHXNRCGSA-N 2 0 421.629 4.122 20 0 HIADRP COc1ccccc1-n1nccc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000430028142 858002650 /nfs/dbraw/zinc/00/26/50/858002650.db2.gz UNVRJJMPNYREHY-FQEVSTJZSA-N 2 0 404.558 4.403 20 0 HIADRP O=C(NC[C@@H]1CCC[N@@H+]1C1CCCCC1)NC[C@@H]1CCC[NH+](Cc2cccs2)C1 ZINC000437664543 863004675 /nfs/dbraw/zinc/00/46/75/863004675.db2.gz DOSBZDOIHQVKRT-FPOVZHCZSA-N 2 0 418.651 4.056 20 0 HIADRP CC(C)COc1ccccc1C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430915230 858369306 /nfs/dbraw/zinc/36/93/06/858369306.db2.gz BYRLTPXAEUVACR-UHFFFAOYSA-N 2 0 401.639 4.350 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCCOc4cc5c(cc43)CCC5)cc2)CC1 ZINC000431340500 858571889 /nfs/dbraw/zinc/57/18/89/858571889.db2.gz WRHHFXCTTSMCDD-VWLOTQADSA-N 2 0 406.570 4.136 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000431674341 858732010 /nfs/dbraw/zinc/73/20/10/858732010.db2.gz DBYKWSFYJWRMQE-PXDATVDWSA-N 2 0 422.617 4.333 20 0 HIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)o1 ZINC000432357743 859118962 /nfs/dbraw/zinc/11/89/62/859118962.db2.gz NGAZBZMPEGIPNJ-HXUWFJFHSA-N 2 0 408.546 4.031 20 0 HIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)o1 ZINC000432357742 859119414 /nfs/dbraw/zinc/11/94/14/859119414.db2.gz NGAZBZMPEGIPNJ-FQEVSTJZSA-N 2 0 408.546 4.031 20 0 HIADRP C[C@@H](C(=O)N1CCc2sccc2C1)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433131791 859532975 /nfs/dbraw/zinc/53/29/75/859532975.db2.gz VZSJATXIJOWOPM-FQEVSTJZSA-N 2 0 423.626 4.009 20 0 HIADRP O=C(CC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)c1ccc2c(c1)OCCO2 ZINC000433164479 859549394 /nfs/dbraw/zinc/54/93/94/859549394.db2.gz FJQFCJICEWMDEI-UHFFFAOYSA-N 2 0 420.553 4.019 20 0 HIADRP c1ncn(Cc2ccccc2)c1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433173332 859554530 /nfs/dbraw/zinc/55/45/30/859554530.db2.gz HVYSADULOOLPJB-UHFFFAOYSA-N 2 0 400.570 4.420 20 0 HIADRP COc1ccc(C)cc1NC(=O)[C@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433178135 859556947 /nfs/dbraw/zinc/55/69/47/859556947.db2.gz RRNOPDBYUXYIJX-NRFANRHFSA-N 2 0 421.585 4.319 20 0 HIADRP CN(c1ccccc1CNc1cccc2c1OCC[C@@H]2[NH+](C)C)C1CC[NH+](C)CC1 ZINC000433180262 859558126 /nfs/dbraw/zinc/55/81/26/859558126.db2.gz XMPNITPQCIVSOK-DEOSSOPVSA-N 2 0 408.590 4.214 20 0 HIADRP C[C@H]1CN(c2cc[nH+]c3ccc(Oc4ccccc4)cc32)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000433756414 859878110 /nfs/dbraw/zinc/87/81/10/859878110.db2.gz CCMXRAHVXDMMAW-CPJSRVTESA-N 2 0 416.569 4.489 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H](c2ccccc2)N2CCOCC2)CC1 ZINC000438834896 864328447 /nfs/dbraw/zinc/32/84/47/864328447.db2.gz LCLHIIXBUFCSFH-NRUKRLKBSA-N 2 0 407.602 4.093 20 0 HIADRP C[NH+](C)[C@@H](CNc1cncc(NC[C@@H](c2cccs2)[NH+](C)C)n1)c1cccs1 ZINC000439132535 864566967 /nfs/dbraw/zinc/56/69/67/864566967.db2.gz OYQIGZSGJPFBRZ-HOTGVXAUSA-N 2 0 416.620 4.029 20 0 HIADRP c1cc(C[NH+]2CCC([C@H]3CCCO3)CC2)ccc1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000439295061 864719272 /nfs/dbraw/zinc/71/92/72/864719272.db2.gz GLAQJQKIEAAYQX-CLJLJLNGSA-N 2 0 412.618 4.469 20 0 HIADRP CC(C)C[C@@H](CNC(=O)N1CCC(CC[NH+](C)C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000468026782 881860722 /nfs/dbraw/zinc/86/07/22/881860722.db2.gz ARVLNTNWKHLXKF-OFNKIYASSA-N 2 0 402.627 4.125 20 0 HIADRP CC(C)C[C@@H](CNC(=O)N1CCC([NH+]2CCCC2)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000468031375 881863803 /nfs/dbraw/zinc/86/38/03/881863803.db2.gz VRQPCGSAKGPIFN-IRLDBZIGSA-N 2 0 400.611 4.022 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[NH+]1Cc1ccccc1 ZINC000440528058 865805066 /nfs/dbraw/zinc/80/50/66/865805066.db2.gz ATZBWVVLYCNPQD-JWQCQUIFSA-N 2 0 405.586 4.022 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2CCCCOc1ccccc1C(F)(F)F ZINC000441188410 866261581 /nfs/dbraw/zinc/26/15/81/866261581.db2.gz KISKDRSLQPZLTB-POAQFYNOSA-N 2 0 400.485 4.048 20 0 HIADRP Cc1ccc([C@H](OC[C@@H](O)C[N@H+](C)CC[C@H]2CCCC[NH+]2C)c2ccccc2)cc1 ZINC000441365458 866434206 /nfs/dbraw/zinc/43/42/06/866434206.db2.gz PZLFIQCCZDJUHU-UODIDJSMSA-N 2 0 410.602 4.268 20 0 HIADRP O[C@H](COc1ccc(-c2ccccc2)cc1)C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441408716 866482033 /nfs/dbraw/zinc/48/20/33/866482033.db2.gz XOEDILFAFKTFSF-KTIWRFAQSA-N 2 0 406.570 4.042 20 0 HIADRP C[C@H](OC[C@@H](O)C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(Cl)cc1 ZINC000441623163 866721005 /nfs/dbraw/zinc/72/10/05/866721005.db2.gz SVKBSZYIJJJSIJ-PTLVVNQVSA-N 2 0 416.993 4.232 20 0 HIADRP C[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Br)cc1C(F)(F)F ZINC000442868652 867707563 /nfs/dbraw/zinc/70/75/63/867707563.db2.gz HGTAEGXYKRTVKA-ZDUSSCGKSA-N 2 0 422.333 4.145 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+][C@@H](c2ccc(Br)cc2Cl)C2CC2)CC1(C)C ZINC000442875281 867708850 /nfs/dbraw/zinc/70/88/50/867708850.db2.gz NSLRFUQHFLDATB-GOSISDBHSA-N 2 0 414.819 4.169 20 0 HIADRP CC[NH+](CC)CCOc1ccc(-c2noc([C@H](C)[NH+]3[C@@H](C)CC[C@@H]3C)n2)cc1OC ZINC000443201168 867873368 /nfs/dbraw/zinc/87/33/68/867873368.db2.gz HQPNVTDTVXQHHM-BZSNNMDCSA-N 2 0 416.566 4.400 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)CC[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443605981 868164279 /nfs/dbraw/zinc/16/42/79/868164279.db2.gz WSPCAUWFXJFWKZ-UHFFFAOYSA-N 2 0 407.986 4.265 20 0 HIADRP C[N@H+](C[C@H](O)Cc1ccccc1C(F)(F)F)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000443609413 868172446 /nfs/dbraw/zinc/17/24/46/868172446.db2.gz MCYQQLIRWHRCAX-TZIWHRDSSA-N 2 0 406.492 4.063 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000443996039 868518163 /nfs/dbraw/zinc/51/81/63/868518163.db2.gz OWKHDWJZSSASPX-QHCPKHFHSA-N 2 0 406.501 4.474 20 0 HIADRP c1ncn(Cc2ccccc2)c1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000445820374 869842951 /nfs/dbraw/zinc/84/29/51/869842951.db2.gz UMGLNLRZAZPCAJ-UHFFFAOYSA-N 2 0 400.570 4.420 20 0 HIADRP O=C(C[NH2+][C@H]1CCC[C@H]1c1ccccc1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000445987013 869950902 /nfs/dbraw/zinc/95/09/02/869950902.db2.gz AIQOVFVSMBGHAR-GOTSBHOMSA-N 2 0 409.599 4.100 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CC[C@H](n3c(C)[nH+]c4c3CCCC4)C2)cc1)C1CC1 ZINC000468451603 882389181 /nfs/dbraw/zinc/38/91/81/882389181.db2.gz ZYJUKFKCCPHMNA-QFIPXVFZSA-N 2 0 406.574 4.142 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000446565555 870476878 /nfs/dbraw/zinc/47/68/78/870476878.db2.gz PFYCAAFXTWNUOR-UHFFFAOYSA-N 2 0 420.601 4.311 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)Nc2ccccc2CC[NH+](C)C)CC1)CC1CC1 ZINC000446577958 870488199 /nfs/dbraw/zinc/48/81/99/870488199.db2.gz OQHGCHCBYOAKDZ-UHFFFAOYSA-N 2 0 400.611 4.157 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N[C@@H](C[N@@H+]1CCc2ccccc2C1)C(C)(C)C ZINC000446582481 870490835 /nfs/dbraw/zinc/49/08/35/870490835.db2.gz XTPMLDLACJQPSN-DEOSSOPVSA-N 2 0 422.617 4.385 20 0 HIADRP C[C@H]1C[C@@H](N(C)C(=O)Nc2ccccc2CC[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000446595982 870502411 /nfs/dbraw/zinc/50/24/11/870502411.db2.gz XSTYAIHLIAWTGZ-REWPJTCUSA-N 2 0 408.590 4.308 20 0 HIADRP CC[C@H]([NH2+]CCCN1CC[NH+](CC)CC1)c1ccc(Br)cc1Cl ZINC000446752197 870661352 /nfs/dbraw/zinc/66/13/52/870661352.db2.gz OARQPJGHBZDTIF-SFHVURJKSA-N 2 0 402.808 4.171 20 0 HIADRP COc1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc(Br)c1OC(F)F ZINC000446886751 870806800 /nfs/dbraw/zinc/80/68/00/870806800.db2.gz JNKBJZGAMIOPPL-UHFFFAOYSA-N 2 0 419.310 4.023 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)CCCS2 ZINC000446935519 870845628 /nfs/dbraw/zinc/84/56/28/870845628.db2.gz FWNIBFZABLQNHZ-HSZRJFAPSA-N 2 0 412.599 4.369 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](Cc3ccc(F)cc3)c3ccccc3)cn2)CC1 ZINC000447527843 871392630 /nfs/dbraw/zinc/39/26/30/871392630.db2.gz GDXREFDKKIKSTI-RUZDIDTESA-N 2 0 418.560 4.436 20 0 HIADRP CC(C)[C@H]1C[C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)c2ccccc21 ZINC000447584907 871490458 /nfs/dbraw/zinc/49/04/58/871490458.db2.gz HJQRLUYACKZKNI-RPBOFIJWSA-N 2 0 405.586 4.486 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(C)[C@H]1CC[N@H+](CC)C[C@@H]1C)c1ccccc1Cl ZINC000448462321 872421613 /nfs/dbraw/zinc/42/16/13/872421613.db2.gz SGYGCGMOEQBDGW-DZFGPLHGSA-N 2 0 409.018 4.095 20 0 HIADRP CCN(C(=O)NC[C@@H]1CCC[NH+](CC(C)C)C1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000448467066 872440141 /nfs/dbraw/zinc/44/01/41/872440141.db2.gz PKYCLGNBWUQUBV-AOHZBQACSA-N 2 0 414.638 4.221 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CCCc1nc(-c2ccccc2)no1 ZINC000460344457 872959104 /nfs/dbraw/zinc/95/91/04/872959104.db2.gz BNNPUQKIMIANDI-PMACEKPBSA-N 2 0 404.558 4.415 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)[C@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)CC1 ZINC000462092139 875202045 /nfs/dbraw/zinc/20/20/45/875202045.db2.gz WEMIDXFWWJQIJB-FQEVSTJZSA-N 2 0 413.528 4.469 20 0 HIADRP Cc1ccc(C[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)cn1 ZINC000462526812 875644492 /nfs/dbraw/zinc/64/44/92/875644492.db2.gz PLHTZKANJVKAOL-UHFFFAOYSA-N 2 0 406.496 4.101 20 0 HIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CCc2cccc(C(N)=O)c2)c2ccc(F)cc2)CC1 ZINC000462823394 875862096 /nfs/dbraw/zinc/86/20/96/875862096.db2.gz UGVATQGZLJZECK-XMMPIXPASA-N 2 0 411.565 4.310 20 0 HIADRP Cc1[nH+]c2ccc(Br)cc2c(N2CC[NH+](CC3CCOCC3)CC2)c1C ZINC000462870530 875900653 /nfs/dbraw/zinc/90/06/53/875900653.db2.gz FHILBLCXDCOZPG-UHFFFAOYSA-N 2 0 418.379 4.163 20 0 HIADRP Clc1ccccc1CN1CCC([NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)CC1 ZINC000463106565 876144768 /nfs/dbraw/zinc/14/47/68/876144768.db2.gz AOGOCFUEQRMKCU-QFIPXVFZSA-N 2 0 412.021 4.459 20 0 HIADRP Fc1ccc(CCN2CCC([NH2+]CC3CC[NH+](Cc4cccs4)CC3)CC2)cc1 ZINC000463112269 876151300 /nfs/dbraw/zinc/15/13/00/876151300.db2.gz JUTHRWMZOIXERP-UHFFFAOYSA-N 2 0 415.622 4.396 20 0 HIADRP C[C@H]1C[C@@H](NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000463238028 876293378 /nfs/dbraw/zinc/29/33/78/876293378.db2.gz NDLQFDPXDBPBDG-LDIWMBKBSA-N 2 0 409.540 4.434 20 0 HIADRP COc1ccccc1N1CC[C@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000463290559 876350244 /nfs/dbraw/zinc/35/02/44/876350244.db2.gz KQLJWVOAQYYKRR-XALAGWIPSA-N 2 0 405.586 4.307 20 0 HIADRP Cc1ccc([C@@H](Cc2ccccc2Br)[NH2+]CC2(O)CC[NH+](C)CC2)cc1 ZINC000464057420 877201080 /nfs/dbraw/zinc/20/10/80/877201080.db2.gz GATPJRIDBUUMBR-OAQYLSRUSA-N 2 0 417.391 4.088 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)C1 ZINC000503389102 912370951 /nfs/dbraw/zinc/37/09/51/912370951.db2.gz QTBYSCHAWNQGRH-ZRBLBEILSA-N 2 0 406.659 4.042 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000465594376 879079251 /nfs/dbraw/zinc/07/92/51/879079251.db2.gz HBHWOHCAQRKLSX-HSZRJFAPSA-N 2 0 422.617 4.192 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCC[NH+]1CCC[C@H](C)C1 ZINC000465612041 879109849 /nfs/dbraw/zinc/10/98/49/879109849.db2.gz YEHMAGCTGLRQJQ-UPVQGACJSA-N 2 0 414.638 4.052 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000503440881 912455801 /nfs/dbraw/zinc/45/58/01/912455801.db2.gz ZLUPNLDEFUPUKB-QFIPXVFZSA-N 2 0 414.638 4.180 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCC2)c1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000503446611 912468293 /nfs/dbraw/zinc/46/82/93/912468293.db2.gz LSHBZNHWYJAQLB-DEOSSOPVSA-N 2 0 412.622 4.080 20 0 HIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@H]2CCC[NH+](C)[C@@H]2c2cccs2)C1 ZINC000465897124 879554134 /nfs/dbraw/zinc/55/41/34/879554134.db2.gz QIZZNDDSWYKQKN-SBHAEUEKSA-N 2 0 420.667 4.331 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000465923922 879586907 /nfs/dbraw/zinc/58/69/07/879586907.db2.gz RVCBPNWMYWMMHI-GMAHTHKFSA-N 2 0 422.617 4.279 20 0 HIADRP C[NH+](C)CCN(CC1CCCCC1)C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000466075973 879783553 /nfs/dbraw/zinc/78/35/53/879783553.db2.gz HXYJIXBNFWKGNS-UNMCSNQZSA-N 2 0 420.667 4.285 20 0 HIADRP C[NH+](C)CCN(CC1CCCCC1)C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000466075970 879784106 /nfs/dbraw/zinc/78/41/06/879784106.db2.gz HXYJIXBNFWKGNS-IFMALSPDSA-N 2 0 420.667 4.285 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CCC[C@@H]([C@@H]4CCOC4)C3)CC2)cc1 ZINC000466347621 880105006 /nfs/dbraw/zinc/10/50/06/880105006.db2.gz SGGOULPSLMVNIL-WXFUMESZSA-N 2 0 400.607 4.243 20 0 HIADRP O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000503505453 912553211 /nfs/dbraw/zinc/55/32/11/912553211.db2.gz UQTYIKZIKSTKDB-VXKWHMMOSA-N 2 0 416.610 4.104 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2c(-c3ccccc3)nc3ccccn32)[C@@H](C)C1 ZINC000469770694 883944432 /nfs/dbraw/zinc/94/44/32/883944432.db2.gz VWJXGCRBTYIDIA-UNMCSNQZSA-N 2 0 406.574 4.228 20 0 HIADRP CN(C(=O)NCc1ccccc1C[NH+]1CCCC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470756920 885224055 /nfs/dbraw/zinc/22/40/55/885224055.db2.gz SFQMKWMOGNZNRH-VWLOTQADSA-N 2 0 420.601 4.088 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@H](C[NH+]2CCCC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000470893972 885391985 /nfs/dbraw/zinc/39/19/85/885391985.db2.gz AGUGJYQZSAQYEF-LEWJYISDSA-N 2 0 400.611 4.023 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+][C@H](C)CCN1CC[NH+](C)CC1 ZINC000471607336 886322595 /nfs/dbraw/zinc/32/25/95/886322595.db2.gz YOLBQPDTVQZFDQ-HZPDHXFCSA-N 2 0 407.027 4.449 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000471895063 886676816 /nfs/dbraw/zinc/67/68/16/886676816.db2.gz ILNROOHBLFUJNM-GMAHTHKFSA-N 2 0 420.601 4.033 20 0 HIADRP CCN(CCC[NH+]1CCCC1)C(=O)Nc1cccc(CC[NH+]2CCC(C)CC2)c1 ZINC000471973350 886804944 /nfs/dbraw/zinc/80/49/44/886804944.db2.gz PDOYEWYKWSCJCR-UHFFFAOYSA-N 2 0 400.611 4.301 20 0 HIADRP CCN(C(=O)NCc1ccc(C[NH+](C)C)cc1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473875462 888738669 /nfs/dbraw/zinc/73/86/69/888738669.db2.gz NQJOQKMHCCLYJQ-HYBUGGRVSA-N 2 0 408.590 4.115 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000474347360 889223896 /nfs/dbraw/zinc/22/38/96/889223896.db2.gz FLOBGRDDKSQHES-GOSISDBHSA-N 2 0 424.427 4.030 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)[C@H](C)c1nc2ccccc2s1 ZINC000474467548 889330586 /nfs/dbraw/zinc/33/05/86/889330586.db2.gz BMKUWBLRSNPGCC-OALUTQOASA-N 2 0 408.615 4.326 20 0 HIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000474820812 889674947 /nfs/dbraw/zinc/67/49/47/889674947.db2.gz HSDZBQKJVJGKAD-OALUTQOASA-N 2 0 400.636 4.328 20 0 HIADRP CC(C)c1nc2c([nH]1)C[C@H](C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@@H]1C)CC2 ZINC000474896434 889755664 /nfs/dbraw/zinc/75/56/64/889755664.db2.gz QJJWFRFWNUJGAP-RBUKOAKNSA-N 2 0 408.590 4.329 20 0 HIADRP CCN(C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475175107 890043345 /nfs/dbraw/zinc/04/33/45/890043345.db2.gz PUTGWSVRHAEKHP-RUZDIDTESA-N 2 0 420.601 4.088 20 0 HIADRP CC(C)[NH2+]C1CCN(C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)CC1 ZINC000476430164 891343044 /nfs/dbraw/zinc/34/30/44/891343044.db2.gz CPVKIEXMEDLJQZ-UHFFFAOYSA-N 2 0 408.590 4.087 20 0 HIADRP Cc1ccccc1[C@H]([C@@H](C)NC(=O)NCc1ccccc1C[NH+]1CCCC1)[NH+](C)C ZINC000476908242 891860751 /nfs/dbraw/zinc/86/07/51/891860751.db2.gz UNLLZTUYHZQXIQ-YKSBVNFPSA-N 2 0 408.590 4.081 20 0 HIADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)c1csc(-c2cccc3ccccc32)n1 ZINC000477662751 892800720 /nfs/dbraw/zinc/80/07/20/892800720.db2.gz GTKKALHHAIQKHQ-UHFFFAOYSA-N 2 0 424.614 4.309 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479268308 894540643 /nfs/dbraw/zinc/54/06/43/894540643.db2.gz ZOBLIYGPUSJXMO-QFIPXVFZSA-N 2 0 416.407 4.156 20 0 HIADRP C[C@@H](Cc1ccc(Br)cc1)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000479280739 894558926 /nfs/dbraw/zinc/55/89/26/894558926.db2.gz HBWQXLVAAASCFX-KRWDZBQOSA-N 2 0 417.391 4.127 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H]2CC(C)(C)c3ccc(Br)cc32)ccn1 ZINC000479405106 894709922 /nfs/dbraw/zinc/70/99/22/894709922.db2.gz CKDOVEYIGNXHMM-IBGZPJMESA-N 2 0 418.379 4.297 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H]2CC(C)(C)c3ccc(Br)cc32)ccn1 ZINC000479405107 894710723 /nfs/dbraw/zinc/71/07/23/894710723.db2.gz CKDOVEYIGNXHMM-LJQANCHMSA-N 2 0 418.379 4.297 20 0 HIADRP COc1cc2c(cc1F)[nH+]ccc2N(C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000480075538 895428563 /nfs/dbraw/zinc/42/85/63/895428563.db2.gz SWWKJOGVHDDOKI-UHFFFAOYSA-N 2 0 414.569 4.015 20 0 HIADRP C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(-c2ccccc2Br)s1 ZINC000480166785 895555413 /nfs/dbraw/zinc/55/54/13/895555413.db2.gz RXFQHCNTFRGTTP-INIZCTEOSA-N 2 0 422.436 4.466 20 0 HIADRP C[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(-c2ccccc2Br)s1 ZINC000480166787 895556666 /nfs/dbraw/zinc/55/66/66/895556666.db2.gz RXFQHCNTFRGTTP-MRXNPFEDSA-N 2 0 422.436 4.466 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000480236644 895645506 /nfs/dbraw/zinc/64/55/06/895645506.db2.gz VQCRYCWIAPSFIP-YPAWHYETSA-N 2 0 418.585 4.391 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000480236640 895646318 /nfs/dbraw/zinc/64/63/18/895646318.db2.gz VQCRYCWIAPSFIP-BHIFYINESA-N 2 0 418.585 4.391 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CNc1cc(C)cc(N2CC[NH+](C(C)C)CC2)c1 ZINC000480455019 895842318 /nfs/dbraw/zinc/84/23/18/895842318.db2.gz KGHJOUMPLXZXOD-UHFFFAOYSA-N 2 0 404.562 4.027 20 0 HIADRP CC(C)(C)C(=O)N1CCC(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)CC1 ZINC000480535596 895897762 /nfs/dbraw/zinc/89/77/62/895897762.db2.gz JLZALZCQDYIDRH-SANMLTNESA-N 2 0 411.634 4.259 20 0 HIADRP C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000480539808 895902649 /nfs/dbraw/zinc/90/26/49/895902649.db2.gz LIIMVZYPLQHFTE-CYBMUJFWSA-N 2 0 411.434 4.401 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H](C)c1ccc2ccccc2c1OC(F)F)N1CC[NH+](C)CC1 ZINC000480548643 895908740 /nfs/dbraw/zinc/90/87/40/895908740.db2.gz JYESSODGDGPCHV-DYESRHJHSA-N 2 0 405.533 4.364 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(OCc2ccc(F)cc2)cc1)N1CC[NH+](C)CC1 ZINC000480553024 895913911 /nfs/dbraw/zinc/91/39/11/895913911.db2.gz LOCVTRGVZBAGIT-CJFMBICVSA-N 2 0 413.581 4.327 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480599257 895960931 /nfs/dbraw/zinc/96/09/31/895960931.db2.gz DCKMBEJKVYEQLU-QZTJIDSGSA-N 2 0 418.578 4.312 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](C)c2cnn(-c3ccc(Cl)cc3Cl)c2C)CC1 ZINC000480600075 895962811 /nfs/dbraw/zinc/96/28/11/895962811.db2.gz HTJUNHJCJUPDIX-HZPDHXFCSA-N 2 0 424.420 4.164 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 ZINC000480604036 895969570 /nfs/dbraw/zinc/96/95/70/895969570.db2.gz FKEWZLSGRHGRFY-HZPDHXFCSA-N 2 0 407.027 4.449 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 ZINC000480604039 895969846 /nfs/dbraw/zinc/96/98/46/895969846.db2.gz FKEWZLSGRHGRFY-JKSUJKDBSA-N 2 0 407.027 4.449 20 0 HIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@H](c1ccc(Cl)cc1)N1CCc2sccc2C1 ZINC000480618091 895986540 /nfs/dbraw/zinc/98/65/40/895986540.db2.gz OJZBYAUAYCDTDX-MAODMQOUSA-N 2 0 404.023 4.431 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1ccc(OC)c(OC)c1 ZINC000480687889 896050654 /nfs/dbraw/zinc/05/06/54/896050654.db2.gz GBZNEQLBKQULOM-QHCPKHFHSA-N 2 0 411.590 4.082 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000480691854 896054648 /nfs/dbraw/zinc/05/46/48/896054648.db2.gz GPPWMZGXPDBSHK-SFHVURJKSA-N 2 0 403.517 4.276 20 0 HIADRP Cc1ccc(OCCCC(=O)Nc2ccc(C[NH2+][C@@H]3CC[N@@H+](C)C[C@@H]3C)cc2)cc1 ZINC000480694046 896056817 /nfs/dbraw/zinc/05/68/17/896056817.db2.gz KXLNFPZRGDUHTQ-GBXCKJPGSA-N 2 0 409.574 4.223 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1 ZINC000480720087 896079502 /nfs/dbraw/zinc/07/95/02/896079502.db2.gz IINLTPYIBRWQCZ-GOSISDBHSA-N 2 0 409.574 4.488 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccccc1OC(F)F ZINC000480727110 896087378 /nfs/dbraw/zinc/08/73/78/896087378.db2.gz MYGHOWQLKJGZQS-LJQANCHMSA-N 2 0 404.505 4.066 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]C1CCC2(CC1)c1ccccc1NC2=O ZINC000480734884 896095776 /nfs/dbraw/zinc/09/57/76/896095776.db2.gz VXOBNZURTABEHU-UHFFFAOYSA-N 2 0 421.585 4.330 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3ccc(Br)s3)cc2)CC1 ZINC000480743186 896105761 /nfs/dbraw/zinc/10/57/61/896105761.db2.gz YSRAHRVWHHYPDL-INIZCTEOSA-N 2 0 422.436 4.499 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H](C)c2sc(-c3ccc(OC)cc3)nc2C)CC1 ZINC000480765574 896129027 /nfs/dbraw/zinc/12/90/27/896129027.db2.gz ALANAXYBZLLRQR-GOSISDBHSA-N 2 0 416.635 4.195 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CCc4ccc(OC(F)(F)F)cc43)cc2)CC1 ZINC000480884189 896240424 /nfs/dbraw/zinc/24/04/24/896240424.db2.gz SDWYLSIRHKVCOQ-JOCHJYFZSA-N 2 0 419.491 4.110 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccccc1OC(F)(F)F ZINC000480894444 896250253 /nfs/dbraw/zinc/25/02/53/896250253.db2.gz DULWMSRNSBRMJG-KRWDZBQOSA-N 2 0 407.480 4.183 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccncc2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480897888 896254668 /nfs/dbraw/zinc/25/46/68/896254668.db2.gz LPRCVTRFRVESBT-LJQANCHMSA-N 2 0 418.541 4.125 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000480910403 896265707 /nfs/dbraw/zinc/26/57/07/896265707.db2.gz KCTPWBNLRDUQTD-GOSISDBHSA-N 2 0 421.507 4.226 20 0 HIADRP O=C(NCCC[NH+](Cc1ccccc1)Cc1ccccc1)N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000481065895 896387322 /nfs/dbraw/zinc/38/73/22/896387322.db2.gz ZCLSRRBCWRHGOJ-DQEYMECFSA-N 2 0 420.601 4.005 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H](O)COc1c(Cl)cccc1Cl ZINC000481179092 896517233 /nfs/dbraw/zinc/51/72/33/896517233.db2.gz ULTALLRTGPXKBS-MMOPVJDHSA-N 2 0 423.384 4.233 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCCOc3ccc(Br)cc32)cc1 ZINC000481306480 896653227 /nfs/dbraw/zinc/65/32/27/896653227.db2.gz IBVQCDGGWVNPQB-HXUWFJFHSA-N 2 0 419.363 4.393 20 0 HIADRP Clc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(OCCN3CCOCC3)c1)CCCO2 ZINC000481415393 896818256 /nfs/dbraw/zinc/81/82/56/896818256.db2.gz OAQXKTNARYKHTD-QFIPXVFZSA-N 2 0 416.949 4.055 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cccc(N4CCOCC4)c3)CC2)cc1 ZINC000481715826 897107649 /nfs/dbraw/zinc/10/76/49/897107649.db2.gz JOGDUMACZRWXEM-NRFANRHFSA-N 2 0 423.601 4.095 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482115155 897566533 /nfs/dbraw/zinc/56/65/33/897566533.db2.gz QCBSEZPFLGVUPR-LJQANCHMSA-N 2 0 418.541 4.125 20 0 HIADRP Cc1nc2c(s1)[C@@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C3CCOCC3)c1)CCC2 ZINC000482257939 897740556 /nfs/dbraw/zinc/74/05/56/897740556.db2.gz JSHQYEHYTBDEML-NRFANRHFSA-N 2 0 415.603 4.108 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)CC1 ZINC000482497389 898077203 /nfs/dbraw/zinc/07/72/03/898077203.db2.gz YATMDEJXAOEIPB-SJORKVTESA-N 2 0 404.599 4.182 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000482498765 898078787 /nfs/dbraw/zinc/07/87/87/898078787.db2.gz BZRHXCPRKARELR-PXNSSMCTSA-N 2 0 416.610 4.190 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2sc(-c3ccccc3F)nc2C)CC1 ZINC000482509421 898093591 /nfs/dbraw/zinc/09/35/91/898093591.db2.gz LZWFABOIMTZFPC-IRXDYDNUSA-N 2 0 404.599 4.182 20 0 HIADRP C[C@@H](C[NH2+][C@H](Cc1ccc(F)cc1)c1ccccc1Cl)CN1CC[NH+](C)CC1 ZINC000482513569 898098762 /nfs/dbraw/zinc/09/87/62/898098762.db2.gz REYXKNSFBMDNOT-FDDCHVKYSA-N 2 0 403.973 4.236 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(-n2cccn2)cc1 ZINC000482542727 898131486 /nfs/dbraw/zinc/13/14/86/898131486.db2.gz YQQFFRUBAAGWQU-OALUTQOASA-N 2 0 407.537 4.175 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cnn(Cc2ccccc2)c1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482550216 898140105 /nfs/dbraw/zinc/14/01/05/898140105.db2.gz PNRHHNODOBAWEH-VQTJNVASSA-N 2 0 421.564 4.234 20 0 HIADRP COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c1 ZINC000482553198 898143737 /nfs/dbraw/zinc/14/37/37/898143737.db2.gz DJMXHLCCXTVDNV-SJORKVTESA-N 2 0 401.526 4.007 20 0 HIADRP C[C@@H](C[NH2+][C@@H](CCSc1ccccc1)c1ccc(F)cc1)N1CC[NH+](C)CC1 ZINC000482554216 898145413 /nfs/dbraw/zinc/14/54/13/898145413.db2.gz GVLGXZJWOYMWSB-CVDCTZTESA-N 2 0 401.595 4.275 20 0 HIADRP C[C@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(-c2ccc(Br)cc2)s1 ZINC000482560554 898152524 /nfs/dbraw/zinc/15/25/24/898152524.db2.gz QFLGUFSHQPNSKF-HOTGVXAUSA-N 2 0 422.436 4.464 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H]2CCCc3nc(C)sc32)CC1 ZINC000482568632 898164165 /nfs/dbraw/zinc/16/41/65/898164165.db2.gz HYAVBDOGOCKCML-BEFAXECRSA-N 2 0 402.583 4.461 20 0 HIADRP CC(C)Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000482631108 898232998 /nfs/dbraw/zinc/23/29/98/898232998.db2.gz CORLDNJWBPDQHJ-CJFMBICVSA-N 2 0 407.602 4.433 20 0 HIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000482634359 898238396 /nfs/dbraw/zinc/23/83/96/898238396.db2.gz SLCVHXUWGURGRC-AUSIDOKSSA-N 2 0 409.574 4.022 20 0 HIADRP COc1ccccc1OC[C@@H](C)C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000482706715 898305807 /nfs/dbraw/zinc/30/58/07/898305807.db2.gz PAKPGFKIBHKAPX-FQEVSTJZSA-N 2 0 411.590 4.030 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)[C@@H](C)C1 ZINC000482948834 898576044 /nfs/dbraw/zinc/57/60/44/898576044.db2.gz SOKDEPYJDGAIQI-WIOPSUGQSA-N 3 0 401.639 4.289 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3cccc(Br)c3)CC2)[C@H](C)C1 ZINC000483121796 898808581 /nfs/dbraw/zinc/80/85/81/898808581.db2.gz RAGGAVYVXGVTFR-XLIONFOSSA-N 2 0 409.412 4.207 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCCc2ccc(Br)cc2F)[C@@H](C)C1 ZINC000483176185 898842849 /nfs/dbraw/zinc/84/28/49/898842849.db2.gz CGWGPNSNXCNBIX-OXJNMPFZSA-N 2 0 415.391 4.247 20 0 HIADRP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2C[C@H](C)C[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000483635736 899288286 /nfs/dbraw/zinc/28/82/86/899288286.db2.gz LFYVJMWCTQGDQV-UZLBHIALSA-N 2 0 411.512 4.077 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@H](C)C2)C[C@H]1C ZINC000483677162 899336674 /nfs/dbraw/zinc/33/66/74/899336674.db2.gz FLBZDXWECMQEJU-WHLIWEHUSA-N 2 0 414.638 4.179 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@H](C)C3)cc2)C[C@@H]1C ZINC000483686714 899344612 /nfs/dbraw/zinc/34/46/12/899344612.db2.gz VEJMDCBXVHQBMM-XARGGIHNSA-N 2 0 414.638 4.179 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C[C@H]1C ZINC000483691500 899349932 /nfs/dbraw/zinc/34/99/32/899349932.db2.gz JQXSMJDRXHSZOV-YKSBVNFPSA-N 2 0 422.617 4.429 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC2CC[NH+](C3CCCC3)CC2)c2ccccc2)CC1 ZINC000483715514 899373163 /nfs/dbraw/zinc/37/31/63/899373163.db2.gz ZCALVCKUSWDUPH-XMMPIXPASA-N 2 0 412.622 4.166 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000483720665 899380564 /nfs/dbraw/zinc/38/05/64/899380564.db2.gz GKAYMDVMVAVKID-RLWLMLJZSA-N 2 0 418.585 4.307 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCC2CC[NH+](Cc3ccccc3Cl)CC2)C[C@H]1C ZINC000483741828 899405849 /nfs/dbraw/zinc/40/58/49/899405849.db2.gz FDWQFGGGOSZABY-WIYYLYMNSA-N 2 0 421.029 4.066 20 0 HIADRP CC[NH+](CC)CCN(Cc1cccs1)C(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000483986535 899629038 /nfs/dbraw/zinc/62/90/38/899629038.db2.gz MWDBREKNLBNULW-UHFFFAOYSA-N 2 0 406.640 4.009 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCN(C(=O)c2ccccc2)CC1 ZINC000484165863 899785256 /nfs/dbraw/zinc/78/52/56/899785256.db2.gz VPGCGQPEGQLRFQ-PXDATVDWSA-N 2 0 405.586 4.039 20 0 HIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H]1CCCc2nc(-c3ccc(OC)cc3)sc21 ZINC000484283099 899851136 /nfs/dbraw/zinc/85/11/36/899851136.db2.gz PMHUXSNPIYDSME-MOPGFXCFSA-N 2 0 403.592 4.143 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)C(c1ccccc1)c1ccccc1 ZINC000484295991 899858838 /nfs/dbraw/zinc/85/88/38/899858838.db2.gz GPEUNKNPZXZYHT-NRFANRHFSA-N 2 0 421.629 4.423 20 0 HIADRP COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C)C2)c1 ZINC000484509814 900000405 /nfs/dbraw/zinc/00/04/05/900000405.db2.gz UOHLPSDWOCFCCZ-HXAGEGRHSA-N 2 0 423.601 4.030 20 0 HIADRP CCOc1ccccc1NC(=O)CC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000485347944 900639694 /nfs/dbraw/zinc/63/96/94/900639694.db2.gz NAWKVCBMYACIJC-ISKFKSNPSA-N 2 0 421.585 4.400 20 0 HIADRP CCC[NH+]1CCC([N@H+](C)CCC(=O)Nc2ccc(OCc3ccccc3)cc2)CC1 ZINC000485671774 900921221 /nfs/dbraw/zinc/92/12/21/900921221.db2.gz PBMKIRACHVWQNJ-UHFFFAOYSA-N 2 0 409.574 4.400 20 0 HIADRP O=C(CC[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1)Nc1ccc(OCc2ccccc2)cc1 ZINC000485672496 900923155 /nfs/dbraw/zinc/92/31/55/900923155.db2.gz KXNXEDIVYJDUGU-QFIPXVFZSA-N 2 0 407.558 4.012 20 0 HIADRP Cc1ccc2ccccc2c1C[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000487776127 902358168 /nfs/dbraw/zinc/35/81/68/902358168.db2.gz ZOGOUEMXNPDSJV-UHFFFAOYSA-N 2 0 407.602 4.352 20 0 HIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C(=O)Nc2cccc(OC)c2)c2ccccc2)CC1 ZINC000488434303 902824562 /nfs/dbraw/zinc/82/45/62/902824562.db2.gz LPEDJVTXSLBTAV-DEOSSOPVSA-N 2 0 409.574 4.429 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000488526567 902870563 /nfs/dbraw/zinc/87/05/63/902870563.db2.gz ZTXIFKALENLOCQ-XRODADMRSA-N 2 0 423.576 4.065 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(Br)c(F)c1 ZINC000489469453 903401980 /nfs/dbraw/zinc/40/19/80/903401980.db2.gz BGUWBMYHTRNDGT-OAHLLOKOSA-N 2 0 421.354 4.396 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000489681898 903541414 /nfs/dbraw/zinc/54/14/14/903541414.db2.gz UEVRACMITSFPCB-HNNXBMFYSA-N 2 0 420.907 4.239 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000489842837 903625209 /nfs/dbraw/zinc/62/52/09/903625209.db2.gz WRMVHWGPDFLBLA-YMPZKCBVSA-N 2 0 424.589 4.016 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489908508 903666382 /nfs/dbraw/zinc/66/63/82/903666382.db2.gz FQYLNSAJNIXYDF-VXKWHMMOSA-N 2 0 414.638 4.051 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)CC1 ZINC000490004682 903719492 /nfs/dbraw/zinc/71/94/92/903719492.db2.gz POOGQFKXPYAWOK-QHCPKHFHSA-N 2 0 424.589 4.113 20 0 HIADRP CCOc1ccc([C@@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2ccccc2Cl)cc1 ZINC000491011556 904367564 /nfs/dbraw/zinc/36/75/64/904367564.db2.gz WACUCMLVCLXUNK-XMMPIXPASA-N 2 0 416.009 4.445 20 0 HIADRP CSc1cccc([C@H]([NH2+]CC2CC[NH+](CCO)CC2)c2cc(F)ccc2F)c1 ZINC000491037789 904390319 /nfs/dbraw/zinc/39/03/19/904390319.db2.gz ORNZNZDDXNAOAS-QFIPXVFZSA-N 2 0 406.542 4.070 20 0 HIADRP CCN(Cc1ccccc1)C(=O)[C@@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000491059990 904403525 /nfs/dbraw/zinc/40/35/25/904403525.db2.gz UTNMPOIDUKUHML-JOCHJYFZSA-N 2 0 407.602 4.268 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccccc1)c1ccccc1Br ZINC000492253198 904824060 /nfs/dbraw/zinc/82/40/60/904824060.db2.gz OIEAONXEHGUZJF-UGKGYDQZSA-N 2 0 417.391 4.365 20 0 HIADRP O=C(C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000493503043 905142051 /nfs/dbraw/zinc/14/20/51/905142051.db2.gz MHNHATJFRCUVAS-UPVQGACJSA-N 2 0 423.626 4.175 20 0 HIADRP CN(CC(C)(C)C[N@H+](C)Cc1ccccc1)C1CC[NH+](CCc2ccccn2)CC1 ZINC000512389882 921126133 /nfs/dbraw/zinc/12/61/33/921126133.db2.gz UVOIJNGVNSYVEJ-UHFFFAOYSA-N 2 0 408.634 4.179 20 0 HIADRP C[C@@H]1[C@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000494050599 905387753 /nfs/dbraw/zinc/38/77/53/905387753.db2.gz QZUBYQIBBOVXLL-ZJSXRUAMSA-N 2 0 405.586 4.068 20 0 HIADRP C[C@@H](c1ccccc1Cl)[NH+]1CCC(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1 ZINC000494560530 905835662 /nfs/dbraw/zinc/83/56/62/905835662.db2.gz GUIDHJVHEFFZAN-IBGZPJMESA-N 2 0 413.993 4.361 20 0 HIADRP C[C@H]([NH2+]C1CCC2(CC1)c1ccccc1NC2=O)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495421111 906441014 /nfs/dbraw/zinc/44/10/14/906441014.db2.gz NVBZSWHCZAVWQF-OCYXBUBRSA-N 2 0 403.570 4.319 20 0 HIADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1OCC(=O)N(C)C ZINC000495438307 906452024 /nfs/dbraw/zinc/45/20/24/906452024.db2.gz GWMLXJGCGSXBIB-SSPYTLHUSA-N 2 0 423.601 4.105 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cccc2ccccc21 ZINC000495460703 906465005 /nfs/dbraw/zinc/46/50/05/906465005.db2.gz LLFWXDWVCSUTFV-WMZHIEFXSA-N 2 0 401.554 4.388 20 0 HIADRP c1cn(Cc2ccccc2)c(CC[NH2+][C@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000512618660 921264385 /nfs/dbraw/zinc/26/43/85/921264385.db2.gz JMTWMQWDCAKYEF-NXCFDTQHSA-N 2 0 414.597 4.364 20 0 HIADRP O=C1CCCN1Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000512619268 921264438 /nfs/dbraw/zinc/26/44/38/921264438.db2.gz LPWNQTWCSODHNM-TWJOJJKGSA-N 2 0 417.597 4.199 20 0 HIADRP c1cn(Cc2ccc(C[NH2+][C@H]3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)cc2)cn1 ZINC000512648531 921273848 /nfs/dbraw/zinc/27/38/48/921273848.db2.gz NZFPGTZPFHKNBP-NXCFDTQHSA-N 2 0 400.570 4.322 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]CC4CCN(c5cc[nH+]cc5)CC4)[C@@H]3C2)cc1 ZINC000512654379 921276262 /nfs/dbraw/zinc/27/62/62/921276262.db2.gz LRNKLOJPHIJBPQ-SKBVVQJISA-N 3 0 404.602 4.188 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@H]2C)CC1 ZINC000497631813 907112926 /nfs/dbraw/zinc/11/29/26/907112926.db2.gz DUVZYIABHNHUSW-CZSZKKDXSA-N 2 0 420.601 4.174 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)NC1CC[NH+]([C@H](C)c2ccccc2)CC1)c1ccco1 ZINC000497632000 907113233 /nfs/dbraw/zinc/11/32/33/907113233.db2.gz FTLBQQHUWDWVQW-JQVVWYNYSA-N 2 0 412.578 4.234 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H]2C)CC1 ZINC000497631815 907113637 /nfs/dbraw/zinc/11/36/37/907113637.db2.gz DUVZYIABHNHUSW-OTPAQWSUSA-N 2 0 420.601 4.174 20 0 HIADRP CCN(CC[NH+]1CCCCCC1)C(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000497634717 907117562 /nfs/dbraw/zinc/11/75/62/907117562.db2.gz SZTLHMJDRYOXFK-NRFANRHFSA-N 2 0 400.611 4.120 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H]3CC=C(c4ccc(F)cc4)CC3)c2)C1 ZINC000497834975 907316840 /nfs/dbraw/zinc/31/68/40/907316840.db2.gz BHRKFCYOLRMQIJ-UKILVPOCSA-N 2 0 421.560 4.249 20 0 HIADRP C[C@@H]1CCc2nc(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)sc2C1 ZINC000498358666 907856667 /nfs/dbraw/zinc/85/66/67/907856667.db2.gz HCCPXIQNKUXLCX-LJQANCHMSA-N 2 0 413.631 4.429 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)c2cccc(C[NH+]3CCCC3)c2)C1 ZINC000498567455 908026705 /nfs/dbraw/zinc/02/67/05/908026705.db2.gz OOEWXWLRQVNWTH-OAQYLSRUSA-N 2 0 405.586 4.444 20 0 HIADRP O=C(NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000498600778 908049376 /nfs/dbraw/zinc/04/93/76/908049376.db2.gz OHPONMZMAZSFPZ-QHCPKHFHSA-N 2 0 411.977 4.085 20 0 HIADRP O=C(c1ccccc1F)N1CCC([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499137886 908495330 /nfs/dbraw/zinc/49/53/30/908495330.db2.gz AQXCOZATHXLERN-WBDAEOGXSA-N 2 0 421.560 4.216 20 0 HIADRP C[C@H]1CN(Cc2cccc(C[NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2)CCO1 ZINC000499144130 908501163 /nfs/dbraw/zinc/50/11/63/908501163.db2.gz VHMHWWXCJUXDFL-VPIUVCPKSA-N 2 0 419.613 4.193 20 0 HIADRP O=C(c1ccccc1)N1CCC([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499146405 908503950 /nfs/dbraw/zinc/50/39/50/908503950.db2.gz MBHYRZURPJVRGD-QEIWAGNOSA-N 2 0 403.570 4.076 20 0 HIADRP COc1ccc([C@@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N(C)C)cc1OC ZINC000499153207 908511309 /nfs/dbraw/zinc/51/13/09/908511309.db2.gz RHRNQUKPOQUSSP-JLLPCOHGSA-N 2 0 423.601 4.092 20 0 HIADRP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(N2CCOCC2)c1 ZINC000499197377 908553002 /nfs/dbraw/zinc/55/30/02/908553002.db2.gz ZCIXQSNEFJTTTP-MPIKPJSNSA-N 2 0 405.586 4.117 20 0 HIADRP COc1cccc(N2CCC[C@@H]([NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499213871 908569144 /nfs/dbraw/zinc/56/91/44/908569144.db2.gz UUORXWHMYUAVCI-MFYODDQASA-N 2 0 405.586 4.449 20 0 HIADRP CC(C)c1nc(C2CC[NH+](Cc3ccccc3N(C)C3CC[NH+](C)CC3)CC2)no1 ZINC000513069177 921524990 /nfs/dbraw/zinc/52/49/90/921524990.db2.gz MONHPQYUGHXPKW-UHFFFAOYSA-N 2 0 411.594 4.103 20 0 HIADRP C[C@@H](NC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1)[C@@H](c1ccccc1)[NH+](C)C ZINC000500574463 909938230 /nfs/dbraw/zinc/93/82/30/909938230.db2.gz NSKRQYCACNEXRG-RQJJNDFQSA-N 2 0 400.611 4.020 20 0 HIADRP C[C@H](NC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1)[C@@H](c1ccccc1)[NH+](C)C ZINC000500574461 909938472 /nfs/dbraw/zinc/93/84/72/909938472.db2.gz NSKRQYCACNEXRG-OZRWQMGGSA-N 2 0 400.611 4.020 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC(CCC[NH+](C)C)CC1 ZINC000500818904 910101492 /nfs/dbraw/zinc/10/14/92/910101492.db2.gz RRUPYXZBELHBLX-OAQYLSRUSA-N 2 0 414.638 4.324 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNC(=O)NCc2ccc(C[NH+](C)C)cc2)C1 ZINC000500848018 910122286 /nfs/dbraw/zinc/12/22/86/910122286.db2.gz HHHFVUKTPFQGOZ-OYRHEFFESA-N 2 0 422.617 4.226 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1ccccc1 ZINC000501023034 910241366 /nfs/dbraw/zinc/24/13/66/910241366.db2.gz LTSFZAAVJNLJDQ-VXKWHMMOSA-N 2 0 414.981 4.079 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)CC1 ZINC000501031044 910248312 /nfs/dbraw/zinc/24/83/12/910248312.db2.gz JDYPARWSWZKVGD-JOCHJYFZSA-N 2 0 421.029 4.240 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000501049276 910259588 /nfs/dbraw/zinc/25/95/88/910259588.db2.gz ASFQRPFYHVQPMW-DENIHFKCSA-N 2 0 421.029 4.288 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1)c1ccsc1 ZINC000501090724 910289203 /nfs/dbraw/zinc/28/92/03/910289203.db2.gz GLQMYXDCDLHIEX-NRFANRHFSA-N 2 0 418.607 4.030 20 0 HIADRP COc1cccc(-c2nc(C[NH+]3CCC(CCC[NH+](C)C)CC3)cs2)c1OC ZINC000501770948 910825260 /nfs/dbraw/zinc/82/52/60/910825260.db2.gz RJQKMQNPVQCCFT-UHFFFAOYSA-N 2 0 403.592 4.381 20 0 HIADRP CCC[NH+]1CCC(NC(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)CC1 ZINC000502087022 911026699 /nfs/dbraw/zinc/02/66/99/911026699.db2.gz LDVNRXMRBMBLAR-UHFFFAOYSA-N 2 0 408.590 4.089 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccccc2NC2CC[NH+](C)CC2)cc1)C1CC1 ZINC000502628763 911657960 /nfs/dbraw/zinc/65/79/60/911657960.db2.gz XBPMQDQSZRZQOS-UHFFFAOYSA-N 2 0 406.574 4.429 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)[NH+]2CCCC2)o1 ZINC000502781380 911805324 /nfs/dbraw/zinc/80/53/24/911805324.db2.gz LVCVENIZEXYACU-PZJWPPBQSA-N 2 0 412.578 4.154 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000502966317 911948189 /nfs/dbraw/zinc/94/81/89/911948189.db2.gz UCJZRUBLVLNICM-FGZHOGPDSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000503036296 912005608 /nfs/dbraw/zinc/00/56/08/912005608.db2.gz CEBPBPPPYVJJRW-OYRHEFFESA-N 2 0 414.638 4.049 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000503036294 912006692 /nfs/dbraw/zinc/00/66/92/912006692.db2.gz CEBPBPPPYVJJRW-NHCUHLMSSA-N 2 0 414.638 4.049 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NCC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000503089968 912061131 /nfs/dbraw/zinc/06/11/31/912061131.db2.gz XDZPDAWLDGJWRD-NRFANRHFSA-N 2 0 422.617 4.327 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)CCCC1)c1ccccc1 ZINC000503107488 912073355 /nfs/dbraw/zinc/07/33/55/912073355.db2.gz MSCMTNNNIOOUCZ-IRLDBZIGSA-N 2 0 424.589 4.379 20 0 HIADRP COc1cc(Cl)c(C)cc1NC(=O)CC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000513325753 921714235 /nfs/dbraw/zinc/71/42/35/921714235.db2.gz KSHUEJODBCHITL-UHFFFAOYSA-N 2 0 407.986 4.372 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1)c1ccccc1 ZINC000503141513 912102730 /nfs/dbraw/zinc/10/27/30/912102730.db2.gz SKZFVMMJRZEJSK-TZIWHRDSSA-N 2 0 412.578 4.235 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1)c1ccccc1 ZINC000503151198 912116383 /nfs/dbraw/zinc/11/63/83/912116383.db2.gz JUXYCNQZSGDCRH-AZUAARDMSA-N 2 0 414.619 4.314 20 0 HIADRP CCOc1cc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc(Br)c1O ZINC000506336307 914949916 /nfs/dbraw/zinc/94/99/16/914949916.db2.gz DDZQZAAEAQBYJB-UHFFFAOYSA-N 2 0 419.363 4.439 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCCCn2nnc(-c3ccccc3)n2)C1 ZINC000506475371 915076698 /nfs/dbraw/zinc/07/66/98/915076698.db2.gz VUYCTXFBAUCMEF-FCHUYYIVSA-N 2 0 410.610 4.097 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCCCn2nnc(-c3ccccc3)n2)C1 ZINC000506475374 915077732 /nfs/dbraw/zinc/07/77/32/915077732.db2.gz VUYCTXFBAUCMEF-YADHBBJMSA-N 2 0 410.610 4.097 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)[NH+]2CCCC2)o1 ZINC000506632034 915299235 /nfs/dbraw/zinc/29/92/35/915299235.db2.gz GDEWELALUXMHPS-FCEUIQTBSA-N 2 0 416.610 4.021 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)C1 ZINC000506862980 915651728 /nfs/dbraw/zinc/65/17/28/915651728.db2.gz JDULBFJZEGJCMB-CQOQZXRMSA-N 2 0 412.622 4.120 20 0 HIADRP CCOc1cc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)ccc1OCC(F)(F)F ZINC000506864776 915653314 /nfs/dbraw/zinc/65/33/14/915653314.db2.gz BWNHMBKHKGACJY-UHFFFAOYSA-N 2 0 400.485 4.334 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC1 ZINC000506865211 915653998 /nfs/dbraw/zinc/65/39/98/915653998.db2.gz DRRJGLQXCRDKIO-UHFFFAOYSA-N 3 0 400.655 4.161 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000506940284 915745504 /nfs/dbraw/zinc/74/55/04/915745504.db2.gz NZBWQECCDOGFRO-FGZHOGPDSA-N 2 0 414.638 4.324 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CCC[NH+](CCCc3ccccc3)CC2)cc1)C1CC1 ZINC000507164285 915902419 /nfs/dbraw/zinc/90/24/19/915902419.db2.gz WTRHHFMWNLNUNA-UHFFFAOYSA-N 2 0 419.613 4.452 20 0 HIADRP CCOc1cc(C[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc(Cl)c1O ZINC000507407161 916176836 /nfs/dbraw/zinc/17/68/36/916176836.db2.gz SKIDXRNKBWFDMS-CALCHBBNSA-N 2 0 418.965 4.343 20 0 HIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)CC1 ZINC000507625652 916383943 /nfs/dbraw/zinc/38/39/43/916383943.db2.gz PJQYJFSIIMXXDK-YHYVQYDKSA-N 2 0 411.569 4.032 20 0 HIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)CC1 ZINC000507625651 916384298 /nfs/dbraw/zinc/38/42/98/916384298.db2.gz PJQYJFSIIMXXDK-WTNAPCKOSA-N 2 0 411.569 4.032 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)c1 ZINC000507811832 916603790 /nfs/dbraw/zinc/60/37/90/916603790.db2.gz YQROLEUXCBESDV-HXUWFJFHSA-N 2 0 406.357 4.062 20 0 HIADRP O=C(CC[NH+]1CCC(C[NH+]2CCCC2)CC1)Nc1ccccc1C(=O)c1ccccc1 ZINC000507863646 916697473 /nfs/dbraw/zinc/69/74/73/916697473.db2.gz WBXLYXWRSUCNMO-UHFFFAOYSA-N 2 0 419.569 4.054 20 0 HIADRP COc1cccc([C@@H]2[C@H]([NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CCN2C2CC2)c1 ZINC000508696303 917456876 /nfs/dbraw/zinc/45/68/76/917456876.db2.gz JLBLCDKXWHZDNR-RLXGFUINSA-N 2 0 419.613 4.473 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(-c3cnn(C)c3)s2)C[C@H](C)O1 ZINC000509487798 918133842 /nfs/dbraw/zinc/13/38/42/918133842.db2.gz SUFBBWCYXYXPNB-HDICACEKSA-N 2 0 410.587 4.048 20 0 HIADRP Cn1c2ccc(C[NH2+]Cc3ccccc3-c3ccc(C[NH+](C)C)cc3)cc2oc1=O ZINC000509831897 918432528 /nfs/dbraw/zinc/43/25/28/918432528.db2.gz KOTHMOLRWRISFF-UHFFFAOYSA-N 2 0 401.510 4.150 20 0 HIADRP C[C@@H]1C[C@H](CCNC(=O)C2CC[NH+](Cc3ccccc3)CC2)C[N@@H+]1Cc1ccccc1 ZINC000510165543 918716664 /nfs/dbraw/zinc/71/66/64/918716664.db2.gz INNHAJYVJONTNG-RDGATRHJSA-N 2 0 419.613 4.316 20 0 HIADRP Cc1cccc([C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c2cccc(F)c2)c1 ZINC000510649452 919090612 /nfs/dbraw/zinc/09/06/12/919090612.db2.gz IEBFHXPZXLIBLS-RUZDIDTESA-N 2 0 419.544 4.305 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NCC(C)(C)[NH+]2CCc3ccccc3C2)cc1)C1CC1 ZINC000510783999 919246553 /nfs/dbraw/zinc/24/65/53/919246553.db2.gz OYFNCRLSCFZHJA-UHFFFAOYSA-N 2 0 405.586 4.238 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NCC2([NH+]3CCSCC3)CCCC2)cc1 ZINC000510789723 919257930 /nfs/dbraw/zinc/25/79/30/919257930.db2.gz IBZLRJDGBZRLDV-UHFFFAOYSA-N 2 0 403.636 4.010 20 0 HIADRP C[C@@H](NC(=O)NCC(C)(C)[NH2+][C@@H](C)c1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511265003 919862997 /nfs/dbraw/zinc/86/29/97/919862997.db2.gz JGCLCGBEKFZPDO-DYXWJJEUSA-N 2 0 400.611 4.068 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)N[C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511294368 919890081 /nfs/dbraw/zinc/89/00/81/919890081.db2.gz QUYXOVQDSMEQOF-UXHICEINSA-N 2 0 416.610 4.182 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)c1 ZINC000511379198 919980659 /nfs/dbraw/zinc/98/06/59/919980659.db2.gz PJVUMLMOKSNBRM-BJKOFHAPSA-N 2 0 416.009 4.343 20 0 HIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)cc1 ZINC000511394043 920004310 /nfs/dbraw/zinc/00/43/10/920004310.db2.gz AOSVCRNGUMVCNC-ZEQRLZLVSA-N 2 0 416.009 4.343 20 0 HIADRP C[NH+](C)Cc1ccc(C(=O)N2CCC[N@H+](Cc3ccc(C(F)(F)F)cc3)CC2)cc1 ZINC000511498114 920110980 /nfs/dbraw/zinc/11/09/80/920110980.db2.gz ITBNHJGDTCEPBG-UHFFFAOYSA-N 2 0 419.491 4.115 20 0 HIADRP O=C(NC[C@H]1CCCC[N@@H+]1Cc1ccccc1)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000511962923 920726866 /nfs/dbraw/zinc/72/68/66/920726866.db2.gz YRNCKLDIQSAQSE-XMMPIXPASA-N 2 0 423.626 4.020 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NCC2CC[NH+](Cc3cccs3)CC2)cc1)C1CC1 ZINC000512059329 920828087 /nfs/dbraw/zinc/82/80/87/920828087.db2.gz GALSIYHALBWYAD-UHFFFAOYSA-N 2 0 411.615 4.374 20 0 HIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)sc1Br ZINC000512135808 920882557 /nfs/dbraw/zinc/88/25/57/920882557.db2.gz OXLZGGAQFCEVHC-MRXNPFEDSA-N 2 0 422.436 4.417 20 0 HIADRP CCOc1ccccc1NC(=O)CC[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512284830 921039311 /nfs/dbraw/zinc/03/93/11/921039311.db2.gz DSRMCAFIKITLNW-VWLOTQADSA-N 2 0 407.558 4.012 20 0 HIADRP C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512318374 921069903 /nfs/dbraw/zinc/06/99/03/921069903.db2.gz OODZVCCZIQIQIK-ZWKOTPCHSA-N 2 0 403.998 4.187 20 0 HIADRP Cc1ccc(NC(=O)COc2ccc(CC[NH2+][C@@H]3CC[N@@H+](C)[C@@H]4CCC[C@H]43)cc2)cc1 ZINC000513703490 922021556 /nfs/dbraw/zinc/02/15/56/922021556.db2.gz WKCQJVGEAZAZQP-ISJGIBHGSA-N 2 0 421.585 4.017 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)c(C)c1OC ZINC000514089360 922411875 /nfs/dbraw/zinc/41/18/75/922411875.db2.gz PARYZQDSJKYRER-BJLQDIEVSA-N 2 0 412.574 4.472 20 0 HIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(NC(=O)CCCOc3ccccc3)cc2)[C@@H]2CCC[C@@H]21 ZINC000514094651 922419085 /nfs/dbraw/zinc/41/90/85/922419085.db2.gz NSEUPSXHXVSNHZ-SDHOMARFSA-N 2 0 421.585 4.447 20 0 HIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccc2c(c1)OCCO2 ZINC000514682382 922752186 /nfs/dbraw/zinc/75/21/86/922752186.db2.gz IXFCWJBJRPRHEN-NFBKMPQASA-N 2 0 422.569 4.037 20 0 HIADRP COc1ccccc1[C@H](C)NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000514962758 922856114 /nfs/dbraw/zinc/85/61/14/922856114.db2.gz FKQIGGOGMKSRTJ-PMACEKPBSA-N 2 0 409.574 4.037 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1)c1ccccc1 ZINC000515290613 923038294 /nfs/dbraw/zinc/03/82/94/923038294.db2.gz AGTYZKNZWFWFLN-RTWAWAEBSA-N 2 0 414.619 4.267 20 0 HIADRP C[C@@H](CNC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC000515521739 923151487 /nfs/dbraw/zinc/15/14/87/923151487.db2.gz UBSUNOOZJZCZSX-BHIFYINESA-N 2 0 407.602 4.317 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(=O)Nc1ccc(F)cc1F ZINC000515756203 923329854 /nfs/dbraw/zinc/32/98/54/923329854.db2.gz QPBTZOIEFPYKOP-IAGOWNOFSA-N 2 0 401.501 4.314 20 0 HIADRP CC(C)[C@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)[N@@H+]1CCc2ccccc2C1 ZINC000516843435 923915998 /nfs/dbraw/zinc/91/59/98/923915998.db2.gz IHACVNNRMKAMJL-VWLOTQADSA-N 2 0 405.586 4.095 20 0 HIADRP CC(C)[N@@H+]1CCC[C@H](CNC(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)C1 ZINC000517140153 924021546 /nfs/dbraw/zinc/02/15/46/924021546.db2.gz DMCZIGUQUCJADN-YPAWHYETSA-N 2 0 414.638 4.084 20 0 HIADRP CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(CC)Cc2ccc(C[NH+](C)C)cc2)C1 ZINC000517703238 926803783 /nfs/dbraw/zinc/80/37/83/926803783.db2.gz RYJOWRRFTBTDQK-FQEVSTJZSA-N 2 0 402.627 4.180 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)c2cccc(C[NH+]3CCCC3)c2)c2ccccc2)CC1 ZINC000517800906 926842481 /nfs/dbraw/zinc/84/24/81/926842481.db2.gz OBJIQSYZNKAIAY-RUZDIDTESA-N 2 0 405.586 4.485 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2c[nH]nc2-c2ccc(Cl)cc2)[C@H](c2ccccc2)C1 ZINC000518767811 927483113 /nfs/dbraw/zinc/48/31/13/927483113.db2.gz SJMTWCJGIOFTEL-QHCPKHFHSA-N 2 0 423.992 4.199 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc(F)cc1F ZINC000518807793 927505221 /nfs/dbraw/zinc/50/52/21/927505221.db2.gz MMTKSZWDJRLRAI-QFIPXVFZSA-N 2 0 401.501 4.031 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+]Cc1ccc(-c2ccc(Br)cc2)o1 ZINC000518981153 927672112 /nfs/dbraw/zinc/67/21/12/927672112.db2.gz LRRPPGWOVGKXPF-SFHVURJKSA-N 2 0 407.352 4.036 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)c2ccccc2)CC1 ZINC000520112110 928318974 /nfs/dbraw/zinc/31/89/74/928318974.db2.gz CHEZYRNECZNHNH-SANMLTNESA-N 2 0 419.613 4.488 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000520215261 928393388 /nfs/dbraw/zinc/39/33/88/928393388.db2.gz TYWPCRJBQGQLBF-HXUWFJFHSA-N 2 0 416.009 4.282 20 0 HIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cn4ccc(Br)cc4n3)CC2)CC1 ZINC000520462434 928579538 /nfs/dbraw/zinc/57/95/38/928579538.db2.gz PUGCVGYKRDCDNL-UHFFFAOYSA-N 2 0 405.384 4.230 20 0 HIADRP O=C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000520782644 928815451 /nfs/dbraw/zinc/81/54/51/928815451.db2.gz ZHBGTHMWHIREHN-YADHBBJMSA-N 2 0 419.013 4.137 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccccc3OC3CCCC3)cc2)CC1 ZINC000520947988 928885657 /nfs/dbraw/zinc/88/56/57/928885657.db2.gz KCKIJFBUHKBWNL-UHFFFAOYSA-N 2 0 407.602 4.435 20 0 HIADRP C[NH+](C)Cc1ccc(C(=O)NCCCC[NH+]2CCC(Cc3ccccc3)CC2)cc1 ZINC000521038284 928951259 /nfs/dbraw/zinc/95/12/59/928951259.db2.gz ATOZEZAVKWZTNM-UHFFFAOYSA-N 2 0 407.602 4.213 20 0 HIADRP CC[N@@H+]1CCCC[C@@H]1C(=O)N1CCC([NH+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000524594997 929704886 /nfs/dbraw/zinc/70/48/86/929704886.db2.gz DBVTXRJWOCCRPJ-HXUWFJFHSA-N 2 0 411.512 4.003 20 0 HIADRP O=C(NC[C@H]1CCC[N@@H+]1CC1CCCCC1)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000524638223 929749266 /nfs/dbraw/zinc/74/92/66/929749266.db2.gz IVKXJGKNDFRDPI-HSZRJFAPSA-N 2 0 415.647 4.010 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000524886880 929873459 /nfs/dbraw/zinc/87/34/59/929873459.db2.gz SHVXMIVWGCIDPE-WIOPSUGQSA-N 2 0 420.601 4.130 20 0 HIADRP C[C@@H]1C[N@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC[C@H]1c1ccccc1 ZINC000525122900 930048863 /nfs/dbraw/zinc/04/88/63/930048863.db2.gz PYGUGZDEVDALCA-PXDATVDWSA-N 2 0 405.586 4.024 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000525402565 930220733 /nfs/dbraw/zinc/22/07/33/930220733.db2.gz PKYBYSZHTJPOOH-DNVJHFABSA-N 2 0 414.638 4.051 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)[C@H]2CCCC[NH+]2Cc2ccccc2)[C@@H]1c1cccs1 ZINC000530820765 930831773 /nfs/dbraw/zinc/83/17/73/930831773.db2.gz UNLUDJNQOWQQJG-MQSCRBSSSA-N 2 0 411.615 4.302 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ccc(Br)cc3)CC2)CC1 ZINC000530952653 930866676 /nfs/dbraw/zinc/86/66/76/930866676.db2.gz CBPHKMOMSHZISH-UHFFFAOYSA-N 2 0 408.428 4.077 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3cnc(-c4ccccn4)s3)CC2)c1 ZINC000531240162 930978471 /nfs/dbraw/zinc/97/84/71/930978471.db2.gz OOHXJKCIQUAARY-UHFFFAOYSA-N 2 0 421.614 4.206 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)Nc2cccc(C[NH+]3CCSCC3)c2C)CC1 ZINC000531443821 931059394 /nfs/dbraw/zinc/05/93/94/931059394.db2.gz QJCDCXSEGZINCQ-UHFFFAOYSA-N 2 0 424.614 4.102 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]CCc2coc(-c3ccc(F)cc3)n2)CC1 ZINC000531532384 931095397 /nfs/dbraw/zinc/09/53/97/931095397.db2.gz VXYYELBNYKTGKS-UHFFFAOYSA-N 2 0 422.548 4.345 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cc(OC)nc3ccccc23)CC1 ZINC000531785720 931196548 /nfs/dbraw/zinc/19/65/48/931196548.db2.gz ZXDMRCBIOQAUIN-UHFFFAOYSA-N 2 0 404.558 4.065 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1cccc(OCC(F)F)c1)C1CC[NH+](C)CC1 ZINC000531848115 931218974 /nfs/dbraw/zinc/21/89/74/931218974.db2.gz CLOYQUCHLUGYFV-UHFFFAOYSA-N 2 0 403.517 4.151 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1ccc(S(C)(=O)=O)cc1 ZINC000531946365 931258566 /nfs/dbraw/zinc/25/85/66/931258566.db2.gz FDAWRMVBRYPDRB-RTBURBONSA-N 2 0 400.588 4.315 20 0 HIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CC(=O)N(C)Cc2ccccc2Cl)c1 ZINC000531959242 931265898 /nfs/dbraw/zinc/26/58/98/931265898.db2.gz VDLWZOZCGMXZRQ-SFHVURJKSA-N 2 0 401.982 4.319 20 0 HIADRP Cc1ccccc1CN1CCC([NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC1 ZINC000532107591 931315104 /nfs/dbraw/zinc/31/51/04/931315104.db2.gz YAGIAOCGUMUKJT-UHFFFAOYSA-N 2 0 420.645 4.280 20 0 HIADRP Cc1ccccc1C1(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)CCOCC1 ZINC000532107390 931315272 /nfs/dbraw/zinc/31/52/72/931315272.db2.gz LIMRZGASOYHDTI-UHFFFAOYSA-N 2 0 421.629 4.363 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(Br)cc1 ZINC000532194106 931344587 /nfs/dbraw/zinc/34/45/87/931344587.db2.gz AJHCPOZWVUGEQY-KRWDZBQOSA-N 2 0 402.380 4.047 20 0 HIADRP CN(c1ccccc1C[NH2+]CCc1nc(-c2ccncc2)cs1)C1CC[NH+](C)CC1 ZINC000532358445 931407564 /nfs/dbraw/zinc/40/75/64/931407564.db2.gz CYYLLOBQHFGXAD-UHFFFAOYSA-N 2 0 421.614 4.068 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@@H](c1ccco1)N1CCCCC1)C1CC[NH+](C)CC1 ZINC000532361650 931409247 /nfs/dbraw/zinc/40/92/47/931409247.db2.gz IENKXAUYSVAZEG-DEOSSOPVSA-N 2 0 410.606 4.127 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@H](c1cccs1)N1CCCC1)C1CC[NH+](C)CC1 ZINC000532361504 931409498 /nfs/dbraw/zinc/40/94/98/931409498.db2.gz VNPZHBBQZWXJAH-HSZRJFAPSA-N 2 0 412.647 4.205 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C[C@H](c1ccccc1Cl)N1CCCC1 ZINC000532461738 931445808 /nfs/dbraw/zinc/44/58/08/931445808.db2.gz QNXDIZZOTZSHDW-CTUHWIOQSA-N 2 0 413.009 4.372 20 0 HIADRP C[NH+](C)CCC1CC[NH+](CC(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)CC1 ZINC000532486446 931457087 /nfs/dbraw/zinc/45/70/87/931457087.db2.gz UMUKOOQVHCJJEK-DEOSSOPVSA-N 2 0 413.993 4.209 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]C3CCC(c4ccccc4)CC3)c2)C1 ZINC000532514919 931470504 /nfs/dbraw/zinc/47/05/04/931470504.db2.gz WQQUEWMLBCXBAT-OADZCNSWSA-N 2 0 405.586 4.200 20 0 HIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccc2c(c1)CCC(=O)N2 ZINC000532549196 931518793 /nfs/dbraw/zinc/51/87/93/931518793.db2.gz DAIVKRKKBQELJT-HXUWFJFHSA-N 2 0 421.585 4.293 20 0 HIADRP O=C(Nc1ccc(OCC[NH+]2CCCCC2)cc1)N1CCC([NH+]2CCCCC2)CC1 ZINC000532860452 931669639 /nfs/dbraw/zinc/66/96/39/931669639.db2.gz LUHHLFMPVIIVBT-UHFFFAOYSA-N 2 0 414.594 4.034 20 0 HIADRP CN(c1ccccc1CNc1ccc(CC[NH+]2CCCC2)cc1)C1CC[NH+](C)CC1 ZINC000533209991 931809419 /nfs/dbraw/zinc/80/94/19/931809419.db2.gz ILTHXBLTZFKKLK-UHFFFAOYSA-N 2 0 406.618 4.467 20 0 HIADRP O=C(CC[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1)N[C@H](c1cccs1)c1ccccc1 ZINC000533293222 931830967 /nfs/dbraw/zinc/83/09/67/931830967.db2.gz CGCNSCAOVLQLEU-URXFXBBRSA-N 2 0 411.615 4.294 20 0 HIADRP CC(C)[C@H](NC(=O)N(C)[C@@H]1CCCC[C@@H]1[N@H+](C)C1CCN(C)CC1)c1ccccc1 ZINC000533663241 931956423 /nfs/dbraw/zinc/95/64/23/931956423.db2.gz WKWAYJVJJZFCLD-VXNXHJTFSA-N 2 0 414.638 4.362 20 0 HIADRP Clc1ccc(-n2cc(CNCc3ccc(C[NH+]4CCCC4)cc3)nn2)c(Cl)c1 ZINC000535185964 933001250 /nfs/dbraw/zinc/00/12/50/933001250.db2.gz QAGRLABLEKKPAP-UHFFFAOYSA-N 2 0 416.356 4.460 20 0 HIADRP COc1ccc(NC(=O)CC[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000535677310 933327658 /nfs/dbraw/zinc/32/76/58/933327658.db2.gz WGBDRUVDMBKIJV-UHFFFAOYSA-N 2 0 407.558 4.012 20 0 HIADRP CCO[C@H]1C[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C12CCCC2 ZINC000537293354 933700966 /nfs/dbraw/zinc/70/09/66/933700966.db2.gz ODIWGRHYDAWTJJ-RPWUZVMVSA-N 2 0 416.606 4.004 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccncc2)C1 ZINC000537324939 933716545 /nfs/dbraw/zinc/71/65/45/933716545.db2.gz DNZJAIYPUBNCRS-NRFANRHFSA-N 2 0 403.574 4.392 20 0 HIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc(OC)c1OC ZINC000563228269 945157456 /nfs/dbraw/zinc/15/74/56/945157456.db2.gz UDTKFCFGUJNPPZ-KRWDZBQOSA-N 2 0 414.546 4.036 20 0 HIADRP COc1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1OCc1ccccc1 ZINC000537621093 938336533 /nfs/dbraw/zinc/33/65/33/938336533.db2.gz VPYOFEXYNSMGCK-UHFFFAOYSA-N 2 0 424.585 4.351 20 0 HIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3cccc(OCCCc4ccccc4)c3)C2)CC1 ZINC000537658927 938348568 /nfs/dbraw/zinc/34/85/68/938348568.db2.gz HQTQXGMTSZBMCR-SANMLTNESA-N 2 0 421.629 4.299 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H](O)CO[C@H]1CCCc2ccccc21 ZINC000537841879 938387022 /nfs/dbraw/zinc/38/70/22/938387022.db2.gz PIRCDXWRKMDDEF-AHWVRZQESA-N 2 0 423.601 4.075 20 0 HIADRP COc1ccc(OCc2nc(C[NH2+]CC3CCN(c4cc[nH+]cc4)CC3)cs2)cc1 ZINC000537869345 938395187 /nfs/dbraw/zinc/39/51/87/938395187.db2.gz NINQWKLZXRJNBP-UHFFFAOYSA-N 2 0 424.570 4.132 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000537955452 938432144 /nfs/dbraw/zinc/43/21/44/938432144.db2.gz WWQAUBXDMBJCMY-MUEKUWCCSA-N 2 0 412.549 4.433 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000537955454 938432565 /nfs/dbraw/zinc/43/25/65/938432565.db2.gz WWQAUBXDMBJCMY-RIEVBORMSA-N 2 0 412.549 4.433 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc(F)cc1Cl ZINC000537971112 938441019 /nfs/dbraw/zinc/44/10/19/938441019.db2.gz ZDWNVOVQKZKVGT-INIZCTEOSA-N 2 0 403.929 4.156 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1 ZINC000537992168 938453859 /nfs/dbraw/zinc/45/38/59/938453859.db2.gz YUXFITAMYWZLEG-PXDATVDWSA-N 2 0 405.586 4.313 20 0 HIADRP COc1ccccc1[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)C1CCCC1 ZINC000538115582 938506214 /nfs/dbraw/zinc/50/62/14/938506214.db2.gz AKPSRRSPZMPGHJ-XMMPIXPASA-N 2 0 415.622 4.143 20 0 HIADRP CC[NH+]1CCC(NC(=O)Nc2ccc(C[N@H+](C[C@H]3CCCCO3)C(C)C)cc2)CC1 ZINC000538248561 938573749 /nfs/dbraw/zinc/57/37/49/938573749.db2.gz RABWPMALJWEREE-HSZRJFAPSA-N 2 0 416.610 4.072 20 0 HIADRP C[C@H](CS(=O)(=O)c1ccccc1)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000538274784 938580734 /nfs/dbraw/zinc/58/07/34/938580734.db2.gz GVWHADAXTUWDKJ-WOJBJXKFSA-N 2 0 400.588 4.013 20 0 HIADRP C[C@@H](CCc1ccc2c(c1)OCO2)[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538275576 938581144 /nfs/dbraw/zinc/58/11/44/938581144.db2.gz HKSVJVPWVYNNGR-GHTZIAJQSA-N 2 0 408.542 4.314 20 0 HIADRP C[C@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2sccc2C1 ZINC000538276822 938581619 /nfs/dbraw/zinc/58/16/19/938581619.db2.gz SHQWQXGGCBVZSV-NQIIRXRSSA-N 2 0 411.615 4.073 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c(Br)c1 ZINC000538397092 938610680 /nfs/dbraw/zinc/61/06/80/938610680.db2.gz PNHJUVDYPCUTOV-OAHLLOKOSA-N 2 0 407.352 4.249 20 0 HIADRP Cc1nn(-c2ccccc2)c(C)c1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000538501721 938637005 /nfs/dbraw/zinc/63/70/05/938637005.db2.gz AZHIDTFDRHSFLS-IBGZPJMESA-N 2 0 418.585 4.297 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C ZINC000538547311 938645936 /nfs/dbraw/zinc/64/59/36/938645936.db2.gz YUCUAWGIHJHFSM-KXBFYZLASA-N 2 0 420.598 4.001 20 0 HIADRP c1cc(C[N@@H+]2CCC[C@H]2C2CCOCC2)ccc1C[NH+]1CCC[C@@H]1C1CCOCC1 ZINC000538627231 938666312 /nfs/dbraw/zinc/66/63/12/938666312.db2.gz COCAQABJIAHWGP-WMPKNSHKSA-N 2 0 412.618 4.469 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cnc(-c4ccsc4)s3)CC2)CC1 ZINC000538723632 938691843 /nfs/dbraw/zinc/69/18/43/938691843.db2.gz QFKOPSMDNKOMDZ-UHFFFAOYSA-N 2 0 418.676 4.500 20 0 HIADRP CCCCCN(C)c1ccc(F)cc1C[N@@H+]1CC[C@@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000538724780 938692720 /nfs/dbraw/zinc/69/27/20/938692720.db2.gz BBJNCVFCMQQXDP-HSZRJFAPSA-N 2 0 404.618 4.052 20 0 HIADRP CCCCCN(C)c1ccc(F)cc1C[N@@H+]1CC[C@H](N2CC[NH+](C(C)C)CC2)C1 ZINC000538724781 938692790 /nfs/dbraw/zinc/69/27/90/938692790.db2.gz BBJNCVFCMQQXDP-QHCPKHFHSA-N 2 0 404.618 4.052 20 0 HIADRP C[NH+](C)CCOC1CC[NH+](Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 ZINC000538732151 938695974 /nfs/dbraw/zinc/69/59/74/938695974.db2.gz NVFIWFYHQIXYQJ-UHFFFAOYSA-N 2 0 415.965 4.135 20 0 HIADRP FC(F)(F)c1ccn(-c2ccc(C[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2)n1 ZINC000538795423 938714039 /nfs/dbraw/zinc/71/40/39/938714039.db2.gz AGRXDSFIVWPTDL-XLIONFOSSA-N 2 0 404.480 4.340 20 0 HIADRP COCCc1nc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)s1 ZINC000538867700 938728220 /nfs/dbraw/zinc/72/82/20/938728220.db2.gz PFXTXNFIXDWDED-KURKYZTESA-N 2 0 417.619 4.100 20 0 HIADRP c1cncc(CC2CC[NH+](CCCC[NH+]3CCC(Cc4cccnc4)CC3)CC2)c1 ZINC000538943535 938742663 /nfs/dbraw/zinc/74/26/63/938742663.db2.gz PXCCZERDOLMPBB-UHFFFAOYSA-N 2 0 406.618 4.466 20 0 HIADRP Cc1cccc(Cl)c1NC(=O)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538944935 938743314 /nfs/dbraw/zinc/74/33/14/938743314.db2.gz UVUUBDLRPDPGAE-UHFFFAOYSA-N 2 0 400.954 4.220 20 0 HIADRP Cc1ccc(Cl)cc1NC(=O)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538946991 938744751 /nfs/dbraw/zinc/74/47/51/938744751.db2.gz NSWAGSDOKRYFKQ-UHFFFAOYSA-N 2 0 400.954 4.220 20 0 HIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000539043542 938780128 /nfs/dbraw/zinc/78/01/28/938780128.db2.gz VLVXWZOUEUACCY-SVFBPWRDSA-N 2 0 415.603 4.009 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H]2CCc3c2cc(Cl)cc3Br)ccn1 ZINC000539047293 938781772 /nfs/dbraw/zinc/78/17/72/938781772.db2.gz NAABWRUKBCQULH-GOSISDBHSA-N 2 0 424.770 4.215 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H]2CCc3c2cc(Cl)cc3Br)ccn1 ZINC000539047294 938781930 /nfs/dbraw/zinc/78/19/30/938781930.db2.gz NAABWRUKBCQULH-SFHVURJKSA-N 2 0 424.770 4.215 20 0 HIADRP C/C=C\COc1ccc(CC[C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000539060690 938787790 /nfs/dbraw/zinc/78/77/90/938787790.db2.gz ITUGWTNNMXOOGB-WCIIFKRRSA-N 2 0 400.607 4.320 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cnn1-c1cccc(Cl)c1 ZINC000539072664 938793930 /nfs/dbraw/zinc/79/39/30/938793930.db2.gz FIVFVDOXFPHPAW-FGTMMUONSA-N 2 0 404.986 4.374 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2nc3sc(C)c(C)c3c(N)n2)CC1 ZINC000539248571 938825498 /nfs/dbraw/zinc/82/54/98/938825498.db2.gz VXLYRURAFOFMRY-MRXNPFEDSA-N 2 0 419.639 4.022 20 0 HIADRP COc1ccccc1N1CC[C@H](C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C1 ZINC000539362908 938848780 /nfs/dbraw/zinc/84/87/80/938848780.db2.gz JLBQNCLJULXSTB-IFMALSPDSA-N 2 0 421.585 4.099 20 0 HIADRP CCCCNC(=O)c1ccc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000539394461 938854088 /nfs/dbraw/zinc/85/40/88/938854088.db2.gz SOYBRUROTXBQLQ-QHCPKHFHSA-N 2 0 421.585 4.294 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+]Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)CC1 ZINC000539517657 938872243 /nfs/dbraw/zinc/87/22/43/938872243.db2.gz QCSVJQFPRBXKDR-UHFFFAOYSA-N 2 0 409.357 4.119 20 0 HIADRP CN(c1ccccc1C[NH2+][C@H]1CCN(c2ccc(Cl)cc2)C1)C1CC[NH+](C)CC1 ZINC000539588474 938884142 /nfs/dbraw/zinc/88/41/42/938884142.db2.gz MOGVRAXZIIZPCA-NRFANRHFSA-N 2 0 413.009 4.239 20 0 HIADRP CN(c1ccccc1C[NH2+][C@@H]1CCN(c2ccc(Cl)cc2)C1)C1CC[NH+](C)CC1 ZINC000539588478 938884201 /nfs/dbraw/zinc/88/42/01/938884201.db2.gz MOGVRAXZIIZPCA-OAQYLSRUSA-N 2 0 413.009 4.239 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ccccc3OC(F)(F)F)CC2)CC1 ZINC000539823088 938946635 /nfs/dbraw/zinc/94/66/35/938946635.db2.gz PQOQNSIXLLGSOD-UHFFFAOYSA-N 2 0 413.528 4.213 20 0 HIADRP COC(=O)[C@H](C)Oc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000539825959 938946978 /nfs/dbraw/zinc/94/69/78/938946978.db2.gz ZTCPSUMJSFLOLT-NRFANRHFSA-N 2 0 422.569 4.115 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)NC[C@H](c3cccs3)[NH+](C)C)c2)CC1 ZINC000539872144 938962989 /nfs/dbraw/zinc/96/29/89/938962989.db2.gz VOXUJQNDZMJSAR-OAQYLSRUSA-N 2 0 414.619 4.447 20 0 HIADRP COc1ccc(-c2nc(C[N@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)co2)cc1 ZINC000540046087 939048310 /nfs/dbraw/zinc/04/83/10/939048310.db2.gz VIYNQAYYACAYKB-UHFFFAOYSA-N 2 0 406.530 4.484 20 0 HIADRP Cc1ccc(CN(C(=O)C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)C2CC2)cc1 ZINC000540047328 939048891 /nfs/dbraw/zinc/04/88/91/939048891.db2.gz KJTIFVVIXUITFU-UHFFFAOYSA-N 2 0 420.601 4.120 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H](CO)Cc1ccccc1C(F)(F)F ZINC000540161846 939097362 /nfs/dbraw/zinc/09/73/62/939097362.db2.gz YWFONWLKXPAWQZ-XQFWAAQXSA-N 2 0 420.519 4.357 20 0 HIADRP C[C@@H]([NH2+]CCc1nc2ccccc2n1C(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000540188795 939113329 /nfs/dbraw/zinc/11/33/29/939113329.db2.gz VLOPJPLVKMNIEY-MRXNPFEDSA-N 2 0 402.489 4.265 20 0 HIADRP CC[N@H+](CCC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(NC(C)=O)c2)CC1)CC(C)C ZINC000540194262 939119368 /nfs/dbraw/zinc/11/93/68/939119368.db2.gz DSMCKQIDQDBGSF-IBGZPJMESA-N 2 0 416.610 4.052 20 0 HIADRP CN(C)[C@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1c(F)cccc1F ZINC000540493077 939273917 /nfs/dbraw/zinc/27/39/17/939273917.db2.gz SDGKACMOSKNGLI-LEWJYISDSA-N 2 0 415.528 4.145 20 0 HIADRP C[N@H+](CCC(=O)NC[C@@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1)C1CCCCC1 ZINC000563662951 945243174 /nfs/dbraw/zinc/24/31/74/945243174.db2.gz HRAXJWONTSGJNU-HTAPYJJXSA-N 2 0 409.977 4.243 20 0 HIADRP C[C@@H](Nc1cccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000540790285 939373443 /nfs/dbraw/zinc/37/34/43/939373443.db2.gz YWVJBPSUPHYUAE-NJDAHSKKSA-N 2 0 411.590 4.409 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc(Br)ccc1F ZINC000540988145 939425804 /nfs/dbraw/zinc/42/58/04/939425804.db2.gz HEQCFPTXANSBEH-RDTXWAMCSA-N 2 0 407.327 4.006 20 0 HIADRP CC(C)S(=O)(=O)c1ccc(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000541060911 939445738 /nfs/dbraw/zinc/44/57/38/939445738.db2.gz WOWKPYUBUREVTJ-UHFFFAOYSA-N 2 0 415.603 4.002 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)cc1 ZINC000541206143 939485531 /nfs/dbraw/zinc/48/55/31/939485531.db2.gz LHWKGGVEUBSFTH-UHFFFAOYSA-N 2 0 419.491 4.033 20 0 HIADRP CCN1CC[C@H]([NH2+]Cc2cn(-c3cc[nH+]cc3)nc2C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000541377660 939500840 /nfs/dbraw/zinc/50/08/40/939500840.db2.gz HGVORXAXYJERIA-FCHUYYIVSA-N 2 0 413.928 4.293 20 0 HIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)N(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000541573545 939558515 /nfs/dbraw/zinc/55/85/15/939558515.db2.gz NCKHXQGVBGINTF-IEBWSBKVSA-N 2 0 413.528 4.066 20 0 HIADRP OC[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12)c1ccc(C(F)(F)F)cc1 ZINC000541882569 939649096 /nfs/dbraw/zinc/64/90/96/939649096.db2.gz ULGFQUCHISLPAL-NMIHRBCNSA-N 2 0 404.476 4.239 20 0 HIADRP OC[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1ccc(OC(F)(F)F)cc1 ZINC000541910815 939651900 /nfs/dbraw/zinc/65/19/00/939651900.db2.gz XSRBMTIPXOCCKV-SFHVURJKSA-N 2 0 414.512 4.123 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(F)c(Br)c1 ZINC000541913974 939652330 /nfs/dbraw/zinc/65/23/30/939652330.db2.gz FTCBWAREEFCMNT-DNVCBOLYSA-N 2 0 421.354 4.396 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3ccc(Br)cc32)C1 ZINC000541915106 939652740 /nfs/dbraw/zinc/65/27/40/939652740.db2.gz XYEKEPYSEHHFBS-UNMCSNQZSA-N 2 0 415.375 4.183 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)N[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)CC1 ZINC000542085863 939705661 /nfs/dbraw/zinc/70/56/61/939705661.db2.gz SHJSPZVWOAMGHJ-RBBKRZOGSA-N 2 0 406.659 4.183 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CCC[NH+](C3CCCC3)CC2)c1 ZINC000542361892 939807520 /nfs/dbraw/zinc/80/75/20/939807520.db2.gz VBPSRQKRNPNRLM-UHFFFAOYSA-N 2 0 405.586 4.409 20 0 HIADRP Fc1ccc([C@H]([NH2+]CCCN2CC[NH+](Cc3ccccc3)CC2)c2ccccc2)nc1 ZINC000542479551 939830092 /nfs/dbraw/zinc/83/00/92/939830092.db2.gz QNKYURAWLGSWHO-AREMUKBSSA-N 2 0 418.560 4.108 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](c2ccc(F)cc2)c2cccnc2)[C@H](c2ccccc2)C1 ZINC000542480291 939830437 /nfs/dbraw/zinc/83/04/37/939830437.db2.gz BBICUVBTAAWCEC-IZZNHLLZSA-N 2 0 418.560 4.279 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@@H](c2ccc(F)cc2)c2cccnc2)[C@H](c2ccccc2)C1 ZINC000542480292 939830542 /nfs/dbraw/zinc/83/05/42/939830542.db2.gz BBICUVBTAAWCEC-UIOOFZCWSA-N 2 0 418.560 4.279 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](CCCOc3ccc(C(C)(C)C)cc3)CC2)CC1 ZINC000542593879 939847218 /nfs/dbraw/zinc/84/72/18/939847218.db2.gz VQDMPNIIMGHBEA-UHFFFAOYSA-N 2 0 401.639 4.103 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N2CC[NH+](C)[C@H](C)[C@@H]2C)cc1)C[C@@H]1CCCCO1 ZINC000542731620 939857648 /nfs/dbraw/zinc/85/76/48/939857648.db2.gz UICQRWMHLJCLSI-QTEQDKRBSA-N 2 0 416.610 4.022 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cnn1-c1ccc(F)cc1 ZINC000542849009 939862794 /nfs/dbraw/zinc/86/27/94/939862794.db2.gz JALHYIHVIODYEX-HOYKHHGWSA-N 2 0 422.548 4.127 20 0 HIADRP COc1ccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccc(F)cc2)cc1 ZINC000542848308 939862913 /nfs/dbraw/zinc/86/29/13/939862913.db2.gz XNVNSLYCOXKRLE-AHWVRZQESA-N 2 0 420.528 4.280 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000543071636 939923564 /nfs/dbraw/zinc/92/35/64/939923564.db2.gz CFSIOMVALGTKKE-INIZCTEOSA-N 2 0 422.411 4.410 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]C3CC(c4cccc(Cl)c4)C3)c2)C1 ZINC000543108551 939948293 /nfs/dbraw/zinc/94/82/93/939948293.db2.gz IXGRXBMQXNMSSA-ZJOBEGKPSA-N 2 0 411.977 4.073 20 0 HIADRP Cc1ccccc1[C@H](CN1CCOCC1)[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000543411206 940057166 /nfs/dbraw/zinc/05/71/66/940057166.db2.gz QVNAVKXVZNUSRN-SANMLTNESA-N 2 0 407.602 4.144 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000543420681 940059891 /nfs/dbraw/zinc/05/98/91/940059891.db2.gz BXIUUANKQURJJW-RCZVLFRGSA-N 2 0 419.613 4.458 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1ccc(Oc2ccccc2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000543458810 940068964 /nfs/dbraw/zinc/06/89/64/940068964.db2.gz KSIKYFBGJFKNGV-QZNHQXDQSA-N 2 0 424.585 4.461 20 0 HIADRP COc1ccccc1-c1ccc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)cc1 ZINC000543619475 940134880 /nfs/dbraw/zinc/13/48/80/940134880.db2.gz SEKCKYGJVXHVQM-UHFFFAOYSA-N 2 0 407.602 4.212 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000544347451 940396910 /nfs/dbraw/zinc/39/69/10/940396910.db2.gz VXXRKKSLEZJHMJ-SFHVURJKSA-N 2 0 418.476 4.144 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000544366283 940403229 /nfs/dbraw/zinc/40/32/29/940403229.db2.gz USAIXYKFMACINQ-RUZDIDTESA-N 2 0 406.549 4.081 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COC(c1ccccc1)c1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544425721 940424039 /nfs/dbraw/zinc/42/40/39/940424039.db2.gz XVKVXLFXCYQJPJ-CVJWPJSTSA-N 2 0 422.613 4.396 20 0 HIADRP C[C@@H]1[NH+](Cc2cccc(C[N@@H+]3CCC4(CCOCC4)[C@@H]3C)c2)CCC12CCOCC2 ZINC000544549949 940476949 /nfs/dbraw/zinc/47/69/49/940476949.db2.gz NZTSCWZKCURXKQ-VXKWHMMOSA-N 2 0 412.618 4.469 20 0 HIADRP CCCCOc1ccc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)cc1OCC ZINC000544596443 940487007 /nfs/dbraw/zinc/48/70/07/940487007.db2.gz QXBDLCXBTDBVGE-UHFFFAOYSA-N 2 0 417.638 4.114 20 0 HIADRP CC[C@H]1CN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000546151400 940714794 /nfs/dbraw/zinc/71/47/94/940714794.db2.gz BWLJTTKOMSAAJF-VWLOTQADSA-N 2 0 405.586 4.022 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(N2CCOCC2)c1 ZINC000564007637 945345563 /nfs/dbraw/zinc/34/55/63/945345563.db2.gz KDGOFWWBGFDPBM-UPVQGACJSA-N 2 0 407.602 4.476 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)c1ccc(C[NH+]2CCCC2)cc1)c1cccc(OC)c1 ZINC000547757480 941074930 /nfs/dbraw/zinc/07/49/30/941074930.db2.gz GMORNXZKRCRLAY-DEOSSOPVSA-N 2 0 409.574 4.104 20 0 HIADRP Cc1nc(CN2CCC(C[NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)oc1C ZINC000548155256 941089411 /nfs/dbraw/zinc/08/94/11/941089411.db2.gz APZGYDWHALYKNK-RDPSFJRHSA-N 2 0 410.606 4.004 20 0 HIADRP O=C(c1ccccc1)N1CC[C@@H](C[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)C1 ZINC000548919263 941129118 /nfs/dbraw/zinc/12/91/18/941129118.db2.gz OQDXBKYHWLTXCX-IGKIAQTJSA-N 2 0 417.597 4.137 20 0 HIADRP C[NH+](C)C[C@H](NC(=O)NCc1ccccc1C[NH+]1CCCC1)c1ccc(Cl)cc1 ZINC000549104276 941159448 /nfs/dbraw/zinc/15/94/48/941159448.db2.gz QXAUYOMYIVMREK-QFIPXVFZSA-N 2 0 414.981 4.038 20 0 HIADRP CC[C@H](C(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[NH+](CC)CC ZINC000549617556 941201528 /nfs/dbraw/zinc/20/15/28/941201528.db2.gz UQTVJCVIZVTKPU-DOKCZXGGSA-N 2 0 406.014 4.491 20 0 HIADRP CC[C@@H](C(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[NH+](CC)CC ZINC000549617558 941201560 /nfs/dbraw/zinc/20/15/60/941201560.db2.gz UQTVJCVIZVTKPU-JYNUSOIKSA-N 2 0 406.014 4.491 20 0 HIADRP CC[N@H+](CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)[C@H](C)c1cccc(OC)c1 ZINC000549938455 941243738 /nfs/dbraw/zinc/24/37/38/941243738.db2.gz SNTRJEDOKYUZOV-OAQYLSRUSA-N 2 0 423.601 4.167 20 0 HIADRP CCCOc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000550269986 941306790 /nfs/dbraw/zinc/30/67/90/941306790.db2.gz DMBMUIBTTDBTSP-XMMPIXPASA-N 2 0 408.586 4.494 20 0 HIADRP COc1cc([C@@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)ccc1F ZINC000550883433 941378537 /nfs/dbraw/zinc/37/85/37/941378537.db2.gz ZNWSFCMCFZUQKN-KNQAVFIVSA-N 2 0 412.549 4.414 20 0 HIADRP C[C@H](c1ccc(F)cc1)N1CCC[C@@H]([NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1=O ZINC000551273336 941440833 /nfs/dbraw/zinc/44/08/33/941440833.db2.gz VXSJCGKBJOFMJR-IWVMGURDSA-N 2 0 423.576 4.378 20 0 HIADRP COc1ncc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1Cl ZINC000551530199 941496082 /nfs/dbraw/zinc/49/60/82/941496082.db2.gz OZEOGWWUDOGIOW-CABCVRRESA-N 2 0 406.933 4.046 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3c[nH]nc3-c3ccc(Cl)cc3)cc2)CC1 ZINC000551580466 941506173 /nfs/dbraw/zinc/50/61/73/941506173.db2.gz KTLGPDYJCDBKKJ-UHFFFAOYSA-N 2 0 410.949 4.493 20 0 HIADRP Cc1cc(OC[C@H](O)C[NH2+]Cc2ccc(C[NH+](C)C)cc2)c(C(C)C)cc1Cl ZINC000551999749 941565350 /nfs/dbraw/zinc/56/53/50/941565350.db2.gz AYZJGUUPZHKGPQ-HXUWFJFHSA-N 2 0 404.982 4.363 20 0 HIADRP O=C([C@H]1CCC[N@H+](Cc2ccccc2)C1)N1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000553124561 941836347 /nfs/dbraw/zinc/83/63/47/941836347.db2.gz ONKGHWRJTVJPMV-BDYUSTAISA-N 2 0 417.597 4.023 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)C[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000553497729 941896233 /nfs/dbraw/zinc/89/62/33/941896233.db2.gz HGLFZSONWPWYKO-LADGPHEKSA-N 2 0 416.569 4.302 20 0 HIADRP c1nc(-c2ccncc2)sc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000553856020 941984067 /nfs/dbraw/zinc/98/40/67/941984067.db2.gz OXYOHAJJZFKGBF-UHFFFAOYSA-N 2 0 422.598 4.366 20 0 HIADRP CC[NH+]1CCC(C[NH2+]Cc2cc(Br)ccc2OCc2ccccn2)CC1 ZINC000554585794 942172156 /nfs/dbraw/zinc/17/21/56/942172156.db2.gz IOKVGKHWILZABB-UHFFFAOYSA-N 2 0 418.379 4.245 20 0 HIADRP C[C@@H]([NH2+]C1CCN(C(=O)CCc2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554858693 942294339 /nfs/dbraw/zinc/29/43/39/942294339.db2.gz UOPQYXCOCPCHLW-RCZVLFRGSA-N 2 0 419.613 4.110 20 0 HIADRP C[C@H](c1ccccc1F)N1CCC[C@@H]([NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1=O ZINC000556223584 942820766 /nfs/dbraw/zinc/82/07/66/942820766.db2.gz KLSJGZVLFCXTLY-SEINPYIVSA-N 2 0 423.576 4.378 20 0 HIADRP Cc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(-c2ccnn2C)c1 ZINC000556431299 942865454 /nfs/dbraw/zinc/86/54/54/942865454.db2.gz SJBJLQKKOKTFJY-UHFFFAOYSA-N 2 0 404.558 4.158 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3c3cccc(C(F)(F)F)c3)cn2)CC1 ZINC000556589235 942908140 /nfs/dbraw/zinc/90/81/40/942908140.db2.gz QFLJVHAMZHLFCZ-LEWJYISDSA-N 2 0 418.507 4.278 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCNC(=O)NC[C@@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000556637592 942923435 /nfs/dbraw/zinc/92/34/35/942923435.db2.gz ALNQIOHSBGRDCT-PLMTUMEDSA-N 2 0 424.992 4.036 20 0 HIADRP Cc1ccc(C[N@H+]2CC[C@H](CN(C)C(=O)c3ccc(C[NH+]4CCCC4)cc3)C2)s1 ZINC000556827936 942936212 /nfs/dbraw/zinc/93/62/12/942936212.db2.gz ZGYRBBABKLAHRZ-OAQYLSRUSA-N 2 0 411.615 4.246 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000558292157 943487528 /nfs/dbraw/zinc/48/75/28/943487528.db2.gz DTPSKACBDVXOIC-FTBPSBKWSA-N 2 0 420.601 4.289 20 0 HIADRP CC[C@H](C)[N@H+](C)CCNC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000558770419 943654058 /nfs/dbraw/zinc/65/40/58/943654058.db2.gz AVJNVFPNNUTWER-NGMPGZOMSA-N 2 0 421.029 4.283 20 0 HIADRP CC[C@@H](C)[N@H+](C)CCNC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000558770398 943654122 /nfs/dbraw/zinc/65/41/22/943654122.db2.gz AVJNVFPNNUTWER-FJXZYEQHSA-N 2 0 421.029 4.283 20 0 HIADRP Brc1ccc2c(c1)CCCC[C@@H]2[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000558972621 943777707 /nfs/dbraw/zinc/77/77/07/943777707.db2.gz WYIYEMGLSZZHHR-KKSFZXQISA-N 2 0 407.396 4.307 20 0 HIADRP C[C@@H](c1ccc(F)cc1)N1CC[C@H]([NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1=O ZINC000559071604 943824350 /nfs/dbraw/zinc/82/43/50/943824350.db2.gz UOZGGDXJRDSUNM-CPJSRVTESA-N 2 0 423.576 4.332 20 0 HIADRP C[C@H](c1ccc(F)cc1)N1CC[C@@H]([NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1=O ZINC000559071596 943824443 /nfs/dbraw/zinc/82/44/43/943824443.db2.gz UOZGGDXJRDSUNM-CJFMBICVSA-N 2 0 423.576 4.332 20 0 HIADRP CCOc1cc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)ccc1OC ZINC000559331287 943897053 /nfs/dbraw/zinc/89/70/53/943897053.db2.gz KTPBFGPNYOXYEW-HSZRJFAPSA-N 2 0 424.585 4.112 20 0 HIADRP CCOc1cc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)ccc1OC ZINC000559331288 943897757 /nfs/dbraw/zinc/89/77/57/943897757.db2.gz KTPBFGPNYOXYEW-QHCPKHFHSA-N 2 0 424.585 4.112 20 0 HIADRP CC(C)Oc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000559333317 943897932 /nfs/dbraw/zinc/89/79/32/943897932.db2.gz ZERSOSUXJBFISW-DEOSSOPVSA-N 2 0 408.586 4.492 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCN(C)[C@@H](c4ccccc4)C3)CC2)cc1 ZINC000559752345 944043595 /nfs/dbraw/zinc/04/35/95/944043595.db2.gz FYBRVGFNHUWUPH-AZGAKELHSA-N 2 0 407.602 4.332 20 0 HIADRP CC(=O)N1CCC(C[NH2+][C@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)CC1 ZINC000559894402 944077668 /nfs/dbraw/zinc/07/76/68/944077668.db2.gz MINZGLDKAQEVEA-XMMPIXPASA-N 2 0 403.586 4.227 20 0 HIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(C)c1OC ZINC000560528594 944243737 /nfs/dbraw/zinc/24/37/37/944243737.db2.gz JEEAAROPGJRKMS-ROUUACIJSA-N 2 0 415.553 4.315 20 0 HIADRP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000560751166 944320153 /nfs/dbraw/zinc/32/01/53/944320153.db2.gz LXGYNAXUZPGSGC-UHFFFAOYSA-N 2 0 420.601 4.446 20 0 HIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1 ZINC000564419841 945571216 /nfs/dbraw/zinc/57/12/16/945571216.db2.gz RCMPKIKOWCAUJI-JIMJEQGWSA-N 2 0 408.586 4.337 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H](c1ccc(Br)cc1)C1CC1 ZINC000564753088 945748659 /nfs/dbraw/zinc/74/86/59/945748659.db2.gz AXJDMLDNGRSNJT-FQEVSTJZSA-N 2 0 404.352 4.025 20 0 HIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)N(Cc1ccncc1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000567056452 946229236 /nfs/dbraw/zinc/22/92/36/946229236.db2.gz DQGMNVZKZSBKPM-QPPBQGQZSA-N 2 0 422.617 4.242 20 0 HIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)CC2 ZINC000567273166 946286176 /nfs/dbraw/zinc/28/61/76/946286176.db2.gz ZFXNUYMMFINCOE-LJQANCHMSA-N 2 0 418.379 4.260 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc1Br ZINC000568796003 946694469 /nfs/dbraw/zinc/69/44/69/946694469.db2.gz LCIDQKIYPCQSOC-OAHLLOKOSA-N 2 0 422.367 4.034 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(F)cc2Br)[C@@H](C)C1 ZINC000570480029 947260853 /nfs/dbraw/zinc/26/08/53/947260853.db2.gz NHBBMNXOTGMGPC-YRNRMSPPSA-N 2 0 415.391 4.246 20 0 HIADRP CC[C@@]1(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)OCCc2ccccc21 ZINC000570975759 947407070 /nfs/dbraw/zinc/40/70/70/947407070.db2.gz JNAAIQHIHSYASY-SANMLTNESA-N 2 0 407.602 4.185 20 0 HIADRP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000572908843 948037073 /nfs/dbraw/zinc/03/70/73/948037073.db2.gz WVDMVZBPEMQHDZ-SANMLTNESA-N 2 0 403.570 4.021 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CCCOc3ccc(Cl)cc3)CC2)CC1 ZINC000573049005 948070977 /nfs/dbraw/zinc/07/09/77/948070977.db2.gz WIMGQFAHJDSOOS-UHFFFAOYSA-N 2 0 408.030 4.237 20 0 HIADRP Cc1ccc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c(-c2cnn(C)c2)c1 ZINC000573108611 948079075 /nfs/dbraw/zinc/07/90/75/948079075.db2.gz GWOWGBJMUUATQT-UHFFFAOYSA-N 2 0 417.601 4.088 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+]C1CC(c2ccc(Br)cc2)C1 ZINC000573284009 948142944 /nfs/dbraw/zinc/14/29/44/948142944.db2.gz IVDYMNIZXOVMFH-UHFFFAOYSA-N 2 0 418.379 4.210 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+](C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1 ZINC000574553052 948469913 /nfs/dbraw/zinc/46/99/13/948469913.db2.gz YMMBLWDNPPVBSL-RUZDIDTESA-N 2 0 401.639 4.112 20 0 HIADRP CN1CC[C@@H]([NH2+]CCCCC[NH2+][C@H]2CCN(C)[C@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000574945313 948562198 /nfs/dbraw/zinc/56/21/98/948562198.db2.gz BKQZDQKIIBDBIX-IAFDGEETSA-N 2 0 420.645 4.227 20 0 HIADRP Cc1nc(-c2ccccc2Br)sc1[C@@H](C)[NH2+]CCOCC[NH+](C)C ZINC000574956325 948564598 /nfs/dbraw/zinc/56/45/98/948564598.db2.gz HTBXENQBQIRTAC-CYBMUJFWSA-N 2 0 412.397 4.110 20 0 HIADRP COC[C@@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1[nH+]c(N3CCCC3)cc3ccccc31)C2 ZINC001164815052 720175553 /nfs/dbraw/zinc/17/55/53/720175553.db2.gz HJEJBFIEQFGVPT-NVQXNPDNSA-N 2 0 420.601 4.020 20 0 HIADRP CC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[NH+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc1 ZINC001164910681 721564061 /nfs/dbraw/zinc/56/40/61/721564061.db2.gz XFIZAXFSKRLLSS-OEMFJLHTSA-N 2 0 424.564 4.110 20 0 HIADRP Cc1ccc(COc2ccc(C[NH2+]Cc3ccc(N4CC[NH+](C)CC4)nc3)cc2)cc1 ZINC000030660786 847754192 /nfs/dbraw/zinc/75/41/92/847754192.db2.gz APJOWAOBLDRHSJ-UHFFFAOYSA-N 2 0 416.569 4.011 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+]Cc3ccc(Oc4cc(F)cc(F)c4)cc3)CC2)CC1 ZINC000051189667 849440484 /nfs/dbraw/zinc/44/04/84/849440484.db2.gz CTFXNBUWLXQUHD-UHFFFAOYSA-N 2 0 415.528 4.405 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2ccccc2C[NH+]2CCC[C@@H](C)C2)CC1 ZINC000056845880 850500553 /nfs/dbraw/zinc/50/05/53/850500553.db2.gz RJLGLRMLZLPSIP-OAQYLSRUSA-N 2 0 414.638 4.180 20 0 HIADRP Cc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]CCCC[NH+]2CCOCC2)cc1 ZINC000060979276 851265495 /nfs/dbraw/zinc/26/54/95/851265495.db2.gz CVHYEJYMDCRKQN-UHFFFAOYSA-N 2 0 418.585 4.109 20 0 HIADRP Fc1cccc(Cl)c1COc1ccc(C[NH2+]CCCC[NH+]2CCOCC2)cc1 ZINC000060979585 851266789 /nfs/dbraw/zinc/26/67/89/851266789.db2.gz IVEDAMLTKNIXDM-UHFFFAOYSA-N 2 0 406.929 4.260 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)CC1 ZINC000061112692 851295956 /nfs/dbraw/zinc/29/59/56/851295956.db2.gz GDCQUOXQMDRFOA-NRFANRHFSA-N 2 0 414.619 4.082 20 0 HIADRP CCc1ccc([C@H](CNC(=O)NCc2ccccc2C[N@H+](C)C(C)C)[NH+](C)C)cc1 ZINC000061222322 851320296 /nfs/dbraw/zinc/32/02/96/851320296.db2.gz ITBMPMVNYASIMW-DEOSSOPVSA-N 2 0 410.606 4.191 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1)C1CC1 ZINC000437044886 862237936 /nfs/dbraw/zinc/23/79/36/862237936.db2.gz RNJYBMCODXZCNL-HSZRJFAPSA-N 2 0 405.586 4.265 20 0 HIADRP Cc1ccc([C@H](CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)[NH+]2CCCC2)cc1 ZINC000061502454 851389696 /nfs/dbraw/zinc/38/96/96/851389696.db2.gz BXMLRFMRXUZUPV-VWLOTQADSA-N 2 0 405.586 4.160 20 0 HIADRP COc1ccc([C@H](CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccccc2)[NH+]2CCCCC2)cc1 ZINC000072015393 852466643 /nfs/dbraw/zinc/46/66/43/852466643.db2.gz IZOSNSQLILUUIK-DQEYMECFSA-N 2 0 421.585 4.003 20 0 HIADRP COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000097549403 852628185 /nfs/dbraw/zinc/62/81/85/852628185.db2.gz AXWHERGEQRLWRP-NHCUHLMSSA-N 2 0 423.601 4.105 20 0 HIADRP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3cccc(C(=O)Nc4ccccc4)c3)CC2)C[C@H](C)O1 ZINC000110736660 853146051 /nfs/dbraw/zinc/14/60/51/853146051.db2.gz IECKHMGJPFUSBS-OYRHEFFESA-N 2 0 421.585 4.260 20 0 HIADRP c1[nH]nc(-c2ccccc2)c1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000236712027 853915490 /nfs/dbraw/zinc/91/54/90/853915490.db2.gz ODVUHXTXEVUHAR-UHFFFAOYSA-N 2 0 404.558 4.238 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cnn(-c3ccccc3)c2)CC1 ZINC000236851862 853929002 /nfs/dbraw/zinc/92/90/02/853929002.db2.gz XWGTYEVZSVHPSH-LJQANCHMSA-N 2 0 407.537 4.004 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(-n3ccnc3)cc2)CC1 ZINC000236851368 853929088 /nfs/dbraw/zinc/92/90/88/853929088.db2.gz NMGKGNUZYXUUOH-LJQANCHMSA-N 2 0 407.537 4.004 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)[C@@H](C)C1 ZINC000236866297 853930140 /nfs/dbraw/zinc/93/01/40/853930140.db2.gz AOSSXHBZVSXBQU-YWZLYKJASA-N 2 0 413.389 4.496 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2c(Cl)n(-c3ccccc3)nc2C(C)C)CC1 ZINC000236948487 853941267 /nfs/dbraw/zinc/94/12/67/853941267.db2.gz MKAKVBWJCBWMAP-IBGZPJMESA-N 2 0 418.029 4.012 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000236974668 853945369 /nfs/dbraw/zinc/94/53/69/853945369.db2.gz DCJYNSYHBPWXLD-IBGZPJMESA-N 2 0 401.982 4.035 20 0 HIADRP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000237097957 853963874 /nfs/dbraw/zinc/96/38/74/853963874.db2.gz AEVPSRJSCCYBNQ-CTXDPNEZSA-N 2 0 417.395 4.357 20 0 HIADRP C[NH+]1CCN(CCC[NH2+]Cc2cccc(Oc3cccc(C(F)(F)F)c3)c2)CC1 ZINC000237208999 853982224 /nfs/dbraw/zinc/98/22/24/853982224.db2.gz VLUIXIFHELMHQV-UHFFFAOYSA-N 2 0 407.480 4.225 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)ccc1OC(F)F ZINC000237215569 853984280 /nfs/dbraw/zinc/98/42/80/853984280.db2.gz BCUMESJZDUVYPD-IAGOWNOFSA-N 2 0 420.500 4.196 20 0 HIADRP C[C@H](C[NH2+]Cc1ccc(-c2ccc(Br)cc2)s1)CN1CC[NH+](C)CC1 ZINC000237578520 854057411 /nfs/dbraw/zinc/05/74/11/854057411.db2.gz HXQABVMXJCGPPP-MRXNPFEDSA-N 2 0 422.436 4.151 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(OC[C@H]3CCCO3)cc2)C[C@@H](C)O1 ZINC000237574670 854057537 /nfs/dbraw/zinc/05/75/37/854057537.db2.gz WLTDNLNDXIFNIK-IPVFLDMMSA-N 2 0 424.585 4.143 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(F)c(Br)c2)C[C@H](C)O1 ZINC000237622054 854063782 /nfs/dbraw/zinc/06/37/82/854063782.db2.gz MFWOKCQZTOGXCT-HOTGVXAUSA-N 2 0 421.354 4.487 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Br)s2)C[C@H](C)O1 ZINC000237621420 854064003 /nfs/dbraw/zinc/06/40/03/854064003.db2.gz DKQAKKDCOBFKPE-GJZGRUSLSA-N 2 0 409.393 4.410 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2cccc(Cl)c2Cl)cc1 ZINC000237853163 854108332 /nfs/dbraw/zinc/10/83/32/854108332.db2.gz AZHFTDMAJVIXCH-UHFFFAOYSA-N 2 0 406.357 4.109 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](CCC(=O)Nc2ccccc2Br)CC1 ZINC000303506745 854995101 /nfs/dbraw/zinc/99/51/01/854995101.db2.gz APDHYAFHIVLGGL-UHFFFAOYSA-N 2 0 410.400 4.222 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NCCCC[N@@H+]2CCC[C@H](C)C2)CC1 ZINC000303630927 855089337 /nfs/dbraw/zinc/08/93/37/855089337.db2.gz FRVIEDQBCHIMGJ-SFTDATJTSA-N 2 0 400.611 4.023 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381779473 855431484 /nfs/dbraw/zinc/43/14/84/855431484.db2.gz YKNOPYYLGAHRPP-ILWGZMRPSA-N 2 0 401.595 4.134 20 0 HIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(Br)s1 ZINC000397633825 855472840 /nfs/dbraw/zinc/47/28/40/855472840.db2.gz OSDVTGOVMCKOJU-OAHLLOKOSA-N 2 0 409.393 4.188 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000400511926 855479701 /nfs/dbraw/zinc/47/97/01/855479701.db2.gz JLXRJCWTGVPDHL-PZJWPPBQSA-N 2 0 401.595 4.134 20 0 HIADRP CC(C)(C)OC(=O)N[C@H]1C[C@H]([NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)C1(C)C ZINC000404887189 855481658 /nfs/dbraw/zinc/48/16/58/855481658.db2.gz GAFZOHLXMTVYHB-MZLICYQSSA-N 2 0 401.595 4.180 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N[C@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000410347097 855941522 /nfs/dbraw/zinc/94/15/22/855941522.db2.gz YSGFTJGLCYOVMN-OFVILXPXSA-N 2 0 420.601 4.135 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)Nc3cccc(OCC[NH+](C)C)c3)cc2)C1 ZINC000410358556 855948568 /nfs/dbraw/zinc/94/85/68/855948568.db2.gz JOVWDHAEFSMTDY-HXUWFJFHSA-N 2 0 424.589 4.181 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)Nc2cccc(OCC[NH+](C)C)c2)C1 ZINC000410363993 855951568 /nfs/dbraw/zinc/95/15/68/855951568.db2.gz LCXIFQDBSUZOPC-HXUWFJFHSA-N 2 0 424.589 4.181 20 0 HIADRP C[C@@H]1CCC[NH+](Cc2ccccc2CNC(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)C1 ZINC000410362894 855951673 /nfs/dbraw/zinc/95/16/73/855951673.db2.gz ZFJAHKNTPVDQDW-FGZHOGPDSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@@H](c1cccs1)[NH+](C)C ZINC000410365715 855954048 /nfs/dbraw/zinc/95/40/48/855954048.db2.gz KIOLKYWQGJCSLO-RXVVDRJESA-N 2 0 414.619 4.225 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@H](c1ccsc1)[NH+](C)C ZINC000410372414 855957974 /nfs/dbraw/zinc/95/79/74/855957974.db2.gz VTPCWOMWMCNEHS-PGRDOPGGSA-N 2 0 414.619 4.225 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000410394532 855970473 /nfs/dbraw/zinc/97/04/73/855970473.db2.gz ZBPIMSSOAVFNJX-PXDATVDWSA-N 2 0 420.601 4.135 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000410394530 855971016 /nfs/dbraw/zinc/97/10/16/855971016.db2.gz ZBPIMSSOAVFNJX-BWKNWUBXSA-N 2 0 420.601 4.135 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000426045275 856069396 /nfs/dbraw/zinc/06/93/96/856069396.db2.gz BSELRTFWVYKRLX-KMDXXIMOSA-N 2 0 413.993 4.376 20 0 HIADRP Cn1c2ccccc2cc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1=O ZINC000426317237 856242199 /nfs/dbraw/zinc/24/21/99/856242199.db2.gz LWXUBOLLZRMRJZ-PZUNEJSGSA-N 2 0 415.581 4.319 20 0 HIADRP COc1ccc(CC[C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1O ZINC000426357817 856258053 /nfs/dbraw/zinc/25/80/53/856258053.db2.gz FICZIQZTNRDWHC-UFYCRDLUSA-N 2 0 412.574 4.121 20 0 HIADRP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000426964010 856565867 /nfs/dbraw/zinc/56/58/67/856565867.db2.gz OBISLZYRBKMJPG-FQEVSTJZSA-N 2 0 406.574 4.023 20 0 HIADRP C[C@@H]1CCN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000437478916 862838380 /nfs/dbraw/zinc/83/83/80/862838380.db2.gz ZQHKQUVIZSCLLA-JOCHJYFZSA-N 2 0 405.586 4.022 20 0 HIADRP Cc1ccc([C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)C2CCC2)cc1 ZINC000427694478 856911765 /nfs/dbraw/zinc/91/17/65/856911765.db2.gz JJDKJRUKEZNLPM-JWQCQUIFSA-N 2 0 405.586 4.323 20 0 HIADRP COc1cc(Br)ccc1C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000427860423 856986130 /nfs/dbraw/zinc/98/61/30/856986130.db2.gz ZWDFFZXFVHDAAI-OAHLLOKOSA-N 2 0 407.352 4.249 20 0 HIADRP CC(C)O[C@H](C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1)c1ccccc1 ZINC000428198160 857107227 /nfs/dbraw/zinc/10/72/27/857107227.db2.gz BRMSWLVXYIJATC-RUZDIDTESA-N 2 0 401.639 4.281 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000428620402 857280182 /nfs/dbraw/zinc/28/01/82/857280182.db2.gz PHBCFWNHGXVEOT-HSZRJFAPSA-N 2 0 419.613 4.412 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000428653481 857290733 /nfs/dbraw/zinc/29/07/33/857290733.db2.gz WTZCTBXFYULHFV-JTOYRKQZSA-N 2 0 414.638 4.097 20 0 HIADRP C[N@H+](C[C@H](O)Cc1ccc(C(F)(F)F)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000437582088 862898467 /nfs/dbraw/zinc/89/84/67/862898467.db2.gz UDIONTZHHDFNAX-IFMALSPDSA-N 2 0 406.492 4.063 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CCOc3cccc4ccccc43)CC2)CC1 ZINC000430935126 858374656 /nfs/dbraw/zinc/37/46/56/858374656.db2.gz OVNNRPCBOSJQFE-UHFFFAOYSA-N 2 0 409.618 4.347 20 0 HIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000431338549 858571926 /nfs/dbraw/zinc/57/19/26/858571926.db2.gz UIDBYHTXFBWNJZ-QFIPXVFZSA-N 2 0 415.622 4.240 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCC4)CC1 ZINC000431352991 858575856 /nfs/dbraw/zinc/57/58/56/858575856.db2.gz UKKYOVQDVHPQCD-RUZDIDTESA-N 2 0 406.570 4.136 20 0 HIADRP COc1ccc([C@H](CNC(=O)C[C@H](c2ccccc2)[NH+](C)C)[NH+]2CCCCC2)cc1 ZINC000431570952 858673057 /nfs/dbraw/zinc/67/30/57/858673057.db2.gz OZJISBPVJHUQPT-RPWUZVMVSA-N 2 0 409.574 4.031 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)NC2CC[NH+](C3CCCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000431667318 858726148 /nfs/dbraw/zinc/72/61/48/858726148.db2.gz YMWDMUWKAKRDQN-NFBKMPQASA-N 2 0 412.622 4.136 20 0 HIADRP C[C@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000432415095 859154326 /nfs/dbraw/zinc/15/43/26/859154326.db2.gz UYDQYZFUHPQPCN-QMTMVMCOSA-N 2 0 413.425 4.323 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@H]1CCCN(c2ccccc2)C1)C1CC[NH+](C)CC1 ZINC000433198479 859563340 /nfs/dbraw/zinc/56/33/40/859563340.db2.gz GEWGEERDTYMDDD-JOCHJYFZSA-N 2 0 406.618 4.223 20 0 HIADRP CCOC1(C)CC[NH+](Cc2cc(C[NH+]3CCC(C)(OCC)CC3)cc(OC)c2)CC1 ZINC000433201803 859564797 /nfs/dbraw/zinc/56/47/97/859564797.db2.gz YGYWBGFKZXEJGN-UHFFFAOYSA-N 2 0 418.622 4.477 20 0 HIADRP Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1 ZINC000433355087 859658643 /nfs/dbraw/zinc/65/86/43/859658643.db2.gz PRDVTBLTDSZGIA-QFIPXVFZSA-N 2 0 401.620 4.279 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)[C@H]2CCCC[NH+]2C2CCCC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000433368632 859661550 /nfs/dbraw/zinc/66/15/50/859661550.db2.gz UOEBDDXJKMSGDH-YHYVQYDKSA-N 2 0 421.988 4.385 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)c1 ZINC000467748236 881552618 /nfs/dbraw/zinc/55/26/18/881552618.db2.gz VIBHSDQSHSULBP-RPWUZVMVSA-N 2 0 416.009 4.342 20 0 HIADRP CN(c1ccccc1C[NH+]1CCC(C(=O)c2ccc(F)cc2)CC1)C1CC[NH+](C)CC1 ZINC000435058914 860620811 /nfs/dbraw/zinc/62/08/11/860620811.db2.gz WBNQBASAOKINPD-UHFFFAOYSA-N 2 0 423.576 4.451 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)c1)C1CCOCC1 ZINC000438196146 863624966 /nfs/dbraw/zinc/62/49/66/863624966.db2.gz CQAHWPSXBFMPGD-OALUTQOASA-N 2 0 414.512 4.387 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(COC2CCCC2)cc1 ZINC000438302635 863783064 /nfs/dbraw/zinc/78/30/64/863783064.db2.gz LUFPTUXZMHKQBP-QFIPXVFZSA-N 2 0 416.610 4.026 20 0 HIADRP C[NH+](C)CCN(Cc1cccs1)C(=O)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000439206315 864631258 /nfs/dbraw/zinc/63/12/58/864631258.db2.gz CWWYRIYOIRORLN-UHFFFAOYSA-N 2 0 414.619 4.007 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)Nc1ccc(Cl)cn1 ZINC000439599588 864923930 /nfs/dbraw/zinc/92/39/30/864923930.db2.gz SZZJLGKIJDDPPP-INIZCTEOSA-N 2 0 412.921 4.077 20 0 HIADRP Cc1ccc(NC2CC[NH+](CCc3ccccc3)CC2)cc1NC(=O)CC[NH+](C)C ZINC000468027914 881861994 /nfs/dbraw/zinc/86/19/94/881861994.db2.gz GEPTZRKAUYYGMA-UHFFFAOYSA-N 2 0 408.590 4.004 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000440529033 865805722 /nfs/dbraw/zinc/80/57/22/865805722.db2.gz GIMNNYGAXTXUBL-VWLOTQADSA-N 2 0 419.613 4.269 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+]Cc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1(C)C ZINC000441371898 866439516 /nfs/dbraw/zinc/43/95/16/866439516.db2.gz NGPZJFAJFQIKAB-UHFFFAOYSA-N 2 0 413.418 4.233 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)NC2CCC(C[NH+](C)C)CC2)CCCC1)c1ccccc1 ZINC000441512798 866591929 /nfs/dbraw/zinc/59/19/29/866591929.db2.gz PRODNMJCWIWMOE-YMISUZCDSA-N 2 0 400.611 4.070 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@H](c4ccc(C(F)(F)F)cc4)C3)cn2)CC1 ZINC000442713413 867642131 /nfs/dbraw/zinc/64/21/31/867642131.db2.gz WPEXANNTOVDWRN-PZJWPPBQSA-N 2 0 418.507 4.278 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442779271 867672689 /nfs/dbraw/zinc/67/26/89/867672689.db2.gz LSZNELKVUVEXSB-RXVVDRJESA-N 2 0 418.507 4.278 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)CC1(C)C ZINC000442874513 867708764 /nfs/dbraw/zinc/70/87/64/867708764.db2.gz MINLIFYGSXBRCV-NRFANRHFSA-N 2 0 416.407 4.154 20 0 HIADRP Cc1cc(N2CCCC2)ccc1NC(=O)C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443597589 868152513 /nfs/dbraw/zinc/15/25/13/868152513.db2.gz BBBMONWVFURXJO-UHFFFAOYSA-N 2 0 412.622 4.122 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)CC1 ZINC000443605637 868165717 /nfs/dbraw/zinc/16/57/17/868165717.db2.gz QNTTVPJNALNJMC-UHFFFAOYSA-N 2 0 416.997 4.428 20 0 HIADRP C[C@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)NCCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000443693041 868294409 /nfs/dbraw/zinc/29/44/09/868294409.db2.gz LLTCJDVIYLBTRS-WIOPSUGQSA-N 2 0 422.617 4.061 20 0 HIADRP CC[NH+](CC)CCOC1CCN([C@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)CC1 ZINC000468281575 882203941 /nfs/dbraw/zinc/20/39/41/882203941.db2.gz XYMZFOCZBXJYHN-LJQANCHMSA-N 2 0 400.567 4.237 20 0 HIADRP CCC(CC)(CNC(=O)NCC1CC[NH+](C2CC2)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000444971179 869133939 /nfs/dbraw/zinc/13/39/39/869133939.db2.gz WUCBPSSVMKMOBO-LJQANCHMSA-N 2 0 400.611 4.070 20 0 HIADRP O=C(C[NH2+][C@H]1CCC[C@@H]1c1ccccc1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000445987014 869951073 /nfs/dbraw/zinc/95/10/73/869951073.db2.gz AIQOVFVSMBGHAR-PKTZIBPZSA-N 2 0 409.599 4.100 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)Nc2ccccc2CC[NH+](C)C)CC1 ZINC000446562455 870474070 /nfs/dbraw/zinc/47/40/70/870474070.db2.gz BXEUWWDIJIGRHL-FQEVSTJZSA-N 2 0 400.611 4.299 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N[C@H](C[N@@H+]1CCc2ccccc2C1)C(C)(C)C ZINC000446582482 870490658 /nfs/dbraw/zinc/49/06/58/870490658.db2.gz XTPMLDLACJQPSN-XMMPIXPASA-N 2 0 422.617 4.385 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000446583202 870491706 /nfs/dbraw/zinc/49/17/06/870491706.db2.gz QYOJBQRBFPLOJP-NOTZXAQLSA-N 2 0 406.574 4.108 20 0 HIADRP C[NH+](C)Cc1ccc(NC(=O)C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)cc1 ZINC000446670453 870584843 /nfs/dbraw/zinc/58/48/43/870584843.db2.gz LGYKUSRASGEVMN-UHFFFAOYSA-N 2 0 422.573 4.090 20 0 HIADRP Cc1nccn1-c1ccc(C[NH2+][C@H](CCn2cncn2)c2ccc(C)cc2)cc1F ZINC000446751084 870658565 /nfs/dbraw/zinc/65/85/65/870658565.db2.gz BJJPBJFUCUUJSN-JOCHJYFZSA-N 2 0 404.493 4.141 20 0 HIADRP CC[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](CC)CC1)c1ccc(Br)cc1Cl ZINC000446757460 870669998 /nfs/dbraw/zinc/66/99/98/870669998.db2.gz UKYFERUBZKLOPY-RDTXWAMCSA-N 2 0 402.808 4.169 20 0 HIADRP CCOc1ccccc1NC(=O)[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000447038262 870914250 /nfs/dbraw/zinc/91/42/50/870914250.db2.gz NJHPAIQFJZOLHO-DEOSSOPVSA-N 2 0 407.558 4.229 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](Cc3ccc(F)cc3)c3ccccc3)cn2)CC1 ZINC000447529563 871393208 /nfs/dbraw/zinc/39/32/08/871393208.db2.gz KRCNIFCASCJZNI-XMMPIXPASA-N 2 0 404.533 4.046 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000447604505 871514554 /nfs/dbraw/zinc/51/45/54/871514554.db2.gz AYSRBMRNMPGMFP-IZZNHLLZSA-N 2 0 404.529 4.466 20 0 HIADRP C[NH+](C)[C@@H]1CCOc2c(NC(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)cccc21 ZINC000447724403 871668391 /nfs/dbraw/zinc/66/83/91/871668391.db2.gz VURSSDFHDUVXSR-JOCHJYFZSA-N 2 0 407.558 4.313 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)N3CC[C@@H]4[C@H](CCC[N@@H+]4C4CC4)C3)c2)CC1 ZINC000448208187 872103234 /nfs/dbraw/zinc/10/32/34/872103234.db2.gz FQGIEXUQWKKFHO-ILBGXUMGSA-N 2 0 424.633 4.077 20 0 HIADRP CC(C)=CCOc1ccc(CC[C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000468546638 882585643 /nfs/dbraw/zinc/58/56/43/882585643.db2.gz DOJUDCDFNWPJOG-FYYLOGMGSA-N 2 0 400.607 4.443 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC(CC)(CC)[NH2+][C@H](C)c2ccccc2)[C@@H](C)C1 ZINC000448524981 872520200 /nfs/dbraw/zinc/52/02/00/872520200.db2.gz MQSVKSAOWQZFOX-VWPQPMDRSA-N 2 0 402.627 4.268 20 0 HIADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1 ZINC000460990579 873876731 /nfs/dbraw/zinc/87/67/31/873876731.db2.gz HRHVQGYFJIACQH-UHFFFAOYSA-N 2 0 421.507 4.117 20 0 HIADRP CC(C)[C@@H](CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C1CC[NH+](C)CC1)[NH+](C)C ZINC000468654166 882790120 /nfs/dbraw/zinc/79/01/20/882790120.db2.gz UJRSPMFCBBVFIO-HXUWFJFHSA-N 2 0 414.421 4.250 20 0 HIADRP Cc1ccc(N[C@H]2C[C@@H](C)C[N@@H+](Cc3ccccc3)C2)cc1NC(=O)CC[NH+](C)C ZINC000468686295 882811580 /nfs/dbraw/zinc/81/15/80/882811580.db2.gz UUJTXZILAQEQJT-XXBNENTESA-N 2 0 408.590 4.208 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCCC2)cc1)N1C[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000461432442 874476836 /nfs/dbraw/zinc/47/68/36/874476836.db2.gz UPKLJKXGOHNTHQ-CLJLJLNGSA-N 2 0 417.597 4.267 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000462166204 875263199 /nfs/dbraw/zinc/26/31/99/875263199.db2.gz FAYRDBDQJNPWIQ-CZSZKKDXSA-N 2 0 420.601 4.032 20 0 HIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CCC2CCS(=O)(=O)CC2)c2ccc(F)cc2)CC1 ZINC000462815057 875857363 /nfs/dbraw/zinc/85/73/63/875857363.db2.gz BOWVHVGRENNNBV-HSZRJFAPSA-N 2 0 424.626 4.183 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(OC(C)(C)C)cc1 ZINC000463027037 876044958 /nfs/dbraw/zinc/04/49/58/876044958.db2.gz BTWNPUICHVKBJC-CVDCTZTESA-N 2 0 423.601 4.412 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(OC(C)(C)C)cc1 ZINC000463030427 876050577 /nfs/dbraw/zinc/05/05/77/876050577.db2.gz SJTFCYAVWBFGGT-SFHVURJKSA-N 2 0 403.611 4.141 20 0 HIADRP COc1ccc([C@H](CNC2CC[NH+](CCc3ccccc3)CC2)[NH+]2CCCC2)cc1 ZINC000463136245 876185692 /nfs/dbraw/zinc/18/56/92/876185692.db2.gz CVYKJZIACVIFSY-SANMLTNESA-N 2 0 407.602 4.129 20 0 HIADRP C[N@H+](CCC(=O)Nc1ccc(Cl)cc1F)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464839780 878105406 /nfs/dbraw/zinc/10/54/06/878105406.db2.gz YZNJPFIIOHSRBL-GOSISDBHSA-N 2 0 403.929 4.262 20 0 HIADRP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2ccc(C)cc2)[C@@H]2CCc3ccccc32)CC1 ZINC000464864880 878147227 /nfs/dbraw/zinc/14/72/27/878147227.db2.gz BNOGIXSGVJUZJX-RUZDIDTESA-N 2 0 405.586 4.085 20 0 HIADRP C[C@H]1CCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000465444453 878875930 /nfs/dbraw/zinc/87/59/30/878875930.db2.gz RDKDLIBNVUASAB-WIOPSUGQSA-N 2 0 420.601 4.130 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@H](C)C3)cc2)C1 ZINC000465517377 878965418 /nfs/dbraw/zinc/96/54/18/878965418.db2.gz CTSDLPFTEIROJW-IMSXRSKXSA-N 2 0 414.638 4.038 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N(C)CC[C@@H]2CCCC[NH+]2C)cc1 ZINC000465557859 879026167 /nfs/dbraw/zinc/02/61/67/879026167.db2.gz KDLIOMVNAYQEMC-OFNKIYASSA-N 2 0 400.611 4.077 20 0 HIADRP CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000465574378 879050798 /nfs/dbraw/zinc/05/07/98/879050798.db2.gz PXLRYLZRFYZWKQ-DEOSSOPVSA-N 2 0 422.617 4.431 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)C1 ZINC000503426253 912421842 /nfs/dbraw/zinc/42/18/42/912421842.db2.gz NAQXDKARDKYJQM-GPXNEJASSA-N 2 0 412.622 4.120 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@]1([NH+](C)C)CCC[C@H](C)C1 ZINC000465715877 879288005 /nfs/dbraw/zinc/28/80/05/879288005.db2.gz VNOIYGUMXCJUJS-PWWKTKHKSA-N 2 0 414.638 4.051 20 0 HIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@H]2CCC[NH+](C)[C@H]2c2cccs2)C1 ZINC000465897125 879554832 /nfs/dbraw/zinc/55/48/32/879554832.db2.gz QIZZNDDSWYKQKN-SFHLNBCPSA-N 2 0 420.667 4.331 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)NCCCCC[NH+]2CCCCC2)[C@@H]1c1cccs1 ZINC000465951134 879618477 /nfs/dbraw/zinc/61/84/77/879618477.db2.gz NGNNKYTZFNXESU-PZJWPPBQSA-N 2 0 406.640 4.086 20 0 HIADRP CCOc1cc2[nH+]ccc(N3CCC(OCC[NH+]4CCCC4)CC3)c2cc1OCC ZINC000466659296 880438191 /nfs/dbraw/zinc/43/81/91/880438191.db2.gz UBTSNNPSHWYPGD-UHFFFAOYSA-N 2 0 413.562 4.113 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1cc2ccccc2o1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000467268636 881008843 /nfs/dbraw/zinc/00/88/43/881008843.db2.gz MVXYLUDATLIVDO-OALUTQOASA-N 2 0 405.542 4.253 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2C)CC1 ZINC000469240410 883339152 /nfs/dbraw/zinc/33/91/52/883339152.db2.gz PTQIYXKLGWMHOT-ROUUACIJSA-N 2 0 401.574 4.465 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)N1CCC(CC[NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000469492471 883733080 /nfs/dbraw/zinc/73/30/80/883733080.db2.gz SJPBXWXGXWRZJP-FQEVSTJZSA-N 2 0 413.528 4.279 20 0 HIADRP C[NH+](C)CCn1ccc2ccc(NC(=O)[C@H]3CCCC[N@@H+]3Cc3ccccc3)cc21 ZINC000469833171 884013258 /nfs/dbraw/zinc/01/32/58/884013258.db2.gz DKEFJFFDIKAORC-HSZRJFAPSA-N 2 0 404.558 4.196 20 0 HIADRP C[C@@H]1CC[N@H+](CCOc2ccc(NC(=O)c3oc4ccccc4c3C[NH+](C)C)cc2)C1 ZINC000470126348 884388025 /nfs/dbraw/zinc/38/80/25/884388025.db2.gz ZJLKVGQHWDLLAR-GOSISDBHSA-N 2 0 421.541 4.467 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)[C@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)C1 ZINC000470540756 884944935 /nfs/dbraw/zinc/94/49/35/884944935.db2.gz YOYKGMHILVEVIN-PXNSSMCTSA-N 2 0 413.528 4.279 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000470674320 885104770 /nfs/dbraw/zinc/10/47/70/885104770.db2.gz LBBZCGWUMQQQQQ-XMMPIXPASA-N 2 0 423.601 4.144 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(C)[C@@H]2CCC[NH+](Cc3ccccc3)C2)cc1)C1CC1 ZINC000470675221 885106793 /nfs/dbraw/zinc/10/67/93/885106793.db2.gz YMZVWMGWRAENIU-RUZDIDTESA-N 2 0 405.586 4.408 20 0 HIADRP CN(C(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470752791 885218369 /nfs/dbraw/zinc/21/83/69/885218369.db2.gz BEVRMITWQGYOMU-RPBOFIJWSA-N 2 0 420.601 4.130 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000470756463 885221635 /nfs/dbraw/zinc/22/16/35/885221635.db2.gz OYWGAJLFSCOLNE-QFIPXVFZSA-N 2 0 420.601 4.043 20 0 HIADRP CCC1(c2ccc(Cl)cc2)CC[NH+](CC(=O)NC2CC[NH+](C(C)C)CC2)CC1 ZINC000470873996 885361517 /nfs/dbraw/zinc/36/15/17/885361517.db2.gz NVRWZZCOMFPKPT-UHFFFAOYSA-N 2 0 406.014 4.073 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000471601256 886314199 /nfs/dbraw/zinc/31/41/99/886314199.db2.gz HQNCMGVPRGMBAS-UONOGXRCSA-N 2 0 411.434 4.401 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccc(Br)cc1 ZINC000471655759 886369007 /nfs/dbraw/zinc/36/90/07/886369007.db2.gz YAYDSHPACPGBMH-FQEVSTJZSA-N 2 0 417.395 4.227 20 0 HIADRP C[N@@H+]1CC[C@@H](NC(=O)Nc2ccc(OCC[NH+]3CCCCC3)cc2)[C@@H]1c1ccccc1 ZINC000471929859 886721773 /nfs/dbraw/zinc/72/17/73/886721773.db2.gz NRCGJBUWBWXBRQ-RPWUZVMVSA-N 2 0 422.573 4.118 20 0 HIADRP CN(c1ccccc1C[NH2+]CCc1cn(C)c2cc(F)ccc12)C1CC[NH+](C)CC1 ZINC000472060633 886869687 /nfs/dbraw/zinc/86/96/87/886869687.db2.gz WSNGKCFCOKNLCP-UHFFFAOYSA-N 2 0 408.565 4.180 20 0 HIADRP CC[NH+](CC)CCO[C@@H]1CC[N@@H+]([C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1 ZINC000472257591 887067778 /nfs/dbraw/zinc/06/77/78/887067778.db2.gz IIBMHKWUHNQDBD-GBXCKJPGSA-N 2 0 409.574 4.433 20 0 HIADRP C[NH+](C)Cc1ccc(S(=O)(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)cc1 ZINC000472685683 887540332 /nfs/dbraw/zinc/54/03/32/887540332.db2.gz MNKGRSMTWWWTBM-UHFFFAOYSA-N 2 0 415.603 4.314 20 0 HIADRP C[C@@H](CCNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1 ZINC000473019685 887845173 /nfs/dbraw/zinc/84/51/73/887845173.db2.gz HJXWLOIICVZWLZ-DHLKQENFSA-N 2 0 422.617 4.061 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000473636641 888378153 /nfs/dbraw/zinc/37/81/53/888378153.db2.gz HHPVICAFTNCLFT-UHFFFAOYSA-N 2 0 416.610 4.326 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N2CCC([NH+]3CCCC3)CC2)c1 ZINC000473735019 888513436 /nfs/dbraw/zinc/51/34/36/888513436.db2.gz PZBLBDOOISOCJX-UHFFFAOYSA-N 2 0 400.611 4.078 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)c1 ZINC000473737973 888517974 /nfs/dbraw/zinc/51/79/74/888517974.db2.gz DTZPEEJZHCIJHQ-UHFFFAOYSA-N 2 0 402.627 4.371 20 0 HIADRP CCN(C(=O)NC[C@H](c1ccsc1)[NH+](C)C)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473886945 888756414 /nfs/dbraw/zinc/75/64/14/888756414.db2.gz RACGCJVCGFLBCF-YUXAGFNASA-N 2 0 414.619 4.218 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)[C@H](C)c1nc2ccccc2s1 ZINC000474467550 889331239 /nfs/dbraw/zinc/33/12/39/889331239.db2.gz BMKUWBLRSNPGCC-RBUKOAKNSA-N 2 0 408.615 4.326 20 0 HIADRP CC(C)C[C@@H](CNC(=O)NC1CC([NH+]2CCCCC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000474522935 889392529 /nfs/dbraw/zinc/39/25/29/889392529.db2.gz NFVCEEQWDUBKQZ-DNJQPREOSA-N 2 0 400.611 4.068 20 0 HIADRP C[C@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474625551 889487857 /nfs/dbraw/zinc/48/78/57/889487857.db2.gz AXQDLQUDBMIGLU-YTQUADARSA-N 2 0 405.011 4.090 20 0 HIADRP C[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)C1CCSCC1 ZINC000474806912 889660341 /nfs/dbraw/zinc/66/03/41/889660341.db2.gz ZSXKTVWMEMZQJP-OAHLLOKOSA-N 2 0 401.542 4.079 20 0 HIADRP Cc1ccccc1-n1nccc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000474808808 889662165 /nfs/dbraw/zinc/66/21/65/889662165.db2.gz KVVXXNIQISLDEZ-UHFFFAOYSA-N 2 0 418.585 4.342 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)NC2CC[NH+](C3CCCCC3)CC2)c1 ZINC000475105616 889953790 /nfs/dbraw/zinc/95/37/90/889953790.db2.gz CQCXRNSTYGOYOQ-UHFFFAOYSA-N 2 0 400.611 4.125 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000475153485 890018724 /nfs/dbraw/zinc/01/87/24/890018724.db2.gz NQNBOVPOHIYDJV-UWJYYQICSA-N 2 0 422.598 4.188 20 0 HIADRP Cc1cc(Br)cn2c(C[NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)cnc12 ZINC000475275243 890171143 /nfs/dbraw/zinc/17/11/43/890171143.db2.gz ARAKPNIIDWPSSK-SFHVURJKSA-N 2 0 413.363 4.017 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000476008141 890937022 /nfs/dbraw/zinc/93/70/22/890937022.db2.gz PWXSNRNZPSOWRR-SFTDATJTSA-N 2 0 404.643 4.080 20 0 HIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCCc3nn(-c4ccccc4)cc32)cc1 ZINC000479058946 894318948 /nfs/dbraw/zinc/31/89/48/894318948.db2.gz KUBGGKRUIXRWPX-XMMPIXPASA-N 2 0 404.558 4.370 20 0 HIADRP COc1cc2c(cc1OC)[C@H]([NH2+]CCCOC1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000479059555 894320670 /nfs/dbraw/zinc/32/06/70/894320670.db2.gz LWCGSUJSCVBIPO-XMMPIXPASA-N 2 0 424.585 4.352 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)N2CCC(CC[NH+]3CCCC[C@H]3C)CC2)C1 ZINC000479446423 894762370 /nfs/dbraw/zinc/76/23/70/894762370.db2.gz BHRZLBTXSZYGPY-FGZHOGPDSA-N 2 0 406.659 4.185 20 0 HIADRP COCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000480238561 895648683 /nfs/dbraw/zinc/64/86/83/895648683.db2.gz DMVYUFBMKAXJJJ-QHAWAJNXSA-N 2 0 412.574 4.172 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc1)CCCO2 ZINC000480241886 895650928 /nfs/dbraw/zinc/65/09/28/895650928.db2.gz QQJCKUBKMOBFOG-KHCICDEESA-N 2 0 410.558 4.308 20 0 HIADRP COc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)cc1OC ZINC000480241868 895650939 /nfs/dbraw/zinc/65/09/39/895650939.db2.gz QLXWJFMGFWXDQE-UFYCRDLUSA-N 2 0 412.574 4.472 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480241041 895652191 /nfs/dbraw/zinc/65/21/91/895652191.db2.gz MZHVRYSYWDDQRF-OTWHNJEPSA-N 2 0 421.585 4.376 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H](C)[C@H](C)Oc1ccc(Cl)cc1Cl)N1CC[NH+](C)CC1 ZINC000480523244 895886872 /nfs/dbraw/zinc/88/68/72/895886872.db2.gz DUFVSDZFMNOGNF-BXWFABGCSA-N 2 0 402.410 4.011 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H](C)[C@@H](C)Oc1ccc(Cl)cc1Cl)N1CC[NH+](C)CC1 ZINC000480523259 895886964 /nfs/dbraw/zinc/88/69/64/895886964.db2.gz DUFVSDZFMNOGNF-MDZRGWNJSA-N 2 0 402.410 4.011 20 0 HIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@@H](C(C)C)N2CC[NH+](C)CC2)CCC3)cc1 ZINC000480557582 895916628 /nfs/dbraw/zinc/91/66/28/895916628.db2.gz RIIHYUQOWPMKNZ-UNMCSNQZSA-N 2 0 412.647 4.358 20 0 HIADRP CC(C)(C)C(=O)N1CCC(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000480566074 895926835 /nfs/dbraw/zinc/92/68/35/895926835.db2.gz XCOMZJNUULTACG-DNQXCXABSA-N 2 0 411.634 4.258 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000480599712 895961987 /nfs/dbraw/zinc/96/19/87/895961987.db2.gz CNTPGOHCNMOLJB-MOPGFXCFSA-N 2 0 415.603 4.283 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](C)c2cnn(-c3ccc(Cl)cc3Cl)c2C)CC1 ZINC000480600074 895962058 /nfs/dbraw/zinc/96/20/58/895962058.db2.gz HTJUNHJCJUPDIX-HOTGVXAUSA-N 2 0 424.420 4.164 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCC[C@@H]2C)[C@H](C)C1 ZINC000480610282 895975678 /nfs/dbraw/zinc/97/56/78/895975678.db2.gz NFBRKRMSFWFUFR-SLSDLSHTSA-N 3 0 401.639 4.288 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cccc(NS(C)(=O)=O)c1 ZINC000480613914 895980459 /nfs/dbraw/zinc/98/04/59/895980459.db2.gz NFPGHHQGECKHQM-RTBURBONSA-N 2 0 415.603 4.283 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000480619847 895987982 /nfs/dbraw/zinc/98/79/82/895987982.db2.gz QPZLURIDUWIWKG-RBUKOAKNSA-N 2 0 415.603 4.141 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480641858 896010974 /nfs/dbraw/zinc/01/09/74/896010974.db2.gz MAPAIWUMGUXGCB-MSOLQXFVSA-N 2 0 418.578 4.454 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480645112 896014100 /nfs/dbraw/zinc/01/41/00/896014100.db2.gz RNPRRXCAESENPR-OAQYLSRUSA-N 2 0 421.651 4.024 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1ccc(OC)c(OC)c1 ZINC000480687888 896051388 /nfs/dbraw/zinc/05/13/88/896051388.db2.gz GBZNEQLBKQULOM-HSZRJFAPSA-N 2 0 411.590 4.082 20 0 HIADRP Cc1ccc(OCCCC(=O)Nc2ccc(C[NH2+][C@H]3CC[N@@H+](C)C[C@H]3C)cc2)cc1 ZINC000480694053 896056149 /nfs/dbraw/zinc/05/61/49/896056149.db2.gz KXLNFPZRGDUHTQ-YKSBVNFPSA-N 2 0 409.574 4.223 20 0 HIADRP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1 ZINC000480694571 896056910 /nfs/dbraw/zinc/05/69/10/896056910.db2.gz HDXPOZXZKMZPKW-KRWDZBQOSA-N 2 0 402.970 4.126 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3oc4ccc(OC)cc4c3C)cn2)CC1 ZINC000480714973 896076513 /nfs/dbraw/zinc/07/65/13/896076513.db2.gz RKQJFTDCZCYXPT-GOSISDBHSA-N 2 0 408.546 4.138 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480721285 896081210 /nfs/dbraw/zinc/08/12/10/896081210.db2.gz LUDCJTOLLQBMQE-ROUUACIJSA-N 2 0 410.562 4.323 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480721284 896081748 /nfs/dbraw/zinc/08/17/48/896081748.db2.gz LUDCJTOLLQBMQE-QZTJIDSGSA-N 2 0 410.562 4.323 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc(OCC(F)(F)F)cc3)cn2)CC1 ZINC000480729948 896089869 /nfs/dbraw/zinc/08/98/69/896089869.db2.gz TXXIGBFPYOJMDZ-KRWDZBQOSA-N 2 0 422.495 4.015 20 0 HIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]Cc3ccnc(N4CC[NH+](C)CC4)c3)cs2)cs1 ZINC000480734351 896095274 /nfs/dbraw/zinc/09/52/74/896095274.db2.gz VVZVETHKCVWANP-OAHLLOKOSA-N 2 0 413.616 4.178 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](c2cccc(Cl)c2)N2CCCC2)[C@@H](C)C1 ZINC000480762773 896124065 /nfs/dbraw/zinc/12/40/65/896124065.db2.gz LFVGIRLUHBDFHF-AJSBUHFISA-N 2 0 408.030 4.204 20 0 HIADRP CCn1cc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)cn1 ZINC000480769157 896131505 /nfs/dbraw/zinc/13/15/05/896131505.db2.gz LQUXMWNWMKZQKV-OAQYLSRUSA-N 2 0 403.574 4.076 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](C)[C@@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000480776521 896140642 /nfs/dbraw/zinc/14/06/42/896140642.db2.gz CICRUSBNZDIQHX-DLBZAZTESA-N 2 0 402.410 4.157 20 0 HIADRP Cc1nn(C)cc1[C@@H](C)[NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000480777787 896142749 /nfs/dbraw/zinc/14/27/49/896142749.db2.gz IOEBSKBRKLYLRX-QGZVFWFLSA-N 2 0 423.527 4.000 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c2ccccc12 ZINC000480898193 896254790 /nfs/dbraw/zinc/25/47/90/896254790.db2.gz HHYNQFZWDHKLDX-FQEVSTJZSA-N 2 0 403.570 4.447 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccccc1OC(F)F ZINC000480909964 896266230 /nfs/dbraw/zinc/26/62/30/896266230.db2.gz LMMXINBEFIBNLT-OAQYLSRUSA-N 2 0 403.517 4.276 20 0 HIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2sc(Cc3ccc(OC)c(OC)c3)nc2C)C1 ZINC000481019854 896350308 /nfs/dbraw/zinc/35/03/08/896350308.db2.gz GLDYHDHULKXKDO-APWZRJJASA-N 2 0 417.619 4.442 20 0 HIADRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(-c3c(OC)ccc4ccccc43)no2)C1 ZINC000481064841 896386093 /nfs/dbraw/zinc/38/60/93/896386093.db2.gz YEXMDWZDUIGRSW-FQEVSTJZSA-N 2 0 423.557 4.436 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)CC1 ZINC000481241230 896591811 /nfs/dbraw/zinc/59/18/11/896591811.db2.gz JXHHMAAPXWVGFF-LJQANCHMSA-N 2 0 402.995 4.204 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000481246989 896598424 /nfs/dbraw/zinc/59/84/24/896598424.db2.gz PHAMNCIQFXYQKE-XMMPIXPASA-N 2 0 422.523 4.185 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cccc(N4CCCC4=O)c3)CC2)cc1 ZINC000481720544 897113949 /nfs/dbraw/zinc/11/39/49/897113949.db2.gz UCQIZQRDJFKJAE-FQEVSTJZSA-N 2 0 421.585 4.385 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H](c2cccnc2)C2CCC2)c1)C1CCOCC1 ZINC000481929879 897313859 /nfs/dbraw/zinc/31/38/59/897313859.db2.gz VQGRKGMIHXKFEB-VWLOTQADSA-N 2 0 409.574 4.202 20 0 HIADRP Cc1c(Cl)cccc1NC(=O)CC[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000482018745 897422601 /nfs/dbraw/zinc/42/26/01/897422601.db2.gz SVBQOGDPBUTKNH-KRWDZBQOSA-N 2 0 403.954 4.268 20 0 HIADRP Clc1cccc2c1SCC[C@H]2[NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000482131460 897589397 /nfs/dbraw/zinc/58/93/97/897589397.db2.gz WRUVCUBDRGIBOQ-HXUWFJFHSA-N 2 0 402.995 4.074 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1 ZINC000482141098 897600803 /nfs/dbraw/zinc/60/08/03/897600803.db2.gz YAOXZHJPGMCTDK-NBGIEHNGSA-N 2 0 414.553 4.334 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cc(F)c(F)c(F)c1 ZINC000482229951 897709655 /nfs/dbraw/zinc/70/96/55/897709655.db2.gz INWLRODKHOKSNX-INIZCTEOSA-N 2 0 422.491 4.444 20 0 HIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000482251160 897733241 /nfs/dbraw/zinc/73/32/41/897733241.db2.gz BSCOSEIAXABBEN-HSZRJFAPSA-N 2 0 421.610 4.422 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc(F)cc1F ZINC000482255591 897737034 /nfs/dbraw/zinc/73/70/34/897737034.db2.gz APUPJBDLKMSUCM-KRWDZBQOSA-N 2 0 404.501 4.305 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000482334320 897838870 /nfs/dbraw/zinc/83/88/70/897838870.db2.gz NTKSYGGJJHNYCY-HXUWFJFHSA-N 2 0 416.610 4.190 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000482358810 897875119 /nfs/dbraw/zinc/87/51/19/897875119.db2.gz PFYCULCQAXEKGH-INIZCTEOSA-N 2 0 403.558 4.265 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc(Cl)ccc1Cl ZINC000482436038 897996604 /nfs/dbraw/zinc/99/66/04/897996604.db2.gz BRMFZBMQXCJFGF-MRXNPFEDSA-N 2 0 408.377 4.036 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000482444668 898006322 /nfs/dbraw/zinc/00/63/22/898006322.db2.gz IINGLDYJJODHBJ-UNMCSNQZSA-N 2 0 408.590 4.432 20 0 HIADRP CCC[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1 ZINC000482451575 898016746 /nfs/dbraw/zinc/01/67/46/898016746.db2.gz JUOPPBCDLAFRLH-NRFANRHFSA-N 2 0 401.986 4.163 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2sc(-c3ccccc3F)nc2C)CC1 ZINC000482509419 898093646 /nfs/dbraw/zinc/09/36/46/898093646.db2.gz LZWFABOIMTZFPC-DLBZAZTESA-N 2 0 404.599 4.182 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCCOc4ccc(Cl)cc43)cc2)CC1 ZINC000482549587 898138617 /nfs/dbraw/zinc/13/86/17/898138617.db2.gz OPCUSGFIWOVWBB-JOCHJYFZSA-N 2 0 400.950 4.300 20 0 HIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(OC)c1 ZINC000482551205 898141742 /nfs/dbraw/zinc/14/17/42/898141742.db2.gz QOSCVKHTIMUYMC-IRXDYDNUSA-N 2 0 401.526 4.007 20 0 HIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)c1 ZINC000482560659 898152645 /nfs/dbraw/zinc/15/26/45/898152645.db2.gz OJFIBFGGWFNKCO-QGZVFWFLSA-N 2 0 404.501 4.404 20 0 HIADRP COC[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cccc(C(F)(F)F)c1 ZINC000482567756 898161893 /nfs/dbraw/zinc/16/18/93/898161893.db2.gz SPARTDOPUTZDEG-QFIPXVFZSA-N 2 0 422.491 4.139 20 0 HIADRP Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccccc2)C1 ZINC000482593509 898193081 /nfs/dbraw/zinc/19/30/81/898193081.db2.gz OZDQBSCDPKHZBZ-JOCHJYFZSA-N 2 0 419.491 4.450 20 0 HIADRP CCC[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(OC)cc1 ZINC000482642486 898247177 /nfs/dbraw/zinc/24/71/77/898247177.db2.gz MQYGVJGRBGYKAM-VWNXMTODSA-N 2 0 409.574 4.024 20 0 HIADRP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000482645550 898249186 /nfs/dbraw/zinc/24/91/86/898249186.db2.gz ZBMHPVXQEDJCHA-JXFKEZNVSA-N 2 0 414.619 4.123 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000482871261 898484811 /nfs/dbraw/zinc/48/48/11/898484811.db2.gz WXLYNKGEHOXTBG-VQIMIIECSA-N 2 0 403.567 4.153 20 0 HIADRP CC1(C(=O)NCC2CC[NH+](Cc3ccccc3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000482891472 898509796 /nfs/dbraw/zinc/50/97/96/898509796.db2.gz DCHWVUBZZFFBIF-UHFFFAOYSA-N 2 0 419.613 4.317 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)[C@H](C)C1 ZINC000482948832 898576557 /nfs/dbraw/zinc/57/65/57/898576557.db2.gz SOKDEPYJDGAIQI-RCZVLFRGSA-N 3 0 401.639 4.289 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3nc4ccccc4[nH]3)cc2)[C@@H](C)C1 ZINC000482949972 898577399 /nfs/dbraw/zinc/57/73/99/898577399.db2.gz WOQREZSGNAVTEP-SIKLNZKXSA-N 2 0 406.574 4.457 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000482956094 898585615 /nfs/dbraw/zinc/58/56/15/898585615.db2.gz ZVEOTVMIIWZKJN-NVQXNPDNSA-N 2 0 406.618 4.458 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000483043777 898714930 /nfs/dbraw/zinc/71/49/30/898714930.db2.gz GBNLMEXSSXUZOL-VWNXMTODSA-N 2 0 411.634 4.402 20 0 HIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000483219669 898864996 /nfs/dbraw/zinc/86/49/96/898864996.db2.gz UNQQEXPIGUJOSM-ARFHVFGLSA-N 2 0 401.378 4.240 20 0 HIADRP C[C@@H]1[C@@H]([NH+]2CCCC2)CCN1C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000483301661 898932623 /nfs/dbraw/zinc/93/26/23/898932623.db2.gz UPVHOJDFXAPNST-YKSBVNFPSA-N 2 0 412.622 4.219 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(-c4cccc(F)c4F)o3)CC2)CC1 ZINC000483314318 898942251 /nfs/dbraw/zinc/94/22/51/898942251.db2.gz ZXXNVUVWYTZRIV-UHFFFAOYSA-N 2 0 403.517 4.074 20 0 HIADRP CC(C)N1CCc2nc(NC(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)sc2C1 ZINC000483449802 899085966 /nfs/dbraw/zinc/08/59/66/899085966.db2.gz ZYKQOPJAMTURGO-UHFFFAOYSA-N 2 0 412.603 4.150 20 0 HIADRP C[N@@H+]1CCCC[C@H]1CCN1CC[NH+](CCOC(c2ccccc2)c2ccccc2)CC1 ZINC000483503582 899162808 /nfs/dbraw/zinc/16/28/08/899162808.db2.gz UWIISIJPRYFNRA-SANMLTNESA-N 2 0 421.629 4.285 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000483512808 899172868 /nfs/dbraw/zinc/17/28/68/899172868.db2.gz KRCYQYVIKLPTOI-GOSISDBHSA-N 2 0 413.635 4.114 20 0 HIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000483518953 899179881 /nfs/dbraw/zinc/17/98/81/899179881.db2.gz NIMXPQJANSJZTL-GOSISDBHSA-N 2 0 413.528 4.229 20 0 HIADRP O=C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)NC1CC[NH+](C2CCCC2)CC1 ZINC000483705722 899361160 /nfs/dbraw/zinc/36/11/60/899361160.db2.gz ADLYWUAKTZDPEY-JOCHJYFZSA-N 2 0 419.013 4.183 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC2CC[NH+](C3CCCC3)CC2)C1 ZINC000483711943 899367326 /nfs/dbraw/zinc/36/73/26/899367326.db2.gz PGESPXURLXNXHP-FQEVSTJZSA-N 2 0 412.622 4.125 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)C[C@@H]1C ZINC000483739525 899401324 /nfs/dbraw/zinc/40/13/24/899401324.db2.gz GRECDSLJLFVUFU-NZQKXSOJSA-N 2 0 400.611 4.077 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@@H](C)c3ccc(OCC[NH+](C)C)cc3)ccc2NC1=O ZINC000483846972 899527993 /nfs/dbraw/zinc/52/79/93/899527993.db2.gz CTNQWZZSRITOMC-HOIFWPIMSA-N 2 0 411.546 4.148 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cccc(-c2ccncc2)c1 ZINC000484273733 899845099 /nfs/dbraw/zinc/84/50/99/899845099.db2.gz BOGIKLDBQYHORT-LJQANCHMSA-N 2 0 408.590 4.026 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(F)c(Cl)cc1Cl ZINC000484298970 899861372 /nfs/dbraw/zinc/86/13/72/899861372.db2.gz NSGWCQSHIRXELX-ZDUSSCGKSA-N 2 0 418.384 4.410 20 0 HIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)cc1 ZINC000484308287 899867831 /nfs/dbraw/zinc/86/78/31/899867831.db2.gz ZTRBXWBNDAVRLM-GOSISDBHSA-N 2 0 405.652 4.464 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(OC(F)F)cc1 ZINC000484469616 899964061 /nfs/dbraw/zinc/96/40/61/899964061.db2.gz CUXRCIWLRUTPNA-QFIPXVFZSA-N 2 0 404.501 4.486 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000484490233 899982640 /nfs/dbraw/zinc/98/26/40/899982640.db2.gz XHTIPJSYAPULFK-XLIONFOSSA-N 2 0 415.965 4.177 20 0 HIADRP COc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(SC)cc1OC ZINC000486504799 901655200 /nfs/dbraw/zinc/65/52/00/901655200.db2.gz KMUISNBSAQDZRC-PKOBYXMFSA-N 2 0 400.588 4.426 20 0 HIADRP C[C@H]([NH2+]Cc1cnc2ccc(Br)cn12)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486505720 901657107 /nfs/dbraw/zinc/65/71/07/901657107.db2.gz MOPLPIFBCGTQOX-FUHWJXTLSA-N 2 0 413.363 4.097 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)CC2CC[NH+](C)CC2)cc1)C[C@@H]1CCCCO1 ZINC000486842413 901890272 /nfs/dbraw/zinc/89/02/72/901890272.db2.gz PZZWWZIKEDWKFL-QHCPKHFHSA-N 2 0 401.595 4.137 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](C2c3ccccc3-c3ccccc32)CC1 ZINC000487773693 902356319 /nfs/dbraw/zinc/35/63/19/902356319.db2.gz PLZHTKAOPAMBHU-UHFFFAOYSA-N 2 0 417.597 4.461 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CC[NH+](C2CCC2)C[C@H](C)C1 ZINC000488139332 902635822 /nfs/dbraw/zinc/63/58/22/902635822.db2.gz YKXUQGALLDBWIR-LEWJYISDSA-N 2 0 412.622 4.077 20 0 HIADRP Cc1nc(C(C)(C)[NH2+]CCOCC[NH2+]C(C)(C)c2nc(C)c(C)s2)sc1C ZINC000489624386 903503316 /nfs/dbraw/zinc/50/33/16/903503316.db2.gz SGNGZMWXDNCCKA-UHFFFAOYSA-N 2 0 410.653 4.199 20 0 HIADRP C[C@H](c1ccc(F)cc1)N(C)C(=O)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000489648595 903513352 /nfs/dbraw/zinc/51/33/52/903513352.db2.gz LYJVIOYEXNWUID-HXUWFJFHSA-N 2 0 411.565 4.189 20 0 HIADRP CCC(CC)[C@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[NH+]1CCCC1 ZINC000489880975 903649408 /nfs/dbraw/zinc/64/94/08/903649408.db2.gz FLDJGFAIZCRBFL-DEOSSOPVSA-N 2 0 414.638 4.193 20 0 HIADRP C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506047354 914742996 /nfs/dbraw/zinc/74/29/96/914742996.db2.gz KJFFFFCGGAYYIF-KRWDZBQOSA-N 2 0 418.969 4.275 20 0 HIADRP c1ccc([C@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c2ccccn2)cc1 ZINC000490163770 903803996 /nfs/dbraw/zinc/80/39/96/903803996.db2.gz HEZAOWDLHBTLQP-SANMLTNESA-N 2 0 400.570 4.363 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H](c1ccccc1)c1ccc(OC(F)F)cc1)N1CC[NH+](C)CC1 ZINC000490163837 903805034 /nfs/dbraw/zinc/80/50/34/903805034.db2.gz HVOIIKDJQOCCBI-DHIUTWEWSA-N 2 0 417.544 4.239 20 0 HIADRP COc1cc(C)c(C[N@H+](C)Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1OC ZINC000506056132 914756488 /nfs/dbraw/zinc/75/64/88/914756488.db2.gz REWSIEBSKRFGJH-UHFFFAOYSA-N 2 0 411.590 4.175 20 0 HIADRP C[NH+]1CCC(CC[NH2+][C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491009683 904368060 /nfs/dbraw/zinc/36/80/60/904368060.db2.gz RDTNOGSLYMWHOS-JOCHJYFZSA-N 2 0 421.006 4.154 20 0 HIADRP O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000506182102 914836187 /nfs/dbraw/zinc/83/61/87/914836187.db2.gz DHMGYNFLIREFPG-QFIPXVFZSA-N 2 0 416.610 4.104 20 0 HIADRP COc1ccc([C@@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)c2ccccc2Cl)cc1 ZINC000492254998 904824943 /nfs/dbraw/zinc/82/49/43/904824943.db2.gz XRYIUEGLCQWICK-AUSIDOKSSA-N 2 0 402.966 4.265 20 0 HIADRP COc1cc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1OCc1ccncc1 ZINC000512388712 921124436 /nfs/dbraw/zinc/12/44/36/921124436.db2.gz YCNFMKPYSJLNLX-UGKGYDQZSA-N 2 0 409.574 4.412 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000512407296 921140900 /nfs/dbraw/zinc/14/09/00/921140900.db2.gz VGTMIAPMTBMSRN-QPPBQGQZSA-N 2 0 414.638 4.051 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccc(Br)c(Cl)c1 ZINC000494196613 905532066 /nfs/dbraw/zinc/53/20/66/905532066.db2.gz YCJNPDSIIMDCHM-GOSISDBHSA-N 2 0 423.782 4.349 20 0 HIADRP C[C@@H](CCSc1ccccc1)[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000512438538 921162201 /nfs/dbraw/zinc/16/22/01/921162201.db2.gz GQAMERHVTDIWAN-LADGPHEKSA-N 2 0 409.643 4.449 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(F)c(Cl)c1 ZINC000495460917 906465343 /nfs/dbraw/zinc/46/53/43/906465343.db2.gz NUVAUJMOQXUYMN-HNAYVOBHSA-N 2 0 403.929 4.027 20 0 HIADRP Cc1nc(NC(=O)[C@H](C)NCc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)sc1C ZINC000495548236 906500290 /nfs/dbraw/zinc/50/02/90/906500290.db2.gz PGGOUYGGYJRNDX-NUJGCVRESA-N 2 0 414.619 4.355 20 0 HIADRP CCCC[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)C(=O)Nc1cc(C)on1 ZINC000495766140 906547634 /nfs/dbraw/zinc/54/76/34/906547634.db2.gz OGMCFPJXIDSPID-IBGZPJMESA-N 2 0 404.580 4.044 20 0 HIADRP Cc1ccc([C@H](OC[C@H](O)C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c2ccccc2)cc1 ZINC000512581662 921248161 /nfs/dbraw/zinc/24/81/61/921248161.db2.gz JGYVEMOWZHUNNL-UXYYBULGSA-N 2 0 408.586 4.019 20 0 HIADRP O=C1CCCN1Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000512636731 921269679 /nfs/dbraw/zinc/26/96/79/921269679.db2.gz NNOWVLVZXVVSJX-UODIDJSMSA-N 2 0 417.597 4.199 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)Nc1ccc(F)cc1F ZINC000497295086 906828947 /nfs/dbraw/zinc/82/89/47/906828947.db2.gz QDIPEVKSODHPIE-QGZVFWFLSA-N 2 0 401.501 4.458 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+](CC3CCCC3)CC2)[C@H]1c1cccs1 ZINC000497561646 907048513 /nfs/dbraw/zinc/04/85/13/907048513.db2.gz KTAHGOZSUBSTNB-UGKGYDQZSA-N 2 0 418.651 4.085 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1)c1ccco1 ZINC000497631999 907112759 /nfs/dbraw/zinc/11/27/59/907112759.db2.gz FTLBQQHUWDWVQW-IPJJNNNSSA-N 2 0 412.578 4.234 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@H]32)cc1 ZINC000498122935 907635017 /nfs/dbraw/zinc/63/50/17/907635017.db2.gz BJLYVCWXAVMANL-ILBGXUMGSA-N 2 0 420.601 4.041 20 0 HIADRP CN(c1ccccc1C[NH2+]CCc1csc(C(C)(C)C)n1)C1CC[NH+](C)CC1 ZINC000498372878 907863527 /nfs/dbraw/zinc/86/35/27/907863527.db2.gz JBKYAPKMJURORS-UHFFFAOYSA-N 2 0 400.636 4.303 20 0 HIADRP FC(F)(F)CN1CCC(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499238944 908604933 /nfs/dbraw/zinc/60/49/33/908604933.db2.gz XYYZJELWWVWKBH-DKUWSORSSA-N 2 0 409.540 4.436 20 0 HIADRP CSc1ccc([C@H](C)[NH2+]CC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)cc1 ZINC000500247188 909736866 /nfs/dbraw/zinc/73/68/66/909736866.db2.gz APUOJCMHBQSXNP-IBGZPJMESA-N 2 0 411.615 4.148 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NCC1([NH2+][C@@H](C)c2ccccc2)CCOCC1)c1ccccc1 ZINC000500495167 909890147 /nfs/dbraw/zinc/89/01/47/909890147.db2.gz UORZLLRQAUWDEY-XUZZJYLKSA-N 2 0 423.601 4.086 20 0 HIADRP CCOc1cc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc(Cl)c1O ZINC000513104275 921551835 /nfs/dbraw/zinc/55/18/35/921551835.db2.gz GAZFSRPRSNFYKU-UHFFFAOYSA-N 2 0 417.981 4.136 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000501049278 910259146 /nfs/dbraw/zinc/25/91/46/910259146.db2.gz ASFQRPFYHVQPMW-SIKLNZKXSA-N 2 0 421.029 4.288 20 0 HIADRP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@H+](CCCN2CC[NH+](C(C)C)CC2)C1 ZINC000501055938 910266916 /nfs/dbraw/zinc/26/69/16/910266916.db2.gz BTTCJLUNHIQGIX-QFIPXVFZSA-N 2 0 411.638 4.213 20 0 HIADRP C[C@H](C(=O)Nc1cc(Cl)ccc1F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501055362 910267753 /nfs/dbraw/zinc/26/77/53/910267753.db2.gz VRHKAOINSPAEET-OAHLLOKOSA-N 2 0 404.917 4.050 20 0 HIADRP C[C@H]1CCN(C(=O)C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c2ccccc2S1 ZINC000501083939 910283303 /nfs/dbraw/zinc/28/33/03/910283303.db2.gz WKGHOJMQMGBKCC-IBGZPJMESA-N 2 0 424.614 4.147 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)c1ccsc1 ZINC000501124698 910308876 /nfs/dbraw/zinc/30/88/76/910308876.db2.gz GGUXPDIHFHQAPF-YADHBBJMSA-N 2 0 414.619 4.267 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccsc1 ZINC000501166821 910337134 /nfs/dbraw/zinc/33/71/34/910337134.db2.gz ZWHUKFAYIFNMQJ-JOCHJYFZSA-N 2 0 414.619 4.226 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000501375328 910502437 /nfs/dbraw/zinc/50/24/37/910502437.db2.gz ACKBZDUTCUAKAT-UHFFFAOYSA-N 2 0 422.523 4.033 20 0 HIADRP c1ccc(CN2CC[NH+](CCCC[NH2+][C@@H]3CCC[C@@H](c4cccnc4)C3)CC2)cc1 ZINC000501384619 910514655 /nfs/dbraw/zinc/51/46/55/910514655.db2.gz AGCATDODERNOAG-AOYPEHQESA-N 2 0 406.618 4.295 20 0 HIADRP COC(=O)c1cccc(-c2nc(C[NH+]3CCC(CCC[NH+](C)C)CC3)cs2)c1 ZINC000501768986 910823569 /nfs/dbraw/zinc/82/35/69/910823569.db2.gz GLMNJTYHKJOBIN-UHFFFAOYSA-N 2 0 401.576 4.151 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2nc(-c3ccccc3C)no2)CC1 ZINC000501773186 910828198 /nfs/dbraw/zinc/82/81/98/910828198.db2.gz GRXCQGDVEJSRCR-LJQANCHMSA-N 2 0 400.567 4.176 20 0 HIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC1 ZINC000501773817 910829078 /nfs/dbraw/zinc/82/90/78/910829078.db2.gz MMYZWQHKBNQGPG-UHFFFAOYSA-N 2 0 417.395 4.460 20 0 HIADRP COCC[N@H+](C)CCCC1CCN([C@@H](C)c2nc3sc(C)c(C)c3c(=O)[nH]2)CC1 ZINC000501788239 910841093 /nfs/dbraw/zinc/84/10/93/910841093.db2.gz DSBGBJSDWPVFIF-INIZCTEOSA-N 2 0 420.623 4.145 20 0 HIADRP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000501793558 910845606 /nfs/dbraw/zinc/84/56/06/910845606.db2.gz AQHKSJNPYFTFLB-SFTDATJTSA-N 2 0 412.603 4.021 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2nnc(-c3ccc(C)cc3)o2)CC1 ZINC000501819449 910867618 /nfs/dbraw/zinc/86/76/18/910867618.db2.gz XCNSQHVIESHJRJ-LJQANCHMSA-N 2 0 400.567 4.176 20 0 HIADRP CSc1nnc(CCC[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)n1CC(C)C ZINC000513208411 921624825 /nfs/dbraw/zinc/62/48/25/921624825.db2.gz SQECCNLZVLHUAN-ICSRJNTNSA-N 2 0 407.672 4.221 20 0 HIADRP c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+][C@H]3CCCC34CCOCC4)CC2)cc1 ZINC000502282524 911234388 /nfs/dbraw/zinc/23/43/88/911234388.db2.gz CEFRADXLZIHTBS-SANMLTNESA-N 2 0 419.613 4.448 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CCC[C@H](c2ncc3n2CCCC3)C1)C1CC[NH+](C)CC1 ZINC000502331648 911311145 /nfs/dbraw/zinc/31/11/45/911311145.db2.gz JHDMDRFZTQBCTO-QFIPXVFZSA-N 2 0 421.633 4.129 20 0 HIADRP CC(C)[N@@H+]1CCC[C@H](CNC(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)C1 ZINC000502763269 911786261 /nfs/dbraw/zinc/78/62/61/911786261.db2.gz NUBRKLLKDVMSDS-NHCUHLMSSA-N 2 0 400.611 4.070 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NC[C@H](c2cccs2)[NH+]2CCC(C)CC2)CC1 ZINC000502803513 911822042 /nfs/dbraw/zinc/82/20/42/911822042.db2.gz QJISEFCNKMWQMS-OAQYLSRUSA-N 2 0 420.667 4.332 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)C1 ZINC000502826457 911839830 /nfs/dbraw/zinc/83/98/30/911839830.db2.gz TWPAENLQTAZQNL-JOCHJYFZSA-N 2 0 422.617 4.179 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)CC(C)C ZINC000502927812 911914157 /nfs/dbraw/zinc/91/41/57/911914157.db2.gz FHMMJNGAJZEGFQ-HSZRJFAPSA-N 2 0 402.627 4.049 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NCc1cccc(C[NH+]2CCCC2)c1)c1ccccc1 ZINC000502960382 911940727 /nfs/dbraw/zinc/94/07/27/911940727.db2.gz NXBQKGHFNDNDAC-FQEVSTJZSA-N 2 0 408.590 4.211 20 0 HIADRP CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000503005742 911980571 /nfs/dbraw/zinc/98/05/71/911980571.db2.gz SVCOBPBDUYNHGN-NRFANRHFSA-N 2 0 414.638 4.193 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)CCCC1)c1ccccc1 ZINC000503107489 912073988 /nfs/dbraw/zinc/07/39/88/912073988.db2.gz MSCMTNNNIOOUCZ-RBBKRZOGSA-N 2 0 424.589 4.379 20 0 HIADRP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000506895324 915691945 /nfs/dbraw/zinc/69/19/45/915691945.db2.gz KPSKSTBRKCFHPW-UHFFFAOYSA-N 2 0 405.384 4.025 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1)c1ccsc1 ZINC000506928239 915730667 /nfs/dbraw/zinc/73/06/67/915730667.db2.gz AMEKTLWSZOMZET-JAXLGGSGSA-N 2 0 420.667 4.427 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC000506948605 915754053 /nfs/dbraw/zinc/75/40/53/915754053.db2.gz GUNKOSXDFWFSKB-ZJSXRUAMSA-N 2 0 414.638 4.324 20 0 HIADRP CSc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000507465332 916234577 /nfs/dbraw/zinc/23/45/77/916234577.db2.gz AFRWSWGADUBUON-MOPGFXCFSA-N 2 0 411.615 4.228 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)ccc2NC1=O ZINC000507487944 916255351 /nfs/dbraw/zinc/25/53/51/916255351.db2.gz SODZGNFRFWSADA-PRWKWXBKSA-N 2 0 419.569 4.357 20 0 HIADRP CCOc1cc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)ccc1OC(F)F ZINC000507711297 916503731 /nfs/dbraw/zinc/50/37/31/916503731.db2.gz XDSXBOPESIUIOB-UHFFFAOYSA-N 2 0 412.521 4.011 20 0 HIADRP CC(C)[NH+](CCN(C)C(=O)NCC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)C(C)C ZINC000508268748 917087277 /nfs/dbraw/zinc/08/72/77/917087277.db2.gz RVWIAFKJVPRQAR-GMAHTHKFSA-N 2 0 402.627 4.047 20 0 HIADRP CC(C)[N@@H+]1CCc2nc(CNc3[nH+]ccn3Cc3ccccc3Cl)sc2C1 ZINC000508449821 917233952 /nfs/dbraw/zinc/23/39/52/917233952.db2.gz AYZXTSRYOJFMGM-UHFFFAOYSA-N 2 0 401.967 4.420 20 0 HIADRP Cc1ccc(C(=O)N2CCC([NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000508700984 917461875 /nfs/dbraw/zinc/46/18/75/917461875.db2.gz VNQAMUFMZPRGTA-XUZZJYLKSA-N 2 0 405.586 4.100 20 0 HIADRP C[C@@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508714575 917475343 /nfs/dbraw/zinc/47/53/43/917475343.db2.gz HLSFVWCSAVWUPW-PXDATVDWSA-N 2 0 407.602 4.213 20 0 HIADRP COc1ccccc1[C@H](CN[C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCCC1 ZINC000508719494 917480654 /nfs/dbraw/zinc/48/06/54/917480654.db2.gz PYTOVLVQSFMWQS-RSEQLOHWSA-N 2 0 407.602 4.332 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccccn2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721149 917483066 /nfs/dbraw/zinc/48/30/66/917483066.db2.gz TWVRQIQNBYAOSY-NFBKMPQASA-N 2 0 414.553 4.334 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@H](C)[C@@H](c2ccccc2C)[NH+](C)C)CC1 ZINC000508856858 917609209 /nfs/dbraw/zinc/60/92/09/917609209.db2.gz WPMSKCJZKHLNQS-OFNKIYASSA-N 2 0 402.627 4.140 20 0 HIADRP Cc1ccccc1[C@@H]([C@@H](C)NC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[NH+](C)C ZINC000508861969 917615251 /nfs/dbraw/zinc/61/52/51/917615251.db2.gz IUVPYISPBTVKBZ-PXDATVDWSA-N 2 0 422.617 4.292 20 0 HIADRP Cc1ccccc1[C@H]([C@H](C)NC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000508882003 917636376 /nfs/dbraw/zinc/63/63/76/917636376.db2.gz OWJGWFGTGLNGHW-PWWKTKHKSA-N 2 0 422.617 4.150 20 0 HIADRP C[C@@H](NC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1)[C@H](c1ccccc1)[NH+](C)C ZINC000508913343 917670553 /nfs/dbraw/zinc/67/05/53/917670553.db2.gz BZUPRKVNPLESNZ-HYBUGGRVSA-N 2 0 423.605 4.021 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+]Cc2ccc(-c3ccccc3Br)cc2)CC1(C)C ZINC000509439864 918095205 /nfs/dbraw/zinc/09/52/05/918095205.db2.gz QFGBKYMDDHUUQS-UHFFFAOYSA-N 2 0 416.407 4.232 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+]Cc1ccc(-c2ccccc2Br)cc1 ZINC000509473722 918120777 /nfs/dbraw/zinc/12/07/77/918120777.db2.gz XIIUWCCYXLZCTI-FQEVSTJZSA-N 2 0 417.391 4.443 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+]Cc2ccc(-c3ccccc3Br)cc2)CC1 ZINC000509528411 918175844 /nfs/dbraw/zinc/17/58/44/918175844.db2.gz QDFMOJHJFLTVHS-UHFFFAOYSA-N 2 0 416.407 4.232 20 0 HIADRP C[C@H]1C[C@@H](CCNC(=O)NCCCC[N@@H+]2CCCC[C@H]2C)C[NH+]1Cc1ccccc1 ZINC000509793910 918400390 /nfs/dbraw/zinc/40/03/90/918400390.db2.gz YJZZZFDLOZFTTO-AOHZBQACSA-N 2 0 414.638 4.241 20 0 HIADRP CC(C)[C@H](CNC(=O)c1oc2ccccc2c1C[NH+](C)C)[N@@H+]1CCc2ccccc2C1 ZINC000510316073 918825852 /nfs/dbraw/zinc/82/58/52/918825852.db2.gz QDSNXDBQOIFUQO-QHCPKHFHSA-N 2 0 419.569 4.307 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCc4ccc(Br)cc43)cc2)CC1 ZINC000510673109 919113523 /nfs/dbraw/zinc/11/35/23/919113523.db2.gz YTSIQNYFLMITER-QFIPXVFZSA-N 2 0 415.375 4.183 20 0 HIADRP C[NH+](C)CC[C@H]([NH2+]C1CCC(NC(=O)COc2ccc(Cl)cc2)CC1)C(C)(C)C ZINC000511047901 919638576 /nfs/dbraw/zinc/63/85/76/919638576.db2.gz ZYXYHAKJNPXDDK-GRERDSQWSA-N 2 0 424.029 4.102 20 0 HIADRP C[C@H](NC(=O)NCCC[NH+](Cc1ccccc1)Cc1ccccc1)C1=CC[N@H+](C)CC1 ZINC000511237015 919841809 /nfs/dbraw/zinc/84/18/09/919841809.db2.gz YPXHOYOHLDKFBE-QFIPXVFZSA-N 2 0 420.601 4.029 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NC2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000511284763 919880213 /nfs/dbraw/zinc/88/02/13/919880213.db2.gz ZNAIWFXKMMMKAP-UHFFFAOYSA-N 2 0 407.602 4.355 20 0 HIADRP CCOCCOc1ccc(Br)cc1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000511458149 920066658 /nfs/dbraw/zinc/06/66/58/920066658.db2.gz GIFYATFLYFTGBJ-UHFFFAOYSA-N 2 0 413.400 4.028 20 0 HIADRP COc1ccc(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c(OC)c1OC ZINC000512287612 921042534 /nfs/dbraw/zinc/04/25/34/921042534.db2.gz IYXZJXLGPDMLLX-RJGXRXQPSA-N 2 0 424.585 4.145 20 0 HIADRP CN(c1ccccc1C[N@H+](C)C1CCN(Cc2ccccc2)CC1)C1CC[NH+](C)CC1 ZINC000513491337 921844111 /nfs/dbraw/zinc/84/41/11/921844111.db2.gz SUZNRJVPYAURKW-UHFFFAOYSA-N 2 0 420.645 4.313 20 0 HIADRP Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513495273 921845746 /nfs/dbraw/zinc/84/57/46/921845746.db2.gz NMTZSMCJFWAREQ-VQIMIIECSA-N 2 0 424.511 4.060 20 0 HIADRP C/C(=C/c1ccc(Cl)cc1)C[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000513545339 921883360 /nfs/dbraw/zinc/88/33/60/921883360.db2.gz PTDLBKYSKGYGJO-OFFMQOAPSA-N 2 0 411.977 4.230 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)c1OC ZINC000513683379 922005179 /nfs/dbraw/zinc/00/51/79/922005179.db2.gz JTMCTHRSVJJLCW-WSTZPKSXSA-N 2 0 412.574 4.472 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H]3CC4(CCCCC4)Oc4ccccc43)ccn2)CC1 ZINC000513787949 922114406 /nfs/dbraw/zinc/11/44/06/922114406.db2.gz HZGGGAWGAJDMDD-QFIPXVFZSA-N 2 0 406.574 4.150 20 0 HIADRP Cc1ccc([C@H](OC[C@@H](O)C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c2ccccc2)cc1 ZINC000514005692 922330590 /nfs/dbraw/zinc/33/05/90/922330590.db2.gz PIIKEQMCSQSTLR-IZZNHLLZSA-N 2 0 410.602 4.267 20 0 HIADRP Cc1nn(C)c(OCC(F)(F)F)c1C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000514095640 922419715 /nfs/dbraw/zinc/41/97/15/922419715.db2.gz SCKNTSIHWBWVEJ-UHFFFAOYSA-N 2 0 424.511 4.014 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000514150022 922486054 /nfs/dbraw/zinc/48/60/54/922486054.db2.gz VWPHSZHJYVKNGC-HSZRJFAPSA-N 2 0 424.589 4.292 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)NC[C@H](c2ccccc2Cl)[NH+]2CCCC2)C1 ZINC000514458875 922635726 /nfs/dbraw/zinc/63/57/26/922635726.db2.gz DUXHVZQWKTWLNA-SIKLNZKXSA-N 2 0 421.029 4.288 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000514818788 922813825 /nfs/dbraw/zinc/81/38/25/922813825.db2.gz WBNRKGKISFXDKF-UHFFFAOYSA-N 2 0 413.631 4.475 20 0 HIADRP Cc1c2cccc(Cl)c2sc1C[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000515314580 923045517 /nfs/dbraw/zinc/04/55/17/923045517.db2.gz FSLLWLQIUMOQGO-UHFFFAOYSA-N 2 0 400.979 4.300 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(=O)Nc1ccc(F)c(F)c1 ZINC000515519021 923151439 /nfs/dbraw/zinc/15/14/39/923151439.db2.gz BMLQTPZNTREJDU-IRXDYDNUSA-N 2 0 401.501 4.456 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(=O)Nc1ccc(F)c(F)c1 ZINC000515519022 923151812 /nfs/dbraw/zinc/15/18/12/923151812.db2.gz BMLQTPZNTREJDU-SJORKVTESA-N 2 0 401.501 4.456 20 0 HIADRP COc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c(OC)c1OC ZINC000516637646 923825085 /nfs/dbraw/zinc/82/50/85/923825085.db2.gz YXGXFEXNUZUEKC-UHFFFAOYSA-N 2 0 410.558 4.201 20 0 HIADRP CC(C)[C@@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)[N@@H+]1CCc2ccccc2C1 ZINC000516843434 923915303 /nfs/dbraw/zinc/91/53/03/923915303.db2.gz IHACVNNRMKAMJL-RUZDIDTESA-N 2 0 405.586 4.095 20 0 HIADRP O=C(C[N@@H+](Cc1ccccc1C(F)(F)F)C1CCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000517135099 924018373 /nfs/dbraw/zinc/01/83/73/924018373.db2.gz JAILFTGYYXCGGY-UHFFFAOYSA-N 2 0 423.523 4.193 20 0 HIADRP CN(C)c1ncc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)cn1 ZINC000518768266 927483468 /nfs/dbraw/zinc/48/34/68/927483468.db2.gz LXEONEJPBKSUFQ-UHFFFAOYSA-N 2 0 401.558 4.095 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000518888669 927600862 /nfs/dbraw/zinc/60/08/62/927600862.db2.gz LWKMPZMNJZHWHI-JWQCQUIFSA-N 2 0 402.586 4.432 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)N3CCCC[C@@H]([NH+]4CCCC4)C3)cc2)CC1 ZINC000519384097 927911418 /nfs/dbraw/zinc/91/14/18/927911418.db2.gz DUEINHBPPDNPNM-XMMPIXPASA-N 2 0 412.622 4.078 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000520215260 928393695 /nfs/dbraw/zinc/39/36/95/928393695.db2.gz TYWPCRJBQGQLBF-FQEVSTJZSA-N 2 0 416.009 4.282 20 0 HIADRP CC(C)(C)[N@@H+]1CCCN(C(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)CC1 ZINC000520296809 928458087 /nfs/dbraw/zinc/45/80/87/928458087.db2.gz TWTNVNJQEJMOOE-UHFFFAOYSA-N 2 0 400.611 4.078 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCNC(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000520726337 928777173 /nfs/dbraw/zinc/77/71/73/928777173.db2.gz LIOUCKGAWPZYPA-LJQANCHMSA-N 2 0 421.029 4.116 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)N3CCCC[C@H]([NH+]4CCCC4)C3)c2)CC1 ZINC000520791380 928820429 /nfs/dbraw/zinc/82/04/29/928820429.db2.gz VTKVRXBVDULQGQ-DEOSSOPVSA-N 2 0 412.622 4.078 20 0 HIADRP c1sc(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)nc1-c1ccccc1 ZINC000520955635 928888331 /nfs/dbraw/zinc/88/83/31/928888331.db2.gz AAMTUNHHWCABAJ-UHFFFAOYSA-N 2 0 420.626 4.498 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(CNC(=O)c2ccc(C[NH+]3CCSCC3)cc2)c1 ZINC000521141034 929019932 /nfs/dbraw/zinc/01/99/32/929019932.db2.gz HRAOVJSLMKGAAN-UHFFFAOYSA-N 2 0 411.615 4.006 20 0 HIADRP CN1CC[NH+](CCCC[NH2+]Cc2ccc(-c3ccc(Br)cc3)s2)CC1 ZINC000521816138 929473946 /nfs/dbraw/zinc/47/39/46/929473946.db2.gz LWRCGJSPYWRSQN-UHFFFAOYSA-N 2 0 422.436 4.295 20 0 HIADRP O=C(NC[C@@H]1CCC[N@@H+]1CC1CCCCC1)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000524638224 929749006 /nfs/dbraw/zinc/74/90/06/929749006.db2.gz IVKXJGKNDFRDPI-QHCPKHFHSA-N 2 0 415.647 4.010 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@H]2CCCC[N@@H+]2Cc2ccccc2)CC1 ZINC000525311567 930149866 /nfs/dbraw/zinc/14/98/66/930149866.db2.gz MNHISDMXARNQJB-PXDATVDWSA-N 2 0 405.586 4.383 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000525402567 930220897 /nfs/dbraw/zinc/22/08/97/930220897.db2.gz PKYBYSZHTJPOOH-ZLNRFVROSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC1 ZINC000525636974 930377098 /nfs/dbraw/zinc/37/70/98/930377098.db2.gz UJOZDERZQDLQOP-IBGZPJMESA-N 2 0 401.639 4.461 20 0 HIADRP C[N@@H+]1CC[C@H](NC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)[C@@H]1c1ccccc1 ZINC000530356647 930691968 /nfs/dbraw/zinc/69/19/68/930691968.db2.gz MXDCBWYBJHZCTC-ZEQRLZLVSA-N 2 0 406.574 4.282 20 0 HIADRP COC(=O)c1cc2c(o1)c(OC)ccc2C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000530664822 930792580 /nfs/dbraw/zinc/79/25/80/930792580.db2.gz OCHGMASJNHRZEL-UHFFFAOYSA-N 2 0 400.519 4.115 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)C[C@H]1C ZINC000531140686 930940632 /nfs/dbraw/zinc/94/06/32/930940632.db2.gz FNHLALPFUPLUHT-NDEVUPSOSA-N 2 0 410.602 4.267 20 0 HIADRP C[C@@H](CC[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)[N@H+](C)Cc1ccccc1 ZINC000531595488 931114305 /nfs/dbraw/zinc/11/43/05/931114305.db2.gz LRYZJCPITDWVEL-QFIPXVFZSA-N 3 0 408.634 4.217 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531682357 931150681 /nfs/dbraw/zinc/15/06/81/931150681.db2.gz MWQGODATWYXEQO-VAMGGRTRSA-N 2 0 414.615 4.419 20 0 HIADRP COc1cc(C[NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)ccc1OCC(F)(F)F ZINC000531691796 931156068 /nfs/dbraw/zinc/15/60/68/931156068.db2.gz HBKLTURVKKMKOQ-APWZRJJASA-N 2 0 423.479 4.032 20 0 HIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]C[C@@H](c2cccc(F)c2)N2CCOCC2)cc1 ZINC000531697151 931161415 /nfs/dbraw/zinc/16/14/15/931161415.db2.gz ZMJQVBSPESLMQN-UUOWRZLLSA-N 2 0 408.521 4.044 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000531937517 931253719 /nfs/dbraw/zinc/25/37/19/931253719.db2.gz JGDDWDJCWKFTQA-VAMGGRTRSA-N 2 0 414.615 4.419 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531944002 931256921 /nfs/dbraw/zinc/25/69/21/931256921.db2.gz OUHJRLOWFRKIPF-LJQANCHMSA-N 2 0 400.588 4.173 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@@H](C)CC(=O)Nc3ccccc3C)CC2)c1 ZINC000531944989 931257513 /nfs/dbraw/zinc/25/75/13/931257513.db2.gz RQRUTRBRIBYZCL-QHCPKHFHSA-N 2 0 422.617 4.213 20 0 HIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)C1 ZINC000531958623 931265004 /nfs/dbraw/zinc/26/50/04/931265004.db2.gz QRUFTPQHSHRQFI-CVEARBPZSA-N 2 0 401.473 4.012 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1 ZINC000531959576 931265914 /nfs/dbraw/zinc/26/59/14/931265914.db2.gz KCOUTLCUCSJBJC-IBGZPJMESA-N 2 0 424.589 4.024 20 0 HIADRP CN(c1ccccc1C[NH2+][C@@H]1CCCN(c2cccc(F)c2)C1)C1CC[NH+](C)CC1 ZINC000532105102 931313603 /nfs/dbraw/zinc/31/36/03/931313603.db2.gz XVZISYUJBRVBKA-JOCHJYFZSA-N 2 0 410.581 4.115 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000532106822 931314232 /nfs/dbraw/zinc/31/42/32/931314232.db2.gz HWAXJFYOBLTSRC-SZPZYZBQSA-N 3 0 400.655 4.065 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)C1CC[NH+](C)CC1 ZINC000532108415 931315629 /nfs/dbraw/zinc/31/56/29/931315629.db2.gz UOKPUIMOEFTGMR-UHFFFAOYSA-N 3 0 420.645 4.493 20 0 HIADRP COc1ccc(CC[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c(Cl)c1 ZINC000532120308 931320878 /nfs/dbraw/zinc/32/08/78/931320878.db2.gz MEAQROXQITVOQN-UHFFFAOYSA-N 2 0 401.982 4.211 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000532193084 931343502 /nfs/dbraw/zinc/34/35/02/931343502.db2.gz OBTUIAMRMMMJMX-JLZZUVOBSA-N 2 0 403.876 4.292 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000532196137 931345146 /nfs/dbraw/zinc/34/51/46/931345146.db2.gz ZDDKAAUVPJJBER-CHWSQXEVSA-N 2 0 403.876 4.150 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000532222659 931360522 /nfs/dbraw/zinc/36/05/22/931360522.db2.gz BAOIMRZFDYESQQ-MRXNPFEDSA-N 2 0 405.945 4.068 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000532249466 931372019 /nfs/dbraw/zinc/37/20/19/931372019.db2.gz YRGYLZYHWWGTAH-QFIPXVFZSA-N 2 0 400.950 4.300 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(-n3ccnc3C)c(F)c2)CC1 ZINC000532296685 931389142 /nfs/dbraw/zinc/38/91/42/931389142.db2.gz YVKLBABQQSUMRN-UHFFFAOYSA-N 2 0 421.564 4.142 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCSc4ccc(Cl)cc43)cn2)CC1 ZINC000532451676 931440311 /nfs/dbraw/zinc/44/03/11/931440311.db2.gz HNKNOHJDMFIUOJ-IBGZPJMESA-N 2 0 402.995 4.204 20 0 HIADRP CC[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1OC(F)F ZINC000532481118 931455735 /nfs/dbraw/zinc/45/57/35/931455735.db2.gz OXLKUMSYHOTUKE-LEWJYISDSA-N 2 0 403.517 4.317 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000532551143 931519583 /nfs/dbraw/zinc/51/95/83/931519583.db2.gz XXPCMJLNFPVIGW-HNNXBMFYSA-N 2 0 408.384 4.163 20 0 HIADRP CC(=O)N(c1nc(C[NH2+]C2CCC(C[NH+](C)C)CC2)cs1)c1ccc(F)cc1 ZINC000532724305 931609946 /nfs/dbraw/zinc/60/99/46/931609946.db2.gz RSDMBTLKMKFNOF-UHFFFAOYSA-N 2 0 404.555 4.177 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+]Cc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 ZINC000532805405 931634496 /nfs/dbraw/zinc/63/44/96/931634496.db2.gz VINXOOSCZQUTGS-UHFFFAOYSA-N 2 0 413.418 4.234 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+]Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)CC1 ZINC000532934449 931703332 /nfs/dbraw/zinc/70/33/32/931703332.db2.gz VIDBRHZZNFCQQL-UHFFFAOYSA-N 2 0 423.445 4.372 20 0 HIADRP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)ccc1OCc1c(C)noc1C ZINC000532985558 931727004 /nfs/dbraw/zinc/72/70/04/931727004.db2.gz UFZIQJWVQPMTCP-NRFANRHFSA-N 2 0 415.578 4.337 20 0 HIADRP CC(C)[NH+]1CCN([C@H]2CC[N@@H+]([C@@H](C)c3cccc(NC(=O)c4ccccc4)c3)C2)CC1 ZINC000533308221 931835092 /nfs/dbraw/zinc/83/50/92/931835092.db2.gz LYKYXPLVECEQDE-OFVILXPXSA-N 2 0 420.601 4.100 20 0 HIADRP C[C@H]([NH2+][C@H](c1ccc(F)cc1)C1CCC1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000533377045 931852965 /nfs/dbraw/zinc/85/29/65/931852965.db2.gz XGVLAYWILWLBHL-DFBJGRDBSA-N 2 0 423.576 4.426 20 0 HIADRP c1cc(C[NH+]2CC[C@H](C3CCOCC3)C2)cc(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)c1 ZINC000533669626 931960926 /nfs/dbraw/zinc/96/09/26/931960926.db2.gz HTOWSUMJKFKRIV-WMPKNSHKSA-N 2 0 412.618 4.184 20 0 HIADRP C[C@H](C(=O)N1CCc2sccc2C1)[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534232748 932353215 /nfs/dbraw/zinc/35/32/15/932353215.db2.gz OKPBXOSPCOJGTD-HXUWFJFHSA-N 2 0 423.626 4.009 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NCc2ccc(C[NH+](C)C)c(F)c2)CC1 ZINC000534259270 932369221 /nfs/dbraw/zinc/36/92/21/932369221.db2.gz SECHQZZTFDPILX-LJQANCHMSA-N 2 0 418.601 4.073 20 0 HIADRP Cc1nc2sccn2c1C[NH+](C)CCCC[N@@H+](C)Cc1c(C)nc2sccn12 ZINC000535008815 932884007 /nfs/dbraw/zinc/88/40/07/932884007.db2.gz SIZAEYYZLQUZDD-UHFFFAOYSA-N 2 0 416.620 4.066 20 0 HIADRP COc1ccc(C(=O)Nc2cccc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)c2)cc1 ZINC000535811967 933407355 /nfs/dbraw/zinc/40/73/55/933407355.db2.gz MCZGVPKFUKNBCX-UHFFFAOYSA-N 2 0 409.574 4.500 20 0 HIADRP CCO[C@@H]1C[C@@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C12CCCC2 ZINC000537293353 933701058 /nfs/dbraw/zinc/70/10/58/933701058.db2.gz ODIWGRHYDAWTJJ-DNQXCXABSA-N 2 0 416.606 4.004 20 0 HIADRP Cc1cc(Br)cc2cc([C@H]([NH2+]CCCN3CC[NH+](C)CC3)C(C)C)oc21 ZINC000537351754 933731694 /nfs/dbraw/zinc/73/16/94/933731694.db2.gz LVTKTRQRCSEYLO-HXUWFJFHSA-N 2 0 422.411 4.428 20 0 HIADRP CC(C)N1CC[C@H](NC(=O)c2cccc(C[NH+](C)C)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000537521194 938315217 /nfs/dbraw/zinc/31/52/17/938315217.db2.gz MSKKWWKDDAWXJF-FCHUYYIVSA-N 2 0 417.956 4.495 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cc(F)cc(C(F)(F)F)c3)CC2)CC1 ZINC000537620054 938335987 /nfs/dbraw/zinc/33/59/87/938335987.db2.gz OQSXZXIHSKNYFM-UHFFFAOYSA-N 2 0 415.519 4.473 20 0 HIADRP Cc1cc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc(C)c1OCc1ccccn1 ZINC000537620634 938336155 /nfs/dbraw/zinc/33/61/55/938336155.db2.gz VPJZQTFRNHOSOL-UHFFFAOYSA-N 2 0 423.601 4.354 20 0 HIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000537939523 938424198 /nfs/dbraw/zinc/42/41/98/938424198.db2.gz SRGXKDMWPOOVOW-ZJOUEHCJSA-N 2 0 415.603 4.009 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCc3c2cc(Cl)cc3Br)CC1 ZINC000537956872 938432196 /nfs/dbraw/zinc/43/21/96/938432196.db2.gz JJNDEAGOZWCWFM-CEXWTWQISA-N 2 0 413.787 4.057 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000538062860 938491868 /nfs/dbraw/zinc/49/18/68/938491868.db2.gz PEWUWOHOQRSTAN-OAQYLSRUSA-N 2 0 406.496 4.339 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000538102721 938502962 /nfs/dbraw/zinc/50/29/62/938502962.db2.gz OJJHUASAQYQTGM-OAQYLSRUSA-N 2 0 419.491 4.238 20 0 HIADRP CCc1ccc([C@@H](C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)N(C)C)cc1 ZINC000538268833 938579805 /nfs/dbraw/zinc/57/98/05/938579805.db2.gz OBBWBPAHTTYZCN-BJKOFHAPSA-N 2 0 407.602 4.430 20 0 HIADRP C[C@@H](CS(=O)(=O)c1ccccc1)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000538274781 938580666 /nfs/dbraw/zinc/58/06/66/938580666.db2.gz GVWHADAXTUWDKJ-PMACEKPBSA-N 2 0 400.588 4.013 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@@H]1CCCN(c3cccc(F)c3)C1)c1ccccc1O2 ZINC000538293661 938585111 /nfs/dbraw/zinc/58/51/11/938585111.db2.gz LUQANYUTIXJULD-NFBKMPQASA-N 2 0 409.549 4.372 20 0 HIADRP COc1ccc(C[C@H](C)C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1OC ZINC000538308471 938589352 /nfs/dbraw/zinc/58/93/52/938589352.db2.gz UYICYLIYDWSYEW-SIKLNZKXSA-N 2 0 424.585 4.460 20 0 HIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3ccccc3OCc3ccccn3)CC2)C[C@H](C)O1 ZINC000538763619 938705083 /nfs/dbraw/zinc/70/50/83/938705083.db2.gz NDOMHDMXHNGBDI-SZPZYZBQSA-N 2 0 423.601 4.372 20 0 HIADRP CCCOCc1ccccc1C[NH2+]Cc1c(Cl)cccc1N1CC[NH+](C)CC1 ZINC000538851457 938725088 /nfs/dbraw/zinc/72/50/88/938725088.db2.gz NJQIJOHRYYZWLS-UHFFFAOYSA-N 2 0 401.982 4.308 20 0 HIADRP CCOc1ccc(NC(=O)[C@H](C)[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000538943968 938742606 /nfs/dbraw/zinc/74/26/06/938742606.db2.gz YBSMIGPSPCDWOQ-IBGZPJMESA-N 2 0 410.562 4.046 20 0 HIADRP C[C@@H](C(=O)Nc1nc2ccccc2s1)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538944180 938743226 /nfs/dbraw/zinc/74/32/26/938743226.db2.gz OTWJAJKKZKJYIC-KRWDZBQOSA-N 2 0 423.586 4.257 20 0 HIADRP Cc1cc2ncc([C@@H](C)[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)c(C)n2n1 ZINC000538988018 938760524 /nfs/dbraw/zinc/76/05/24/938760524.db2.gz WJMJOWOECNLJLU-HXUWFJFHSA-N 2 0 421.589 4.068 20 0 HIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000539041074 938778082 /nfs/dbraw/zinc/77/80/82/938778082.db2.gz HAZCNCUXENDABX-WSTZPKSXSA-N 2 0 418.578 4.181 20 0 HIADRP COc1ccc(NC(=O)C[C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000539045556 938781309 /nfs/dbraw/zinc/78/13/09/938781309.db2.gz BCPGJMZZRPPLDI-JAXLGGSGSA-N 2 0 409.574 4.303 20 0 HIADRP Cc1cc(C[C@@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)n(-c2ccccc2)n1 ZINC000539048823 938782824 /nfs/dbraw/zinc/78/28/24/938782824.db2.gz VMBAGXQQVWVALS-TZIWHRDSSA-N 2 0 406.574 4.403 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(COC2CCOCC2)cc1 ZINC000539052481 938783686 /nfs/dbraw/zinc/78/36/86/938783686.db2.gz IRMPBBBOYYOKCZ-QFQXNSOFSA-N 2 0 408.586 4.382 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc(Cl)s1 ZINC000539069845 938792703 /nfs/dbraw/zinc/79/27/03/938792703.db2.gz AWNNDOGHHSKSQH-SFHVURJKSA-N 2 0 405.995 4.468 20 0 HIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)CCCO2 ZINC000539072732 938793942 /nfs/dbraw/zinc/79/39/42/938793942.db2.gz GPDDUAUZLLZAGF-HSZRJFAPSA-N 2 0 409.574 4.105 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]C[C@@H](c1ccccc1)N1CCCC1)c1ccccc1O2 ZINC000539369085 938850295 /nfs/dbraw/zinc/85/02/95/938850295.db2.gz BEWYYJBAPYFRAD-RPWUZVMVSA-N 2 0 405.586 4.401 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@@H]1CCN(c3cccc(Cl)c3)C1)c1ccccc1O2 ZINC000539400504 938855002 /nfs/dbraw/zinc/85/50/02/938855002.db2.gz LXTZMALDTMEYLP-DENIHFKCSA-N 2 0 411.977 4.497 20 0 HIADRP C[C@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1nc(-c2ccccc2)no1 ZINC000539409055 938856417 /nfs/dbraw/zinc/85/64/17/938856417.db2.gz IAPINBRKMVZVRB-NQIIRXRSSA-N 2 0 418.541 4.418 20 0 HIADRP CC(C)[NH+]1CCN(c2cccc(N[C@@H](C)[C@@H](c3ccccc3)[NH+]3CCOCC3)c2)CC1 ZINC000539645260 938893092 /nfs/dbraw/zinc/89/30/92/938893092.db2.gz MHNZBKFVEFWSOG-NVQXNPDNSA-N 2 0 422.617 4.091 20 0 HIADRP Cc1c([C@@H](C)Nc2ccc(N3CC[C@H]([NH+](C)C)C3)cn2)cnn1-c1ccc(F)cc1 ZINC000539658518 938895543 /nfs/dbraw/zinc/89/55/43/938895543.db2.gz AVGKFTBYGSYUKU-IERDGZPVSA-N 2 0 408.525 4.028 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)CC1 ZINC000539714228 938909987 /nfs/dbraw/zinc/90/99/87/938909987.db2.gz WKTWCLBJFOPQBV-UHFFFAOYSA-N 3 0 406.618 4.104 20 0 HIADRP CCCOc1cc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)ccc1OC ZINC000539822051 938945515 /nfs/dbraw/zinc/94/55/15/938945515.db2.gz HOZJRKLDFCYOIF-UHFFFAOYSA-N 2 0 417.638 4.112 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccccc1N(C)C ZINC000539857751 938959397 /nfs/dbraw/zinc/95/93/97/938959397.db2.gz DUBJKIKKQJGHFS-FQEVSTJZSA-N 2 0 411.590 4.093 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccc(F)cn1 ZINC000539969276 938982367 /nfs/dbraw/zinc/98/23/67/938982367.db2.gz RIELUUKISPASIB-QGZVFWFLSA-N 2 0 424.486 4.493 20 0 HIADRP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000539990507 939030946 /nfs/dbraw/zinc/03/09/46/939030946.db2.gz ZILTXENYQNGYMF-UHFFFAOYSA-N 2 0 420.601 4.059 20 0 HIADRP Cc1ccc(OCc2nc(C[NH2+]CC3CCN(c4cc[nH+]cc4)CC3)cs2)cc1 ZINC000540067854 939057387 /nfs/dbraw/zinc/05/73/87/939057387.db2.gz ZVRHXSKEAZBFFV-UHFFFAOYSA-N 2 0 408.571 4.432 20 0 HIADRP COc1cc(C)c([C@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc1OC ZINC000540119216 939079752 /nfs/dbraw/zinc/07/97/52/939079752.db2.gz LOCYJAAQBBSOHR-NRFANRHFSA-N 2 0 411.590 4.265 20 0 HIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C3CCN([C@H]4CCC[C@@H]4O)CC3)s2)cc1 ZINC000540160141 939095909 /nfs/dbraw/zinc/09/59/09/939095909.db2.gz JVLGMNKPZRFOCF-JHVJFLLYSA-N 2 0 415.603 4.156 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H](c3cccc(C(F)(F)F)c3)C3CC3)ccn2)CC1 ZINC000540262489 939177055 /nfs/dbraw/zinc/17/70/55/939177055.db2.gz IXNYTEHWANMEHK-NRFANRHFSA-N 2 0 404.480 4.093 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000540303254 939187966 /nfs/dbraw/zinc/18/79/66/939187966.db2.gz SJQVQVLSLOAJFI-OAQYLSRUSA-N 2 0 421.507 4.484 20 0 HIADRP C[C@H]([NH2+]CCC[NH2+][C@@H](C)c1cccc(-n2cccn2)c1)c1cccc(-n2cccn2)c1 ZINC000540390475 939228700 /nfs/dbraw/zinc/22/87/00/939228700.db2.gz XZKYDRRJJWUJGI-SFTDATJTSA-N 2 0 414.557 4.450 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@H]1CCN(c3ccc(F)cc3)C1)c1ccccc1O2 ZINC000540475390 939267260 /nfs/dbraw/zinc/26/72/60/939267260.db2.gz UIMFEMQPMSERPN-XXBNENTESA-N 2 0 409.549 4.230 20 0 HIADRP C[C@H](CCN[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000540494681 939274400 /nfs/dbraw/zinc/27/44/00/939274400.db2.gz HDQRYNJFISTBKU-ZJSXRUAMSA-N 2 0 407.602 4.475 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1cccc(C[NH+]2CCC(CO)CC2)c1 ZINC000540749970 939358444 /nfs/dbraw/zinc/35/84/44/939358444.db2.gz RRMFHMMRLYMXET-QFQXNSOFSA-N 2 0 407.602 4.213 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(OC(F)(F)F)cc1 ZINC000540988583 939425593 /nfs/dbraw/zinc/42/55/93/939425593.db2.gz NUWTXRYXOBUCMP-JXFKEZNVSA-N 2 0 408.464 4.393 20 0 HIADRP CSC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(C(F)(F)F)cc1 ZINC000540988631 939425719 /nfs/dbraw/zinc/42/57/19/939425719.db2.gz HWCJNEMCFOHHKD-LJQANCHMSA-N 2 0 424.536 4.046 20 0 HIADRP COc1cccc(C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccccc2)c1 ZINC000540990388 939426249 /nfs/dbraw/zinc/42/62/49/939426249.db2.gz JWQFXNYTDIMRRE-BDYUSTAISA-N 2 0 416.565 4.335 20 0 HIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)ccc1OC(F)F ZINC000540990654 939426869 /nfs/dbraw/zinc/42/68/69/939426869.db2.gz SMGLPFZMBOVLMN-OXJNMPFZSA-N 2 0 420.500 4.104 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000541536183 939546527 /nfs/dbraw/zinc/54/65/27/939546527.db2.gz CYQJSDPORVGQJN-UHFFFAOYSA-N 3 0 401.558 4.064 20 0 HIADRP O=C1CC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c2ccccc2N1 ZINC000541541518 939548063 /nfs/dbraw/zinc/54/80/63/939548063.db2.gz FFVBWNFWPARRDA-QHCPKHFHSA-N 2 0 407.558 4.121 20 0 HIADRP CCc1ccc([C@H](CN2CCOCC2)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1 ZINC000541552050 939552893 /nfs/dbraw/zinc/55/28/93/939552893.db2.gz CELOFJSCOPOAGG-SANMLTNESA-N 2 0 407.602 4.008 20 0 HIADRP C[C@@H]1C[NH+](CCOc2ccc(CC[NH2+][C@H]3CCC(=O)Nc4ccccc43)cc2)C[C@H]1C ZINC000541564473 939556196 /nfs/dbraw/zinc/55/61/96/939556196.db2.gz RFBZAEVDQAFTPX-REHUZNOOSA-N 2 0 421.585 4.259 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000541744095 939618956 /nfs/dbraw/zinc/61/89/56/939618956.db2.gz BONAREYISDIUOA-AKIFATBCSA-N 2 0 406.636 4.324 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc(F)cc(Br)c1 ZINC000541915113 939652669 /nfs/dbraw/zinc/65/26/69/939652669.db2.gz YFCMTTLYIHLFMZ-LEWJYISDSA-N 2 0 421.354 4.396 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1OC(F)F ZINC000541918975 939653741 /nfs/dbraw/zinc/65/37/41/939653741.db2.gz QWWYFKCMTNEHHS-PZJWPPBQSA-N 2 0 404.501 4.486 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cccc(OC(F)(F)F)c1 ZINC000541917889 939653782 /nfs/dbraw/zinc/65/37/82/939653782.db2.gz HDVIRDHYLWONMT-OXJNMPFZSA-N 2 0 408.464 4.393 20 0 HIADRP CCC[NH+]1CCN(C(=O)Nc2ccc(C[N@H+](C[C@@H]3CCCCO3)C(C)C)cc2)CC1 ZINC000541962030 939663331 /nfs/dbraw/zinc/66/33/31/939663331.db2.gz IIVDTLFDTUNYAJ-QHCPKHFHSA-N 2 0 416.610 4.026 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C[C@H](c1c(F)cccc1Cl)N1CCCC1 ZINC000542317147 939798881 /nfs/dbraw/zinc/79/88/81/939798881.db2.gz BCWAJGDBMAZCSP-OAQYLSRUSA-N 2 0 413.928 4.295 20 0 HIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@@H](c2cccnc2)c2ccc(F)cc2F)cc1 ZINC000542472890 939828987 /nfs/dbraw/zinc/82/89/87/939828987.db2.gz PPVFIALSBNQBDQ-DEOSSOPVSA-N 2 0 411.496 4.222 20 0 HIADRP Cc1ccccc1[C@H](CN1CCOCC1)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000542478577 939830065 /nfs/dbraw/zinc/83/00/65/939830065.db2.gz PLCNWTYJTPBFEY-SANMLTNESA-N 2 0 407.602 4.144 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@@H](c2ccccc2)c2ccc(F)cn2)[C@@H](c2ccccc2)C1 ZINC000542480800 939830783 /nfs/dbraw/zinc/83/07/83/939830783.db2.gz QLHGTXKTQKDSFW-FTJBHMTQSA-N 2 0 418.560 4.279 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](CCCOc3cccc(C(C)(C)C)c3)CC2)CC1 ZINC000542592031 939847111 /nfs/dbraw/zinc/84/71/11/939847111.db2.gz TVEKAIDVAISDFH-UHFFFAOYSA-N 2 0 401.639 4.103 20 0 HIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2cccc(Br)c21 ZINC000542845623 939862456 /nfs/dbraw/zinc/86/24/56/939862456.db2.gz DDNCBFXLZTUFFV-FYINFDKHSA-N 2 0 415.375 4.354 20 0 HIADRP C[NH+](Cc1ccccc1)Cc1cccc(C(=O)N2CC[C@H](C[N@H+](C)CC3CC3)C2)c1 ZINC000543279072 940016604 /nfs/dbraw/zinc/01/66/04/940016604.db2.gz REYDNEFVRPWDLT-XMMPIXPASA-N 2 0 405.586 4.123 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000543405320 940054372 /nfs/dbraw/zinc/05/43/72/940054372.db2.gz XBYQTBGVHZPENE-DFBJGRDBSA-N 2 0 406.549 4.079 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H](c3ccccc3)c3cncnc3)CC2)cc1 ZINC000543591517 940122789 /nfs/dbraw/zinc/12/27/89/940122789.db2.gz JLNKZFNGJGSNPD-SANMLTNESA-N 2 0 416.569 4.227 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@@H]2CCCc3c(Cl)cccc32)cc1 ZINC000543601363 940127126 /nfs/dbraw/zinc/12/71/26/940127126.db2.gz FXMHOWXXWDMSQL-HSZRJFAPSA-N 2 0 411.977 4.333 20 0 HIADRP O=C(NCc1ccccc1)[C@@H](Cc1ccccc1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000543769939 940180969 /nfs/dbraw/zinc/18/09/69/940180969.db2.gz NFYALUICAGZQON-AREMUKBSSA-N 2 0 419.613 4.301 20 0 HIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)ccc1SC ZINC000543774517 940181452 /nfs/dbraw/zinc/18/14/52/940181452.db2.gz FUXXSLMKCYBQJQ-UWJYYQICSA-N 2 0 400.588 4.225 20 0 HIADRP CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000543996347 940289355 /nfs/dbraw/zinc/28/93/55/940289355.db2.gz GJSMOYHGGFWLBK-CQSZACIVSA-N 2 0 423.623 4.111 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000544355625 940398941 /nfs/dbraw/zinc/39/89/41/940398941.db2.gz WZVYCUAHWJATSU-VWLOTQADSA-N 2 0 406.549 4.079 20 0 HIADRP C[NH+](C)Cc1cccc(C(=O)N[C@@H](c2ccc(F)c(F)c2)C(C)(C)[NH+]2CCCC2)c1 ZINC000544365236 940402706 /nfs/dbraw/zinc/40/27/06/940402706.db2.gz JKHYDBZLNDPHCG-QFIPXVFZSA-N 2 0 415.528 4.372 20 0 HIADRP Fc1ccc(-c2noc(CCC[NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)n2)cc1 ZINC000544367019 940403171 /nfs/dbraw/zinc/40/31/71/940403171.db2.gz IALXEZAWGUUHGN-ACIOBRDBSA-N 2 0 420.532 4.309 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(OCc4ccccc4)cc3)CC2)CC1 ZINC000544493792 940456454 /nfs/dbraw/zinc/45/64/54/940456454.db2.gz QLJANWDWFMWVKB-UHFFFAOYSA-N 2 0 407.602 4.115 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](CC3=Cc4cc(Cl)cc(Cl)c4OC3)CC2)CC1 ZINC000544596100 940486823 /nfs/dbraw/zinc/48/68/23/940486823.db2.gz HWZACDHBSGXQCA-UHFFFAOYSA-N 2 0 424.416 4.119 20 0 HIADRP Cc1ccc(S(=O)(=O)C[C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000544604860 940489066 /nfs/dbraw/zinc/48/90/66/940489066.db2.gz JQVFPWJEMWEQFM-QZNHQXDQSA-N 2 0 414.615 4.048 20 0 HIADRP C[C@H]1C[NH+](CC2CC[NH+](Cc3ccc(OCC(F)(F)F)c(F)c3)CC2)C[C@H](C)O1 ZINC000544611877 940489954 /nfs/dbraw/zinc/48/99/54/940489954.db2.gz MAMIIKCUVPICHE-HOTGVXAUSA-N 2 0 418.475 4.088 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)N(C)[C@@H](C)C2CC[NH+](C)CC2)CCCC1)c1ccccc1 ZINC000544657699 940499222 /nfs/dbraw/zinc/49/92/22/940499222.db2.gz ZOOJOLCKGMCNPN-PMACEKPBSA-N 2 0 400.611 4.022 20 0 HIADRP c1ccc(-c2noc([C@H]3CCC[N@H+](Cc4cccnc4)C3)n2)c(C[NH+]2CCCC2)c1 ZINC000544915707 940524985 /nfs/dbraw/zinc/52/49/85/940524985.db2.gz PZAUKMXDOMNCQL-NRFANRHFSA-N 2 0 403.530 4.107 20 0 HIADRP C[NH+](C)CCOc1ccccc1-c1noc([C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)n1 ZINC000545794796 940598090 /nfs/dbraw/zinc/59/80/90/940598090.db2.gz LOEVCDXQDQWBSF-LJQANCHMSA-N 2 0 424.520 4.196 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccncc2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547505539 941065968 /nfs/dbraw/zinc/06/59/68/941065968.db2.gz RGJGHTHQCAYLKY-HYBUGGRVSA-N 2 0 414.553 4.334 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(COC2CCOCC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547828343 941077701 /nfs/dbraw/zinc/07/77/01/941077701.db2.gz FCMFEJNFOZEIAM-OFVILXPXSA-N 2 0 408.586 4.382 20 0 HIADRP C[C@H]([NH2+]C[C@@H](CO)Cc1c(F)cccc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548155678 941089365 /nfs/dbraw/zinc/08/93/65/941089365.db2.gz UGPTVXTVQGYDSK-YSIASYRMSA-N 2 0 404.957 4.130 20 0 HIADRP COC(=O)c1cc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c[nH]1 ZINC000548993412 941139788 /nfs/dbraw/zinc/13/97/88/941139788.db2.gz KQFQRUXTSZOCNR-VZKPYBMVSA-N 2 0 401.938 4.158 20 0 HIADRP Cc1ccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c(-c2cnn(C)c2)c1 ZINC000549808354 941207915 /nfs/dbraw/zinc/20/79/15/941207915.db2.gz NBUMMWPNLXLQAF-UHFFFAOYSA-N 2 0 423.649 4.024 20 0 HIADRP COc1ccc(C[N@H+](Cc2cn(-c3cc[nH+]cc3)nc2C)[C@@H](C)C2CC2)c(OC)c1 ZINC000549821457 941208567 /nfs/dbraw/zinc/20/85/67/941208567.db2.gz XAUXOXVWQIFHPJ-SFHVURJKSA-N 2 0 406.530 4.394 20 0 HIADRP COc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1Cl ZINC000549877817 941223771 /nfs/dbraw/zinc/22/37/71/941223771.db2.gz WNGBUTOHIAWNEE-OAQYLSRUSA-N 2 0 414.977 4.367 20 0 HIADRP Fc1ccc(/C=C\C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1F ZINC000550271170 941307023 /nfs/dbraw/zinc/30/70/23/941307023.db2.gz JQJSJLBQBRSWGT-FDQBOKQBSA-N 2 0 412.524 4.496 20 0 HIADRP Cc1ccc([C@@H](OC[C@H](O)C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc2)cc1 ZINC000550328532 941315822 /nfs/dbraw/zinc/31/58/22/941315822.db2.gz UUZISJHGEZEMHR-RPWUZVMVSA-N 2 0 410.602 4.361 20 0 HIADRP C[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ncc(Br)cn1 ZINC000550829873 941371931 /nfs/dbraw/zinc/37/19/31/941371931.db2.gz OQZILVZLGFGGTN-VNCLNFNDSA-N 2 0 403.368 4.333 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CCc4sc(Br)cc43)cc2)CC1 ZINC000551008355 941394504 /nfs/dbraw/zinc/39/45/04/941394504.db2.gz JKUHIWDTXZBYDK-SFHVURJKSA-N 2 0 420.420 4.035 20 0 HIADRP CCOc1cc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)ccc1OC(F)F ZINC000551219712 941429743 /nfs/dbraw/zinc/42/97/43/941429743.db2.gz WALMYVHBCRYJCR-UHFFFAOYSA-N 2 0 420.500 4.450 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H]3CCCOc4ccccc43)C3(C2)CCOCC3)cc1 ZINC000551265894 941439308 /nfs/dbraw/zinc/43/93/08/941439308.db2.gz ZVERXACISXPKLN-UPVQGACJSA-N 2 0 406.570 4.419 20 0 HIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1Cl ZINC000551537598 941497704 /nfs/dbraw/zinc/49/77/04/941497704.db2.gz AYKPFEIVJREZFU-QGZVFWFLSA-N 2 0 402.970 4.125 20 0 HIADRP c1ncn(Cc2ccccc2C[NH2+][C@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000552033823 941570940 /nfs/dbraw/zinc/57/09/40/941570940.db2.gz UHLPNMCNVJLXIZ-NXCFDTQHSA-N 2 0 415.585 4.107 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H](C)c2ccccc2OC(C)C)CC1 ZINC000552875295 941795578 /nfs/dbraw/zinc/79/55/78/941795578.db2.gz MHBOAQTYYPXMGK-NRFANRHFSA-N 2 0 423.601 4.214 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000552904725 941800765 /nfs/dbraw/zinc/80/07/65/941800765.db2.gz UOJCTZYBLKHJCA-UWJYYQICSA-N 2 0 410.949 4.433 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000552905186 941800812 /nfs/dbraw/zinc/80/08/12/941800812.db2.gz RTJWXOKKMQNGBW-DEOSSOPVSA-N 2 0 412.622 4.223 20 0 HIADRP O=C([C@@H]1CCC[N@H+](Cc2ccccc2)C1)N1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000553124562 941836294 /nfs/dbraw/zinc/83/62/94/941836294.db2.gz ONKGHWRJTVJPMV-VPUSJEBWSA-N 2 0 417.597 4.023 20 0 HIADRP C[C@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000553394222 941878627 /nfs/dbraw/zinc/87/86/27/941878627.db2.gz IXXRCVULBXSTET-GBXCKJPGSA-N 2 0 420.601 4.183 20 0 HIADRP C[C@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000553394224 941878738 /nfs/dbraw/zinc/87/87/38/941878738.db2.gz IXXRCVULBXSTET-RDPSFJRHSA-N 2 0 420.601 4.183 20 0 HIADRP COc1cc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c2ccccc2n1 ZINC000553492287 941895717 /nfs/dbraw/zinc/89/57/17/941895717.db2.gz WWVUUYRJKYUTSX-QFIPXVFZSA-N 2 0 403.526 4.321 20 0 HIADRP O=C(CCC(F)(F)F)N1CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000554094866 942035063 /nfs/dbraw/zinc/03/50/63/942035063.db2.gz LKPJUBYCFXFGMC-MXEMCNAFSA-N 2 0 423.523 4.105 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(NC2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)c1 ZINC000554392360 942124142 /nfs/dbraw/zinc/12/41/42/942124142.db2.gz MUAWPPYFXQOQPV-CVDCTZTESA-N 2 0 400.611 4.422 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1cccc2ccccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554448659 942147836 /nfs/dbraw/zinc/14/78/36/942147836.db2.gz ZWUKMKDWEKYUFF-ZTCOLXNVSA-N 2 0 404.554 4.080 20 0 HIADRP C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1C[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000554961091 942335272 /nfs/dbraw/zinc/33/52/72/942335272.db2.gz SHLQOFJWVPDPFP-CWKRKGSWSA-N 2 0 423.626 4.254 20 0 HIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000555000495 942350510 /nfs/dbraw/zinc/35/05/10/942350510.db2.gz YYLDQICHPDNFQU-BDYUSTAISA-N 2 0 416.565 4.335 20 0 HIADRP c1csc(-c2n[nH]cc2C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000555611641 942670476 /nfs/dbraw/zinc/67/04/76/942670476.db2.gz AAVVSWVOSBBLJB-NRFANRHFSA-N 2 0 422.598 4.157 20 0 HIADRP c1nc(C2CCC2)sc1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000555618983 942674040 /nfs/dbraw/zinc/67/40/40/942674040.db2.gz UGVJUQYFKKUUGV-OAQYLSRUSA-N 2 0 411.615 4.429 20 0 HIADRP C[C@H]([NH2+]C1(CN[C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCOCC1)c1ccccc1 ZINC000556093672 942804055 /nfs/dbraw/zinc/80/40/55/942804055.db2.gz LFDMRBDOLWAGOB-GPUOULLFSA-N 2 0 407.602 4.312 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1Br ZINC000556404771 942858368 /nfs/dbraw/zinc/85/83/68/942858368.db2.gz WSUYBFSYYKVSOE-UHFFFAOYSA-N 2 0 419.363 4.221 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC[C@H]3c3cccc(C(F)(F)F)c3)cn2)CC1 ZINC000556589240 942908352 /nfs/dbraw/zinc/90/83/52/942908352.db2.gz QFLJVHAMZHLFCZ-SFTDATJTSA-N 2 0 418.507 4.278 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]CCCOCC4CCOCC4)[C@@H]3C2)cc1 ZINC000556870768 942945944 /nfs/dbraw/zinc/94/59/44/942945944.db2.gz JAYFZMMRIYHJMI-ISJGIBHGSA-N 2 0 400.607 4.100 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2nc(-c3ccccc3)c(C)s2)[C@@H](C)C1 ZINC000557278190 943065548 /nfs/dbraw/zinc/06/55/48/943065548.db2.gz YWTYFFULVYUSHC-GHTZIAJQSA-N 2 0 401.620 4.388 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCc4c5cc(C)ccc5[nH]c43)cn2)CC1 ZINC000558152814 943398470 /nfs/dbraw/zinc/39/84/70/943398470.db2.gz XUYHHTUMDLZGSP-HSZRJFAPSA-N 2 0 403.574 4.180 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1ccc(Cl)cc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000558482672 943570915 /nfs/dbraw/zinc/57/09/15/943570915.db2.gz ZMOLJYHXGDIOJT-ILZDJORESA-N 2 0 423.384 4.233 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000558970617 943776236 /nfs/dbraw/zinc/77/62/36/943776236.db2.gz KPXKZBRRSACILH-PWRODBHTSA-N 2 0 407.396 4.184 20 0 HIADRP CCOC(=O)[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c2ccccc21 ZINC000558976886 943780979 /nfs/dbraw/zinc/78/09/79/943780979.db2.gz YIZXPLZYMXWHPJ-FTBPSBKWSA-N 2 0 406.570 4.322 20 0 HIADRP Cc1c2cccc(Cl)c2sc1C[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000559273550 943888831 /nfs/dbraw/zinc/88/88/31/943888831.db2.gz RTNZYUOLORCJHU-UHFFFAOYSA-N 2 0 415.990 4.444 20 0 HIADRP CCOc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1F ZINC000559330012 943897404 /nfs/dbraw/zinc/89/74/04/943897404.db2.gz MGLXNEZJYQVBSU-JOCHJYFZSA-N 2 0 412.549 4.243 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)[C@@H]2C[NH+](C(C)(C)C)C[C@H]2C(F)(F)F)C1 ZINC000559825602 944060660 /nfs/dbraw/zinc/06/06/60/944060660.db2.gz YWJFYZDASKXZAB-NCXUSEDFSA-N 2 0 417.560 4.008 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@@H]3CCCNc4ccccc43)C3(C2)CCOCC3)cc1 ZINC000559890720 944076783 /nfs/dbraw/zinc/07/67/83/944076783.db2.gz IKJKPMNLUTUITN-RCZVLFRGSA-N 2 0 405.586 4.452 20 0 HIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c(OC)c1 ZINC000559892171 944078174 /nfs/dbraw/zinc/07/81/74/944078174.db2.gz WOLOIPYKMNQNRP-UNMCSNQZSA-N 2 0 424.585 4.283 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+]C3CCC4(CCOCC4)CC3)C3(C2)CCOCC3)cc1 ZINC000559895240 944079318 /nfs/dbraw/zinc/07/93/18/944079318.db2.gz VYFUQIJHTXYCPU-QHCPKHFHSA-N 2 0 412.618 4.244 20 0 HIADRP Cc1c(Br)cc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1Br ZINC000560073361 944149431 /nfs/dbraw/zinc/14/94/31/944149431.db2.gz UWAZCPHOWZGVRD-LBPRGKRZSA-N 2 0 402.174 4.094 20 0 HIADRP CC[C@@H](Cc1ccc(OC)c(OC)c1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000560266687 944212073 /nfs/dbraw/zinc/21/20/73/944212073.db2.gz PBIOCWHKDHVSTH-NRFANRHFSA-N 2 0 412.574 4.288 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]Cc1ccccc1Cn1ccnc1)c1ccccc1O2 ZINC000561224996 944519280 /nfs/dbraw/zinc/51/92/80/944519280.db2.gz VEWUUEGUSRRILT-QHCPKHFHSA-N 2 0 402.542 4.009 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000561297681 944542748 /nfs/dbraw/zinc/54/27/48/944542748.db2.gz HPIXHGAJVHNYTP-RTWAWAEBSA-N 2 0 418.507 4.278 20 0 HIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CCC(=O)Nc3cccc(Br)c3)C2)CC1 ZINC000562237318 945036698 /nfs/dbraw/zinc/03/66/98/945036698.db2.gz UXPCUZRWRZQKKP-SFHVURJKSA-N 2 0 422.411 4.222 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@@H]3CCN(C)[C@H](c4ccccc4)C3)CC2)c1 ZINC000564474779 945606594 /nfs/dbraw/zinc/60/65/94/945606594.db2.gz SQYYMEVDFOPKPV-VPUSJEBWSA-N 2 0 420.645 4.322 20 0 HIADRP CC(C)[N@@H+](C)C[C@@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000564590652 945691657 /nfs/dbraw/zinc/69/16/57/945691657.db2.gz NHYYIJZWJKGNFP-KUIDOIOASA-N 2 0 421.029 4.282 20 0 HIADRP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000564740148 945742609 /nfs/dbraw/zinc/74/26/09/945742609.db2.gz GTXIZVZRURGIPN-UHFFFAOYSA-N 2 0 406.574 4.056 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)C2CC[NH+](C3CC3)CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000565150724 945789798 /nfs/dbraw/zinc/78/97/98/945789798.db2.gz LBBDJZNHUPKIHS-WIYYLYMNSA-N 2 0 423.523 4.079 20 0 HIADRP C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000565902772 945909234 /nfs/dbraw/zinc/90/92/34/945909234.db2.gz BINMQIKTSREGRY-WDMHFBJGSA-N 2 0 403.998 4.243 20 0 HIADRP CC[NH+](CC)CCN(C(=O)c1ccc2c[nH+]cn2c1)c1cccc(C(F)(F)F)c1 ZINC000565906603 945910872 /nfs/dbraw/zinc/91/08/72/945910872.db2.gz JRHPNWZYXVRZNG-UHFFFAOYSA-N 2 0 404.436 4.342 20 0 HIADRP Fc1ccc([C@H]2CC[N@H+](CC3(C[NH+]4CC[C@@H](c5ccc(F)cc5)C4)COC3)C2)cc1 ZINC000566994370 946205523 /nfs/dbraw/zinc/20/55/23/946205523.db2.gz WUBOUBONGWWVTB-SZPZYZBQSA-N 2 0 412.524 4.260 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000569627780 946899492 /nfs/dbraw/zinc/89/94/92/946899492.db2.gz WKPIUFILUUIPNU-FVJLSDCUSA-N 2 0 419.491 4.135 20 0 HIADRP C[C@H]([NH2+]C1CCN(CCc2ccc(F)cc2)CC1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000569729802 946956954 /nfs/dbraw/zinc/95/69/54/946956954.db2.gz SWMAMRLMYLPMTK-SFHVURJKSA-N 2 0 424.564 4.467 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccccc2N2CCO[C@@H](C)C2)C1 ZINC000570587591 947305044 /nfs/dbraw/zinc/30/50/44/947305044.db2.gz ZQUZNOSFKMWPHW-YADHBBJMSA-N 2 0 407.602 4.433 20 0 HIADRP CC[C@]1(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)OCCc2ccccc21 ZINC000570975756 947406306 /nfs/dbraw/zinc/40/63/06/947406306.db2.gz JNAAIQHIHSYASY-AREMUKBSSA-N 2 0 407.602 4.185 20 0 HIADRP CC[NH+](CC)CCOc1ccc(-c2noc([C@@]3(F)CC[N@@H+](C(C)(C)C)C3)n2)cc1 ZINC000571249347 947569563 /nfs/dbraw/zinc/56/95/63/947569563.db2.gz ICCDFCPJIZJQRX-JOCHJYFZSA-N 2 0 404.530 4.126 20 0 HIADRP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CCCc3nc(-c4ccccc4)no3)C2)s1 ZINC000571688439 947748928 /nfs/dbraw/zinc/74/89/28/947748928.db2.gz UMRMJERFAZHPEX-IBGZPJMESA-N 2 0 410.587 4.493 20 0 HIADRP CCc1nc2ccccc2n1C1CC[NH+](Cc2cn(-c3cc[nH+]cc3)nc2C)CC1 ZINC000572764354 948003931 /nfs/dbraw/zinc/00/39/31/948003931.db2.gz RWNFUNZSVMKONM-UHFFFAOYSA-N 2 0 400.530 4.325 20 0 HIADRP CC[C@H](C(=O)N[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000572969983 948049014 /nfs/dbraw/zinc/04/90/14/948049014.db2.gz WQRXTSKHTQFSNE-DHIUTWEWSA-N 2 0 421.585 4.001 20 0 HIADRP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1[nH+]c(N3CCCC3)cc3ccccc31)C2 ZINC001164815049 720175623 /nfs/dbraw/zinc/17/56/23/720175623.db2.gz HJEJBFIEQFGVPT-ATIYNZHBSA-N 2 0 420.601 4.020 20 0 HIADRP COCC[N@@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1[nH+]c(C)cc3ccccc31)CC2 ZINC001164784089 721463014 /nfs/dbraw/zinc/46/30/14/721463014.db2.gz GTRKJNBETDFIAC-QHCPKHFHSA-N 2 0 423.601 4.277 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000436273043 861581911 /nfs/dbraw/zinc/58/19/11/861581911.db2.gz IPFADERJCYSOPS-UHFFFAOYSA-N 2 0 419.569 4.224 20 0 HIADRP c1cc(-c2n[nH]cc2C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cs1 ZINC000436301143 861606385 /nfs/dbraw/zinc/60/63/85/861606385.db2.gz YAKAAWDZNFPOED-UHFFFAOYSA-N 2 0 410.587 4.299 20 0 HIADRP COc1ccc([C@H](CNC(=O)c2ccc(C[NH+]3CCCCC3)cc2)[NH+]2CCCC2)cc1 ZINC000017911885 846277363 /nfs/dbraw/zinc/27/73/63/846277363.db2.gz PIHZCFXNBXOFSV-VWLOTQADSA-N 2 0 421.585 4.248 20 0 HIADRP CC[C@H]([NH2+]CC(=O)Nc1ccc(N2CC[NH+](CC)CC2)cc1)c1ccc(Cl)cc1 ZINC000024254651 846807012 /nfs/dbraw/zinc/80/70/12/846807012.db2.gz HQKVMRSTSAVMMC-QFIPXVFZSA-N 2 0 414.981 4.161 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)C3CC[NH+](Cc4ccccc4)CC3)c2)CC1 ZINC000038831190 848180392 /nfs/dbraw/zinc/18/03/92/848180392.db2.gz BQTQLVMDTXDWCB-UHFFFAOYSA-N 2 0 419.613 4.447 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)C3CC[NH+](Cc4ccccc4)CC3)cc2)C1 ZINC000038831182 848180753 /nfs/dbraw/zinc/18/07/53/848180753.db2.gz BKLUFRFKXVIKSX-QFIPXVFZSA-N 2 0 419.613 4.447 20 0 HIADRP Cc1cc(O)c(C(C)C)cc1C(=O)N(C)[C@H]1CCCC[C@H]1[N@H+](C)C1CCN(C)CC1 ZINC000436632179 861876221 /nfs/dbraw/zinc/87/62/21/861876221.db2.gz VRUNLBBZKKBJMD-PKTZIBPZSA-N 2 0 415.622 4.233 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC(C[NH+]2CCCC2)CC1 ZINC000045780818 848727256 /nfs/dbraw/zinc/72/72/56/848727256.db2.gz GAUHAXLHDSBRFE-NRFANRHFSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CCC([NH+]3CCCCC3)CC2)C1 ZINC000045788414 848728325 /nfs/dbraw/zinc/72/83/25/848728325.db2.gz IOFVHGHDNVBXPX-OAQYLSRUSA-N 2 0 412.622 4.078 20 0 HIADRP COc1cc(-c2noc(CCCCC[NH2+]C3CC[NH+](C(C)(C)C)CC3)n2)ccc1O ZINC000436768708 861960917 /nfs/dbraw/zinc/96/09/17/861960917.db2.gz XUPHGBRGQRHZHL-UHFFFAOYSA-N 2 0 416.566 4.016 20 0 HIADRP Cc1ccccc1[C@@H](OC[C@H](O)C[NH+]1CCC(CC[NH+](C)C)CC1)c1ccccc1 ZINC000056523045 850382595 /nfs/dbraw/zinc/38/25/95/850382595.db2.gz SHGOAKYYKJGNOU-RSXGOPAZSA-N 2 0 410.602 4.126 20 0 HIADRP Cc1ccccc1[C@@H](OC[C@@H](O)C[NH+]1CCC(CC[NH+](C)C)CC1)c1ccccc1 ZINC000056523051 850382850 /nfs/dbraw/zinc/38/28/50/850382850.db2.gz SHGOAKYYKJGNOU-AHWVRZQESA-N 2 0 410.602 4.126 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000060798188 851216107 /nfs/dbraw/zinc/21/61/07/851216107.db2.gz VWPHSZHJYVKNGC-QHCPKHFHSA-N 2 0 424.589 4.292 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000061142376 851305078 /nfs/dbraw/zinc/30/50/78/851305078.db2.gz NJQDTWCQXVSHTL-QHCPKHFHSA-N 2 0 424.589 4.148 20 0 HIADRP C[C@H](CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000061722231 851425265 /nfs/dbraw/zinc/42/52/65/851425265.db2.gz CQPUCZQHPQDABY-NHCUHLMSSA-N 2 0 422.617 4.335 20 0 HIADRP Cc1cc(C[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cc(C)c1OCc1ccccn1 ZINC000062252878 851516951 /nfs/dbraw/zinc/51/69/51/851516951.db2.gz SPLJLNGPFGIGJC-VXKWHMMOSA-N 2 0 411.590 4.256 20 0 HIADRP CCc1cccc[n+]1C(C(=O)c1ccc(C(C)C)cc1)C(=S)NC1CC[NH+](C)CC1 ZINC000063441596 851691237 /nfs/dbraw/zinc/69/12/37/851691237.db2.gz MXIRWAAZBJPMQF-UHFFFAOYSA-O 2 0 424.634 4.283 20 0 HIADRP O=C([C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1)N1CCCCC1 ZINC000063631480 851729624 /nfs/dbraw/zinc/72/96/24/851729624.db2.gz JZGMGATVWPCLTF-RUZDIDTESA-N 2 0 405.586 4.242 20 0 HIADRP COC(=O)COc1c(C)cc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc1C ZINC000063903635 851790443 /nfs/dbraw/zinc/79/04/43/851790443.db2.gz YOVGNZZTCCOLEO-UHFFFAOYSA-N 2 0 410.558 4.131 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)c1 ZINC000065522932 852168261 /nfs/dbraw/zinc/16/82/61/852168261.db2.gz FNJOGLOWUVPKQC-RDPSFJRHSA-N 2 0 408.590 4.163 20 0 HIADRP O=C(NC[C@H]1CCC[NH+](Cc2ccccc2)C1)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000065901457 852309527 /nfs/dbraw/zinc/30/95/27/852309527.db2.gz ZKPREIXDYRYGNV-DNQXCXABSA-N 2 0 423.576 4.066 20 0 HIADRP O=C([C@@H]1CCC[N@H+](Cc2ccccc2)C1)N1CCC[NH+](CCCc2ccccc2)CC1 ZINC000072072797 852497171 /nfs/dbraw/zinc/49/71/71/852497171.db2.gz KSESYRYWBFZEPP-AREMUKBSSA-N 2 0 419.613 4.066 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(-c4ccccc4Cl)o3)cn2)CC1 ZINC000097357136 852604740 /nfs/dbraw/zinc/60/47/40/852604740.db2.gz SHNRMXTYSOOCLW-UHFFFAOYSA-N 2 0 410.949 4.427 20 0 HIADRP C[C@H](C(=O)N(C)Cc1cccc(F)c1)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000110797679 853154308 /nfs/dbraw/zinc/15/43/08/853154308.db2.gz KVIHGZWXDKLBQO-HXUWFJFHSA-N 2 0 411.565 4.017 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NC[C@@H](c1ccccc1OC)[NH+]1CCCC1)c1ccccc1 ZINC000111075245 853197956 /nfs/dbraw/zinc/19/79/56/853197956.db2.gz KKEHNWTXOMPPQS-UPVQGACJSA-N 2 0 409.574 4.031 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)C(=O)NCc1ccc(F)cc1 ZINC000195538722 853673741 /nfs/dbraw/zinc/67/37/41/853673741.db2.gz JNZOBXDQQMEDBL-AQNXPRMDSA-N 2 0 411.565 4.098 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[NH2+]C[C@H]4CCC[N@@H+](C(C)C)C4)cc3)nc12 ZINC000236621865 853903893 /nfs/dbraw/zinc/90/38/93/853903893.db2.gz JUQZNQMWZUQMNH-JOCHJYFZSA-N 2 0 406.574 4.432 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(OC)c(OC(F)F)c2)CC1 ZINC000236802732 853924594 /nfs/dbraw/zinc/92/45/94/853924594.db2.gz VAKOSWPBICYQMQ-UHFFFAOYSA-N 2 0 419.516 4.118 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cnc3c(cnn3C(C)C)c2)CC1 ZINC000236853305 853929159 /nfs/dbraw/zinc/92/91/59/853929159.db2.gz MTYWJFNIIQZSNP-SFHVURJKSA-N 2 0 424.568 4.144 20 0 HIADRP COc1cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc(OC)c1OCc1ccccc1 ZINC000237338071 854009853 /nfs/dbraw/zinc/00/98/53/854009853.db2.gz DKZDSIFDTPZXAQ-FRIKZZABSA-N 2 0 410.558 4.388 20 0 HIADRP C[C@@H](C[NH2+]Cc1cccc(Oc2cccc(C(F)(F)F)c2)c1)N1CC[NH+](C)CC1 ZINC000237417341 854027460 /nfs/dbraw/zinc/02/74/60/854027460.db2.gz CTTZPWRBJOPKDE-KRWDZBQOSA-N 2 0 407.480 4.223 20 0 HIADRP Cc1cc(C[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc(C)c1OCc1ccccn1 ZINC000237609219 854061807 /nfs/dbraw/zinc/06/18/07/854061807.db2.gz SPLJLNGPFGIGJC-SZPZYZBQSA-N 2 0 411.590 4.256 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2ccc(Cl)c(Cl)c2)cc1 ZINC000237689002 854076167 /nfs/dbraw/zinc/07/61/67/854076167.db2.gz AILFDJQSZFUVLG-UHFFFAOYSA-N 2 0 406.357 4.109 20 0 HIADRP O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000303140297 854781334 /nfs/dbraw/zinc/78/13/34/854781334.db2.gz BAPJFUNACKKSQG-ISKFKSNPSA-N 2 0 412.622 4.121 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CC(=O)Nc2ccc(N3CCCC3)cc2)CC1 ZINC000303216348 854820367 /nfs/dbraw/zinc/82/03/67/854820367.db2.gz STUKGBKKHFXRFJ-UHFFFAOYSA-N 2 0 420.601 4.069 20 0 HIADRP C[C@H](CNC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[NH+](C)Cc1ccccc1 ZINC000303489360 854980574 /nfs/dbraw/zinc/98/05/74/854980574.db2.gz RVOJGXXMNABGCH-QLKXDWOZSA-N 2 0 420.601 4.002 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2ccccc2Br)C1 ZINC000303582789 855056977 /nfs/dbraw/zinc/05/69/77/855056977.db2.gz KSKJMKVHHKIYFX-ZWKOTPCHSA-N 2 0 422.411 4.364 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NCC(C)(C)[NH+]2C[C@H](C)C[C@@H](C)C2)CC1 ZINC000303688208 855134069 /nfs/dbraw/zinc/13/40/69/855134069.db2.gz UMIQLHLKBHXCAZ-NJDAHSKKSA-N 2 0 414.638 4.268 20 0 HIADRP C[C@@H]([NH2+]C1CCN(C(=O)OCc2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309697256 855363827 /nfs/dbraw/zinc/36/38/27/855363827.db2.gz DVWPBCXHRXBBIX-QPPBQGQZSA-N 2 0 421.585 4.288 20 0 HIADRP C[C@@H]([NH2+]C1CCN(C(=O)OCc2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309697260 855364336 /nfs/dbraw/zinc/36/43/36/855364336.db2.gz DVWPBCXHRXBBIX-ZJSXRUAMSA-N 2 0 421.585 4.288 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc(I)c1 ZINC000398013740 855473846 /nfs/dbraw/zinc/47/38/46/855473846.db2.gz FBZSDXYUCAAEJF-OXQOHEQNSA-N 2 0 420.338 4.291 20 0 HIADRP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CN1C(=O)OC(C)(C)C ZINC000399026201 855477241 /nfs/dbraw/zinc/47/72/41/855477241.db2.gz JIPKRDBNTGUUMI-HJNYFJLDSA-N 2 0 401.595 4.276 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)CC1 ZINC000410340046 855937433 /nfs/dbraw/zinc/93/74/33/855937433.db2.gz WBJJPKBYUOJKKZ-UHFFFAOYSA-N 2 0 400.611 4.027 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC000410344746 855939198 /nfs/dbraw/zinc/93/91/98/855939198.db2.gz LLONMLJPQSCOLM-JOCHJYFZSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000410347101 855941778 /nfs/dbraw/zinc/94/17/78/855941778.db2.gz YSGFTJGLCYOVMN-SQJMNOBHSA-N 2 0 420.601 4.135 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)N(CC[NH+](C)C)Cc3ccccc3)cc2)C1 ZINC000410353182 855944257 /nfs/dbraw/zinc/94/42/57/855944257.db2.gz KXEYKGGXFGZMQT-QFIPXVFZSA-N 2 0 422.617 4.192 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000410355036 855945562 /nfs/dbraw/zinc/94/55/62/855945562.db2.gz SDSXFTCMFQGGEB-SFHVURJKSA-N 2 0 400.611 4.169 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCNC(=O)NCc1ccccc1C[NH+]1CCCC[C@@H]1C ZINC000410364471 855952808 /nfs/dbraw/zinc/95/28/08/855952808.db2.gz ILFDLRRDUVLGKP-RTWAWAEBSA-N 2 0 400.611 4.125 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)C1 ZINC000410367111 855954862 /nfs/dbraw/zinc/95/48/62/855954862.db2.gz JJCSDSPKMQOZEP-RDPSFJRHSA-N 2 0 408.590 4.021 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N(CC[NH+](C)C)Cc1ccccc1 ZINC000410371270 855957409 /nfs/dbraw/zinc/95/74/09/855957409.db2.gz ZPBGBIGAELZJPE-JOCHJYFZSA-N 2 0 422.617 4.334 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NCc1cccc(C[NH+](C)C)c1 ZINC000410379899 855962576 /nfs/dbraw/zinc/96/25/76/855962576.db2.gz REJNTJDGLOYLQS-FQEVSTJZSA-N 2 0 408.590 4.122 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NCCC[NH2+]C1CCCCC1 ZINC000410393815 855970771 /nfs/dbraw/zinc/97/07/71/855970771.db2.gz RJTJEGRCDXIIBD-HXUWFJFHSA-N 2 0 400.611 4.173 20 0 HIADRP COCC1(C[NH2+][C@@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)CCOCC1 ZINC000425930376 856005687 /nfs/dbraw/zinc/00/56/87/856005687.db2.gz WTMSCFXQPBXZNH-QHCPKHFHSA-N 2 0 406.586 4.412 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)Nc1ccc(OCC[NH+]2CCCCC2)cc1)c1ccsc1 ZINC000426148021 856140093 /nfs/dbraw/zinc/14/00/93/856140093.db2.gz JFAVFLWQSYFUTR-OAQYLSRUSA-N 2 0 416.591 4.037 20 0 HIADRP C[C@H]1CCN(C(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000426706782 856423329 /nfs/dbraw/zinc/42/33/29/856423329.db2.gz XANINEJHFMEBIS-QFIPXVFZSA-N 2 0 405.586 4.409 20 0 HIADRP C[C@H]1CCN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000437478920 862838599 /nfs/dbraw/zinc/83/85/99/862838599.db2.gz ZQHKQUVIZSCLLA-QFIPXVFZSA-N 2 0 405.586 4.022 20 0 HIADRP O=C(c1ccoc1)N1CCC([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000428224642 857118498 /nfs/dbraw/zinc/11/84/98/857118498.db2.gz XLCYXKHKXKNEEQ-GVXSCFBNSA-N 2 0 421.585 4.165 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000428260415 857131376 /nfs/dbraw/zinc/13/13/76/857131376.db2.gz LJFCUEQWBUXPDY-BWKNWUBXSA-N 2 0 422.617 4.381 20 0 HIADRP CC[N@@H+](Cc1cnc(-c2ccccc2OC)nc1)CC1CCN(c2ccccn2)CC1 ZINC000430240089 858093417 /nfs/dbraw/zinc/09/34/17/858093417.db2.gz CMRNYIREKJKUFI-UHFFFAOYSA-N 2 0 417.557 4.286 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cc(-c4ccc(F)cc4)no3)CC2)CC1 ZINC000430943084 858377911 /nfs/dbraw/zinc/37/79/11/858377911.db2.gz ODYUWXOSEFMHPA-UHFFFAOYSA-N 2 0 414.569 4.109 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCOc4c(C(C)C)cccc43)cn2)CC1 ZINC000431326090 858566216 /nfs/dbraw/zinc/56/62/16/858566216.db2.gz ABQSFZKGYNDRCA-QHCPKHFHSA-N 2 0 408.590 4.350 20 0 HIADRP C[C@H](CCN1CC[NH+](C2CCC(C)CC2)CC1)N1CC[NH+](C2CCC(C)CC2)CC1 ZINC000431599302 858681922 /nfs/dbraw/zinc/68/19/22/858681922.db2.gz ZOULAILSZYPGLA-UCBLTYHBSA-N 2 0 418.714 4.158 20 0 HIADRP Cc1cccc(CN(CC[NH+](C)C)C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000431673776 858730301 /nfs/dbraw/zinc/73/03/01/858730301.db2.gz POKCJQMLMORXMO-WIOPSUGQSA-N 2 0 422.617 4.121 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000431674343 858731238 /nfs/dbraw/zinc/73/12/38/858731238.db2.gz DBYKWSFYJWRMQE-SQJMNOBHSA-N 2 0 422.617 4.333 20 0 HIADRP COc1ccccc1[C@H](CNC(=O)C[C@@H](c1ccccc1)[NH+](C)C)[NH+]1CCCCC1 ZINC000431727879 858767989 /nfs/dbraw/zinc/76/79/89/858767989.db2.gz LVJOQYDUGRSOLC-GOTSBHOMSA-N 2 0 409.574 4.031 20 0 HIADRP C[NH+](C)CC[C@H](NC(=O)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)C(C)(C)C ZINC000431950409 858883799 /nfs/dbraw/zinc/88/37/99/858883799.db2.gz LRBLLIOZDBCVCB-QFIPXVFZSA-N 2 0 414.638 4.051 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NCc1ccccc1C[NH+](C)C)c1cccc(C(F)(F)F)c1 ZINC000467535937 881356353 /nfs/dbraw/zinc/35/63/53/881356353.db2.gz CATZMOXBGLPWGP-NRFANRHFSA-N 2 0 421.507 4.466 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CC(c3cccc(Br)c3)C2)[C@@H](C)C1 ZINC000432414981 859154382 /nfs/dbraw/zinc/15/43/82/859154382.db2.gz UMUJEDPNQGUDTF-KSCTXSPISA-N 2 0 409.412 4.422 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H]2CCC[C@H]2c2ccccc2)CC1 ZINC000432800592 859367594 /nfs/dbraw/zinc/36/75/94/859367594.db2.gz OLHWUPNHBCVYRW-DQEYMECFSA-N 2 0 405.586 4.002 20 0 HIADRP C[C@H]1C[N@H+](CCCNC(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)CCCO1 ZINC000432978016 859459573 /nfs/dbraw/zinc/45/95/73/859459573.db2.gz QAKADOIZEAWXLN-FQEVSTJZSA-N 2 0 416.610 4.074 20 0 HIADRP CSc1ccccc1[C@H](C)[NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000433198623 859563418 /nfs/dbraw/zinc/56/34/18/859563418.db2.gz ZGEXJFUJWSDTLX-IBGZPJMESA-N 2 0 411.615 4.148 20 0 HIADRP C[C@@H]1CN(c2cc[nH+]c3ccc(Oc4ccccc4)cc32)CC[C@@H]1[NH+]1CCN(C)CC1 ZINC000433756418 859877958 /nfs/dbraw/zinc/87/79/58/859877958.db2.gz CCMXRAHVXDMMAW-NLFFAJNJSA-N 2 0 416.569 4.489 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000434898594 860543678 /nfs/dbraw/zinc/54/36/78/860543678.db2.gz VZAWTQQWPHAQKG-OTPAQWSUSA-N 2 0 405.586 4.034 20 0 HIADRP COc1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1OC ZINC000467856982 881707003 /nfs/dbraw/zinc/70/70/03/881707003.db2.gz UCHSKQQZWPQGIG-DLBZAZTESA-N 2 0 401.526 4.007 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000467860258 881710522 /nfs/dbraw/zinc/71/05/22/881710522.db2.gz YZYYWXWACLZJJO-MSOLQXFVSA-N 2 0 415.553 4.397 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000467860261 881712898 /nfs/dbraw/zinc/71/28/98/881712898.db2.gz YZYYWXWACLZJJO-ZWKOTPCHSA-N 2 0 415.553 4.397 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC2CCCC2)c(F)c1 ZINC000438649079 864088430 /nfs/dbraw/zinc/08/84/30/864088430.db2.gz SIXSEFATHFCMBH-IBGZPJMESA-N 2 0 420.573 4.027 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCN(C(=O)CCc3ccccc3)C2)CC1 ZINC000438826544 864321009 /nfs/dbraw/zinc/32/10/09/864321009.db2.gz DRIOJQQKGRHVGG-GXUWAKPLSA-N 2 0 419.613 4.253 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C2CCN(C(=O)c3ccccc3F)CC2)CC1 ZINC000438832350 864326184 /nfs/dbraw/zinc/32/61/84/864326184.db2.gz LWSJQIOGTBGNCN-UHFFFAOYSA-N 2 0 423.576 4.463 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(Br)s2)C2CC2)CC1 ZINC000439138122 864570388 /nfs/dbraw/zinc/57/03/88/864570388.db2.gz JSVBRGPUIMJVCI-FRQCXROJSA-N 2 0 413.425 4.319 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N1c2ccccc2C[C@@H]1C ZINC000439595416 864918734 /nfs/dbraw/zinc/91/87/34/864918734.db2.gz JXLQMAOBGNPIBC-VQTJNVASSA-N 2 0 417.553 4.368 20 0 HIADRP CC(C)C[C@@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000468016079 881854382 /nfs/dbraw/zinc/85/43/82/881854382.db2.gz HRAQGPCXKHRPSR-KNQAVFIVSA-N 2 0 402.627 4.314 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCC([NH+]2CCCCC2)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000468030718 881863615 /nfs/dbraw/zinc/86/36/15/881863615.db2.gz RBSYQYVFKQLLSZ-JTHBVZDNSA-N 2 0 414.638 4.412 20 0 HIADRP Cc1ccc(N[C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1NC(=O)CC[NH+](C)C ZINC000468033854 881865416 /nfs/dbraw/zinc/86/54/16/881865416.db2.gz OYGITCMXHIYTLW-QPTUXGOLSA-N 2 0 420.601 4.208 20 0 HIADRP Cc1ccc(NC2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)cc1NC(=O)CC[NH+](C)C ZINC000468041852 881870664 /nfs/dbraw/zinc/87/06/64/881870664.db2.gz ZGKQREVTTWHHNZ-GCJKJVERSA-N 2 0 400.611 4.340 20 0 HIADRP CSc1ccccc1[C@H](C)[NH2+]CC(=O)N1CCC[N@H+](Cc2ccccc2C)CC1 ZINC000440621189 865843426 /nfs/dbraw/zinc/84/34/26/865843426.db2.gz YFJNAPRBUGXTHH-FQEVSTJZSA-N 2 0 411.615 4.102 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)[C@@H](C)C1 ZINC000440689190 865866788 /nfs/dbraw/zinc/86/67/88/865866788.db2.gz HSNQBEWIEXPGDD-PZYJALBSSA-N 2 0 410.602 4.124 20 0 HIADRP O[C@H](COc1ccc(Oc2ccccc2)cc1)C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441412896 866485614 /nfs/dbraw/zinc/48/56/14/866485614.db2.gz PQWDMFDQNSXLFR-LIXHSBQKSA-N 2 0 422.569 4.167 20 0 HIADRP O[C@@H](Cn1c2ccccc2c2ccccc21)C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441416130 866490171 /nfs/dbraw/zinc/49/01/71/866490171.db2.gz CHJGRLNCYFEIFT-XZDHIHRUSA-N 2 0 403.570 4.104 20 0 HIADRP Brc1ccc(-c2nccc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)n2)cc1 ZINC000441999285 867053613 /nfs/dbraw/zinc/05/36/13/867053613.db2.gz HBBATNULHOVCQD-UHFFFAOYSA-N 2 0 415.379 4.214 20 0 HIADRP CSc1cccc([C@H]([NH2+]CCN2CC[N@H+](C)C(C)(C)C2)c2ccc(F)c(F)c2)c1 ZINC000442868555 867706874 /nfs/dbraw/zinc/70/68/74/867706874.db2.gz GQAZGZARXISOJH-QFIPXVFZSA-N 2 0 419.585 4.392 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)CC1(C)C ZINC000442874515 867709780 /nfs/dbraw/zinc/70/97/80/867709780.db2.gz MINLIFYGSXBRCV-OAQYLSRUSA-N 2 0 416.407 4.154 20 0 HIADRP Cc1cc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000443624567 868197964 /nfs/dbraw/zinc/19/79/64/868197964.db2.gz FFOWVCNWQQTCLU-UHFFFAOYSA-N 2 0 414.981 4.040 20 0 HIADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000468381707 882325490 /nfs/dbraw/zinc/32/54/90/882325490.db2.gz IOVCHZDGCZROOE-IBGZPJMESA-N 2 0 400.538 4.036 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)N3CC[C@@H](C[NH+]4CCCCC4)C3)c2)CC1 ZINC000446274136 870209681 /nfs/dbraw/zinc/20/96/81/870209681.db2.gz AYNRLVXIEJUNGY-QHCPKHFHSA-N 2 0 412.622 4.301 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)Nc2ccccc2CC[NH+](C)C)cc1 ZINC000446562710 870474243 /nfs/dbraw/zinc/47/42/43/870474243.db2.gz DCPLTURUAUDNRC-FQEVSTJZSA-N 2 0 408.590 4.487 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccc(Br)cc1Cl)C1CC1 ZINC000446820310 870734662 /nfs/dbraw/zinc/73/46/62/870734662.db2.gz BGLCYVLGKDTURV-APWZRJJASA-N 2 0 415.803 4.380 20 0 HIADRP CC[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1ccc(Br)cc1Cl ZINC000446819961 870734948 /nfs/dbraw/zinc/73/49/48/870734948.db2.gz WXCWZKJYUHUEEX-GOSISDBHSA-N 2 0 402.808 4.171 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(Br)cc1F ZINC000446881176 870802282 /nfs/dbraw/zinc/80/22/82/870802282.db2.gz NRHMNEBIMGAIMG-RDTXWAMCSA-N 2 0 407.327 4.006 20 0 HIADRP CCOc1ccccc1NC(=O)[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000447038263 870913747 /nfs/dbraw/zinc/91/37/47/870913747.db2.gz NJHPAIQFJZOLHO-XMMPIXPASA-N 2 0 407.558 4.229 20 0 HIADRP OC[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1c(F)cccc1Cl ZINC000447545298 871411839 /nfs/dbraw/zinc/41/18/39/871411839.db2.gz QUQQFQSFPGSVBT-XSDIEEQYSA-N 2 0 416.968 4.415 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)cc1 ZINC000447585977 871493957 /nfs/dbraw/zinc/49/39/57/871493957.db2.gz MAELJSRVBZWPEQ-VWLOTQADSA-N 2 0 419.544 4.191 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000448208919 872106183 /nfs/dbraw/zinc/10/61/83/872106183.db2.gz MDRQRTONBNXOMH-ZCYQVOJMSA-N 2 0 424.633 4.221 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000448221104 872130878 /nfs/dbraw/zinc/13/08/78/872130878.db2.gz WCCLPDYQMJRUGH-UKILVPOCSA-N 2 0 424.633 4.221 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)[C@H](C)C1 ZINC000448461398 872418520 /nfs/dbraw/zinc/41/85/20/872418520.db2.gz KWLLCWVEPQZJEV-YKSBVNFPSA-N 2 0 414.638 4.323 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2C[C@@H]3CC[NH+](Cc4ccccc4)C[C@@H]3C2)cc1)C1CC1 ZINC000461444506 874501014 /nfs/dbraw/zinc/50/10/14/874501014.db2.gz LJQVZUJUNIMDDS-LOSJGSFVSA-N 2 0 417.597 4.265 20 0 HIADRP C[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)N(C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC000461723815 874871166 /nfs/dbraw/zinc/87/11/66/874871166.db2.gz JEWNCVUGFFRPFJ-SLSDLSHTSA-N 2 0 422.617 4.201 20 0 HIADRP Cc1cccc(N2CC[NH+](CCC(=O)Nc3cccc(C[NH+]4CCCCC4)c3)CC2)c1 ZINC000462030147 875145492 /nfs/dbraw/zinc/14/54/92/875145492.db2.gz AXRGFJWZKUACQU-UHFFFAOYSA-N 2 0 420.601 4.132 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000462748623 875817226 /nfs/dbraw/zinc/81/72/26/875817226.db2.gz DSJNESSKORAPHH-DEOSSOPVSA-N 2 0 414.638 4.052 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)[C@@H](C)C1 ZINC000463126309 876171033 /nfs/dbraw/zinc/17/10/33/876171033.db2.gz TUIQIDWHECCWSU-CVDCTZTESA-N 2 0 408.030 4.031 20 0 HIADRP C[C@H](CCCOc1ccccc1C(N)=O)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000468936225 883001249 /nfs/dbraw/zinc/00/12/49/883001249.db2.gz IPEGUUUVLVLPFQ-SNWXZZBVSA-N 2 0 421.585 4.118 20 0 HIADRP COc1ccccc1N1CC[C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000463290558 876350655 /nfs/dbraw/zinc/35/06/55/876350655.db2.gz KQLJWVOAQYYKRR-KWDCZQRMSA-N 2 0 405.586 4.307 20 0 HIADRP c1ccc(CC[N@@H+]2CC[C@H](CNC3C[C@H]4CC[C@@H](C3)[NH+]4Cc3ccccc3)C2)cc1 ZINC000463291188 876351071 /nfs/dbraw/zinc/35/10/71/876351071.db2.gz MKTHMPWFBCPJTC-BKILYWIHSA-N 2 0 403.614 4.336 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464828787 878083918 /nfs/dbraw/zinc/08/39/18/878083918.db2.gz DAZDGIVLBOBAKG-LJQANCHMSA-N 2 0 415.965 4.131 20 0 HIADRP C[N@H+](C[C@@H](O)COc1ccc(Cl)cc1Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464834870 878096988 /nfs/dbraw/zinc/09/69/88/878096988.db2.gz HNICKRCXKSBKBP-UYAOXDASSA-N 2 0 423.384 4.187 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(CNC(=O)N(C)CC[C@@H]3CCCC[NH+]3C)cc2)C1 ZINC000465518989 878966794 /nfs/dbraw/zinc/96/67/94/878966794.db2.gz FORTZINZSBOOBD-IMSXRSKXSA-N 2 0 414.638 4.180 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@H](C1CCCCC1)[NH+](C)C ZINC000465533096 878990244 /nfs/dbraw/zinc/99/02/44/878990244.db2.gz IULGMQBBDVOEPO-LADGPHEKSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1C ZINC000465567804 879042904 /nfs/dbraw/zinc/04/29/04/879042904.db2.gz IWKDUFIINCFCAH-YKSBVNFPSA-N 2 0 420.601 4.231 20 0 HIADRP CCC(CC)[C@@H](CNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCCC1 ZINC000465571642 879044309 /nfs/dbraw/zinc/04/43/09/879044309.db2.gz HKXDADNRGAMBLP-LADGPHEKSA-N 2 0 414.638 4.051 20 0 HIADRP CN(C)[C@H](CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccccc1Cl ZINC000503437326 912445573 /nfs/dbraw/zinc/44/55/73/912445573.db2.gz PVASSMBMBXKZES-DENIHFKCSA-N 2 0 421.029 4.240 20 0 HIADRP Cc1cc(N2CCC(OCC[NH+]3CCCC3)CC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000466646353 880422238 /nfs/dbraw/zinc/42/22/38/880422238.db2.gz AOVVIBILGLENDH-UHFFFAOYSA-N 2 0 405.489 4.226 20 0 HIADRP C[NH+](C)CCc1ccc(CNC(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)cc1 ZINC000467013746 880817688 /nfs/dbraw/zinc/81/76/88/880817688.db2.gz LCRRIIARAAJIEO-UHFFFAOYSA-N 2 0 422.617 4.166 20 0 HIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000503564509 912640080 /nfs/dbraw/zinc/64/00/80/912640080.db2.gz AREFGDSEIYEPLF-MNDPQUGUSA-N 2 0 409.540 4.458 20 0 HIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C1 ZINC000467336092 881086859 /nfs/dbraw/zinc/08/68/59/881086859.db2.gz NSDUOBASHXPQDA-RPWUZVMVSA-N 2 0 420.601 4.032 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H]2CCc3cc(F)c(OC)cc32)CC1 ZINC000467349720 881105423 /nfs/dbraw/zinc/10/54/23/881105423.db2.gz YJRVLGLPEWIGGE-KSFYIVLOSA-N 2 0 415.528 4.453 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NCCC1CC[NH+](CC)CC1)c1cccc(C(F)(F)F)c1 ZINC000469634221 883842844 /nfs/dbraw/zinc/84/28/44/883842844.db2.gz RYKKEDPWROHJLL-HXUWFJFHSA-N 2 0 413.528 4.327 20 0 HIADRP CC(C)S(=O)(=O)c1ccc(C[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000469755426 883919386 /nfs/dbraw/zinc/91/93/86/883919386.db2.gz AHPVGCCGFGJRFB-PMACEKPBSA-N 2 0 414.615 4.115 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N1CCC[C@H](C[NH+]2CCC(C)CC2)C1)c1ccccc1 ZINC000503690508 912794822 /nfs/dbraw/zinc/79/48/22/912794822.db2.gz PJFUWUMXCXBHGW-FCHUYYIVSA-N 2 0 414.638 4.269 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)CC1 ZINC000503740809 912813434 /nfs/dbraw/zinc/81/34/34/912813434.db2.gz QQYQHVKIBVJNSN-NRFANRHFSA-N 2 0 414.638 4.413 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC(C[NH+]2CCCC2)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000503743198 912813677 /nfs/dbraw/zinc/81/36/77/912813677.db2.gz WTTBWBLXEFLOIT-OAQYLSRUSA-N 2 0 414.638 4.413 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CC[C@H](C[NH+]2CCCC2)C1)C1CCCCC1 ZINC000470734876 885189850 /nfs/dbraw/zinc/18/98/50/885189850.db2.gz VRVGCDQMWOHDLC-OAQYLSRUSA-N 2 0 412.622 4.078 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000470893974 885391100 /nfs/dbraw/zinc/39/11/00/885391100.db2.gz AGUGJYQZSAQYEF-RTWAWAEBSA-N 2 0 400.611 4.023 20 0 HIADRP O=C(NC[C@H]1CC[N@H+](Cc2ccccc2)C1)Nc1ccc(CC[NH+]2CCCCC2)cc1 ZINC000471247144 885824900 /nfs/dbraw/zinc/82/49/00/885824900.db2.gz YLFYLOWGOKRING-XMMPIXPASA-N 2 0 420.601 4.359 20 0 HIADRP CCN(C(=O)NC[C@H](c1cccs1)[NH+](C)C)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000471374867 886016014 /nfs/dbraw/zinc/01/60/14/886016014.db2.gz UDZDNRFNOMXPFA-HMXCVIKNSA-N 2 0 414.619 4.218 20 0 HIADRP CCN(C(=O)NC1CC[NH+](C(C)(C)C)CC1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473937237 888815798 /nfs/dbraw/zinc/81/57/98/888815798.db2.gz BCNOENKDIGLUNR-DENIHFKCSA-N 2 0 400.611 4.116 20 0 HIADRP Cn1c2ccc(C[NH+]3CCC4(CC[N@H+](Cc5ccccc5)C4)CC3)cc2sc1=O ZINC000474273880 889137963 /nfs/dbraw/zinc/13/79/63/889137963.db2.gz GCKKZYXEXIRQNF-UHFFFAOYSA-N 2 0 407.583 4.088 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(C)C2CC[NH+](CCc3ccccn3)CC2)cc1)C(C)C ZINC000504546628 913323218 /nfs/dbraw/zinc/32/32/18/913323218.db2.gz NZKKYIGGLDXEQK-UHFFFAOYSA-N 2 0 422.617 4.091 20 0 HIADRP CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@H]1C)CC2 ZINC000474896432 889755254 /nfs/dbraw/zinc/75/52/54/889755254.db2.gz QJJWFRFWNUJGAP-MOPGFXCFSA-N 2 0 408.590 4.329 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(Cl)cc1-n1cncn1 ZINC000474940351 889798207 /nfs/dbraw/zinc/79/82/07/889798207.db2.gz YMBXTYSRPPCSMY-UHFFFAOYSA-N 2 0 410.953 4.054 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000475141490 890007788 /nfs/dbraw/zinc/00/77/88/890007788.db2.gz WEBATGIGYKLZNG-UHFFFAOYSA-N 2 0 412.622 4.269 20 0 HIADRP COc1ccc(OCc2ccccn2)c(CNC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000475274507 890169254 /nfs/dbraw/zinc/16/92/54/890169254.db2.gz NGNXIYUOPQGBMV-QFIPXVFZSA-N 2 0 417.553 4.281 20 0 HIADRP c1ccc(C[NH+]2CCC[C@]3(CC[N@@H+](CCc4nc(-c5ccccc5)no4)C3)C2)cc1 ZINC000475731448 890671055 /nfs/dbraw/zinc/67/10/55/890671055.db2.gz VHTANRMZIBNYDQ-RUZDIDTESA-N 2 0 402.542 4.267 20 0 HIADRP CN(C(=O)NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000475997679 890921395 /nfs/dbraw/zinc/92/13/95/890921395.db2.gz NFFXTNXOZSCGND-XMMPIXPASA-N 2 0 412.622 4.090 20 0 HIADRP c1cc(C[N@@H+]2CCC[C@@]3(CCCOC3)C2)ccc1C[NH+]1CCC[C@]2(CCCOC2)C1 ZINC000477044473 891970825 /nfs/dbraw/zinc/97/08/25/891970825.db2.gz CANZSIPLWHWIIR-WMPKNSHKSA-N 2 0 412.618 4.472 20 0 HIADRP CC(C)(C)c1nn(-c2ccccc2Cl)cc1C[NH2+]CCCC[NH+]1CCOCC1 ZINC000478185847 893348689 /nfs/dbraw/zinc/34/86/89/893348689.db2.gz YMTLSZAQWHQEOE-UHFFFAOYSA-N 2 0 404.986 4.025 20 0 HIADRP CC1(C)C[C@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c2cc(Br)ccc21 ZINC000479062828 894324806 /nfs/dbraw/zinc/32/48/06/894324806.db2.gz OPZHMPMRTZKZQN-YWZLYKJASA-N 2 0 407.396 4.262 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479289167 894568697 /nfs/dbraw/zinc/56/86/97/894568697.db2.gz VZGDLUFSRIISSD-JOCHJYFZSA-N 2 0 416.407 4.154 20 0 HIADRP C[C@@H]1CCCC[NH+]1CCC1CCN(C(=O)NCCCC[N@H+]2CCC[C@H](C)C2)CC1 ZINC000479446422 894762857 /nfs/dbraw/zinc/76/28/57/894762857.db2.gz BHRZLBTXSZYGPY-FCHUYYIVSA-N 2 0 406.659 4.185 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CCc1cccc(OCC(F)(F)F)c1 ZINC000479523530 894833131 /nfs/dbraw/zinc/83/31/31/894833131.db2.gz QFTZMXPDGBGQGO-UTKZUKDTSA-N 2 0 407.480 4.065 20 0 HIADRP COc1ccc(-c2ccncc2)cc1C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000479559842 894857766 /nfs/dbraw/zinc/85/77/66/894857766.db2.gz SSIOVZJRVAWAIP-UHFFFAOYSA-N 2 0 417.553 4.004 20 0 HIADRP COc1ccc([C@H](CN[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)[NH+]2CCCC2)cc1 ZINC000480086233 895445509 /nfs/dbraw/zinc/44/55/09/895445509.db2.gz AHAXIZBDSIWHFL-NYMACZPPSA-N 2 0 407.602 4.332 20 0 HIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc(NS(=O)(=O)CC)cc2)cc1 ZINC000480143136 895523730 /nfs/dbraw/zinc/52/37/30/895523730.db2.gz QOUSSSXCLXCELU-SFHVURJKSA-N 2 0 403.592 4.141 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480143286 895524848 /nfs/dbraw/zinc/52/48/48/895524848.db2.gz OOXNAKNPVUBMIC-SFHVURJKSA-N 2 0 400.588 4.315 20 0 HIADRP C[NH+]1CCN(CCC[NH2+][C@@H](CCSc2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000480162517 895552384 /nfs/dbraw/zinc/55/23/84/895552384.db2.gz IGSNOPBLYKOHEM-QHCPKHFHSA-N 2 0 419.585 4.415 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1)c1ccc2c(c1)OCCO2 ZINC000480244160 895653652 /nfs/dbraw/zinc/65/36/52/895653652.db2.gz XEZWAXSSHBMMHQ-YDHSSHFGSA-N 2 0 410.558 4.308 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)[C@H](C)C1 ZINC000480264568 895672459 /nfs/dbraw/zinc/67/24/59/895672459.db2.gz VYOQRNKDZWEXQJ-RCZVLFRGSA-N 3 0 401.639 4.145 20 0 HIADRP C[NH+]1CCC(C[NH2+]Cc2cc(Br)c(Cl)s2)(N2CCCCC2)CC1 ZINC000480330837 895734305 /nfs/dbraw/zinc/73/43/05/895734305.db2.gz DTKHPUPVIBFFKY-UHFFFAOYSA-N 2 0 420.848 4.204 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccc(COCC(F)(F)F)cc1 ZINC000480363276 895769820 /nfs/dbraw/zinc/76/98/20/895769820.db2.gz LWICBIHQBVXXIM-UWJYYQICSA-N 2 0 407.480 4.161 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@@H](C)C1 ZINC000480473049 895854472 /nfs/dbraw/zinc/85/44/72/895854472.db2.gz RDRIMDXQJBFSHJ-LPHOPBHVSA-N 2 0 407.649 4.449 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H](C)[C@H](C)Oc1ccc(Cl)cc1Cl)N1CC[NH+](C)CC1 ZINC000480523256 895887135 /nfs/dbraw/zinc/88/71/35/895887135.db2.gz DUFVSDZFMNOGNF-GJYPPUQNSA-N 2 0 402.410 4.011 20 0 HIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480536671 895899553 /nfs/dbraw/zinc/89/95/53/895899553.db2.gz CWPUJFMQHAPMDS-WIYYLYMNSA-N 2 0 400.636 4.350 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480539247 895902672 /nfs/dbraw/zinc/90/26/72/895902672.db2.gz KEYFIOOCXABSPY-JXFKEZNVSA-N 2 0 404.599 4.180 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C1CCN(CC[NH+](C)C)CC1 ZINC000480554663 895914893 /nfs/dbraw/zinc/91/48/93/895914893.db2.gz ODXWBWSQQREPFR-OAHLLOKOSA-N 2 0 407.027 4.449 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000480601295 895964925 /nfs/dbraw/zinc/96/49/25/895964925.db2.gz MTOYVHHUUITPKV-XLGIIRLISA-N 2 0 406.618 4.456 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480614660 895980750 /nfs/dbraw/zinc/98/07/50/895980750.db2.gz VMRVLBJSESFOHQ-MOPGFXCFSA-N 2 0 415.603 4.141 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC[C@@H](C)C2)[C@H](C)C1 ZINC000480617752 895983595 /nfs/dbraw/zinc/98/35/95/895983595.db2.gz VTMFXFBRQQDEIG-RQTOMXEWSA-N 3 0 401.639 4.145 20 0 HIADRP FC(F)(F)COc1ccc(CC[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000480668536 896032754 /nfs/dbraw/zinc/03/27/54/896032754.db2.gz SXYMEVBUONYIBB-PCCBWWKXSA-N 2 0 419.491 4.065 20 0 HIADRP C[NH+]1CCN(c2cc(CN[C@@H]3CCCc4c(Cl)sc(Cl)c43)ccn2)CC1 ZINC000480703787 896065549 /nfs/dbraw/zinc/06/55/49/896065549.db2.gz FKEGOWSPNVCTGX-OAHLLOKOSA-N 2 0 411.402 4.369 20 0 HIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1 ZINC000480705198 896067191 /nfs/dbraw/zinc/06/71/91/896067191.db2.gz MOLRLSLYFSPRHG-FQEVSTJZSA-N 2 0 416.569 4.360 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1 ZINC000480720089 896079318 /nfs/dbraw/zinc/07/93/18/896079318.db2.gz IINLTPYIBRWQCZ-SFHVURJKSA-N 2 0 409.574 4.488 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2sc(-c3ccccc3F)nc2C)CC1 ZINC000480769020 896131171 /nfs/dbraw/zinc/13/11/71/896131171.db2.gz HUGIROROLDOFTQ-QGZVFWFLSA-N 2 0 404.599 4.326 20 0 HIADRP CCn1cc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)cn1 ZINC000480774407 896138279 /nfs/dbraw/zinc/13/82/79/896138279.db2.gz AOXCSJOABKAZGV-GOSISDBHSA-N 2 0 423.527 4.175 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000480884183 896240499 /nfs/dbraw/zinc/24/04/99/896240499.db2.gz SBZIDDDNLAOAMF-KRWDZBQOSA-N 2 0 407.480 4.183 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(F)c(Br)c1 ZINC000480901696 896257509 /nfs/dbraw/zinc/25/75/09/896257509.db2.gz SKSGYDSQGWROGY-MRXNPFEDSA-N 2 0 420.370 4.186 20 0 HIADRP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000480904655 896260142 /nfs/dbraw/zinc/26/01/42/896260142.db2.gz BTBKWBBDNYSPLV-KRWDZBQOSA-N 2 0 400.636 4.347 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(OC(F)F)cc1 ZINC000480920546 896278245 /nfs/dbraw/zinc/27/82/45/896278245.db2.gz LUKMXLIUGDRUTB-QFIPXVFZSA-N 2 0 403.517 4.276 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(OC(F)F)cc1 ZINC000480920545 896278573 /nfs/dbraw/zinc/27/85/73/896278573.db2.gz LUKMXLIUGDRUTB-JOCHJYFZSA-N 2 0 403.517 4.276 20 0 HIADRP CC[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc2cc(OC)ccc2c1 ZINC000481224701 896577193 /nfs/dbraw/zinc/57/71/93/896577193.db2.gz WLFODJVMWBAZTF-XMMPIXPASA-N 2 0 404.558 4.236 20 0 HIADRP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(SCC(F)F)cc1 ZINC000481245231 896597542 /nfs/dbraw/zinc/59/75/42/896597542.db2.gz FUPINOLJIQXALM-MRXNPFEDSA-N 2 0 406.546 4.041 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2cccc(CN3CCOCC3)c2)cnn1-c1cc(C)ccc1C ZINC000481311872 896658044 /nfs/dbraw/zinc/65/80/44/896658044.db2.gz LLKFXAQEQCNGKS-OAQYLSRUSA-N 2 0 418.585 4.481 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCCOc3cc(Br)ccc32)cc1 ZINC000481331564 896691604 /nfs/dbraw/zinc/69/16/04/896691604.db2.gz HHFRTUJNZNIBIT-HXUWFJFHSA-N 2 0 419.363 4.393 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000481716330 897108592 /nfs/dbraw/zinc/10/85/92/897108592.db2.gz KIMBIONVXDNJRN-NVQXNPDNSA-N 2 0 406.618 4.458 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000481722834 897118057 /nfs/dbraw/zinc/11/80/57/897118057.db2.gz ZFLSQTQEOPILPC-IBGZPJMESA-N 3 0 401.620 4.251 20 0 HIADRP Clc1ccc2c(c1)[C@@H]([NH2+]CCCN1CCN(c3cc[nH+]cc3)CC1)CCS2 ZINC000482114971 897565786 /nfs/dbraw/zinc/56/57/86/897565786.db2.gz OIFGFRLOIKKSNI-FQEVSTJZSA-N 2 0 402.995 4.074 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CC1CC[NH+](CCN(C)C)CC1 ZINC000482347465 897856948 /nfs/dbraw/zinc/85/69/48/897856948.db2.gz CXZWLNCGOZMNQP-MRXNPFEDSA-N 2 0 404.599 4.182 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000482359895 897876954 /nfs/dbraw/zinc/87/69/54/897876954.db2.gz RQHNTQZVQJVIHK-GOSISDBHSA-N 2 0 400.394 4.070 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2ccc3ccccc3c2OC(F)F)CC1 ZINC000482513125 898098315 /nfs/dbraw/zinc/09/83/15/898098315.db2.gz SLMHRBPYWQTWRK-QZTJIDSGSA-N 2 0 405.533 4.365 20 0 HIADRP C[C@H](C[NH2+][C@H](Cc1ccc(F)cc1)c1ccccc1Cl)CN1CC[NH+](C)CC1 ZINC000482513578 898098624 /nfs/dbraw/zinc/09/86/24/898098624.db2.gz REYXKNSFBMDNOT-WZONZLPQSA-N 2 0 403.973 4.236 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000482534842 898122380 /nfs/dbraw/zinc/12/23/80/898122380.db2.gz OJRHFCBBUJYRND-LJQANCHMSA-N 2 0 419.038 4.458 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000482543419 898131923 /nfs/dbraw/zinc/13/19/23/898131923.db2.gz MQJJAMMXQHFJOP-HSZRJFAPSA-N 2 0 403.973 4.380 20 0 HIADRP CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1OCC ZINC000482544969 898134730 /nfs/dbraw/zinc/13/47/30/898134730.db2.gz VQGCFWQGSNWALD-LJQANCHMSA-N 2 0 412.574 4.292 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccccc1OC(F)(F)F ZINC000482549771 898140070 /nfs/dbraw/zinc/14/00/70/898140070.db2.gz DUSPRBZUVFAFRQ-MRXNPFEDSA-N 2 0 408.464 4.393 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2cccc(NC(C)=O)c2)CC1 ZINC000482556312 898147321 /nfs/dbraw/zinc/14/73/21/898147321.db2.gz RYRKBZKBJLZISG-ROUUACIJSA-N 2 0 412.553 4.338 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCc4cc(Br)ccc43)cc2)CC1 ZINC000482557698 898148854 /nfs/dbraw/zinc/14/88/54/898148854.db2.gz SDIVFHHPTLOULD-QFIPXVFZSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000482558329 898148948 /nfs/dbraw/zinc/14/89/48/898148948.db2.gz WMQLRHHSDXMNQR-AWEZNQCLSA-N 2 0 411.434 4.402 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCCO3)CC1 ZINC000482558135 898149118 /nfs/dbraw/zinc/14/91/18/898149118.db2.gz MSCAHIYKILRZCT-ROUUACIJSA-N 2 0 413.537 4.151 20 0 HIADRP C[C@@H](C[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)N1CC[NH+](C)CC1 ZINC000482570444 898165240 /nfs/dbraw/zinc/16/52/40/898165240.db2.gz WUXUHQZKPXZDAI-YJBOKZPZSA-N 2 0 405.011 4.066 20 0 HIADRP C[C@@H](C[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)N1CC[NH+](C)CC1 ZINC000482570442 898165665 /nfs/dbraw/zinc/16/56/65/898165665.db2.gz WUXUHQZKPXZDAI-MAUKXSAKSA-N 2 0 405.011 4.066 20 0 HIADRP CC(C)Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000482631111 898232751 /nfs/dbraw/zinc/23/27/51/898232751.db2.gz CORLDNJWBPDQHJ-NBGIEHNGSA-N 2 0 407.602 4.433 20 0 HIADRP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000482645556 898249980 /nfs/dbraw/zinc/24/99/80/898249980.db2.gz ZBMHPVXQEDJCHA-UZLBHIALSA-N 2 0 414.619 4.123 20 0 HIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000482649903 898252811 /nfs/dbraw/zinc/25/28/11/898252811.db2.gz RZZXQOKHYHSVMT-RXVVDRJESA-N 2 0 405.542 4.289 20 0 HIADRP C[C@@H](c1nnc(-c2ccccc2F)s1)N1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000482678297 898280447 /nfs/dbraw/zinc/28/04/47/898280447.db2.gz CEWSLDLRAMCJGH-BBWFWOEESA-N 2 0 418.582 4.226 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc(COC2CCOCC2)c1 ZINC000482876795 898490211 /nfs/dbraw/zinc/49/02/11/898490211.db2.gz PRPDGDNJUOUKQZ-HFZDXXHNSA-N 2 0 408.586 4.382 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc(COC2CCOCC2)c1 ZINC000482876797 898490749 /nfs/dbraw/zinc/49/07/49/898490749.db2.gz PRPDGDNJUOUKQZ-QFQXNSOFSA-N 2 0 408.586 4.382 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)[C@H](C)C1 ZINC000482948833 898575920 /nfs/dbraw/zinc/57/59/20/898575920.db2.gz SOKDEPYJDGAIQI-RDGATRHJSA-N 3 0 401.639 4.289 20 0 HIADRP O=C([C@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000483140893 898820906 /nfs/dbraw/zinc/82/09/06/898820906.db2.gz DZRUOWLJIHKCLV-JYFHCDHNSA-N 2 0 409.618 4.156 20 0 HIADRP C[C@@H]([NH2+][C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483191370 898849072 /nfs/dbraw/zinc/84/90/72/898849072.db2.gz FJGZZQUCYMBCCV-MJGOQNOKSA-N 2 0 419.516 4.158 20 0 HIADRP C[C@H](CCNC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[N@H+](C)Cc1ccccc1 ZINC000483331978 898960399 /nfs/dbraw/zinc/96/03/99/898960399.db2.gz UIQZZUKPVQXOSU-JOCHJYFZSA-N 2 0 407.602 4.316 20 0 HIADRP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000483598042 899248149 /nfs/dbraw/zinc/24/81/49/899248149.db2.gz YEYUUFNIUAAQKX-IZZNHLLZSA-N 2 0 417.597 4.409 20 0 HIADRP O=C([C@@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000483603883 899254653 /nfs/dbraw/zinc/25/46/53/899254653.db2.gz FVLSTDWREIBWLZ-ARNLJNQMSA-N 2 0 409.618 4.154 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@H](C)C3)cc2)C[C@H]1C ZINC000483686713 899344780 /nfs/dbraw/zinc/34/47/80/899344780.db2.gz VEJMDCBXVHQBMM-WHLIWEHUSA-N 2 0 414.638 4.179 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC2CC[NH+](C3CCCC3)CC2)C1 ZINC000483711945 899367983 /nfs/dbraw/zinc/36/79/83/899367983.db2.gz PGESPXURLXNXHP-HXUWFJFHSA-N 2 0 412.622 4.125 20 0 HIADRP COc1cccc([C@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)c1 ZINC000483737274 899399128 /nfs/dbraw/zinc/39/91/28/899399128.db2.gz ZUITXMJPKTWJTA-INIZCTEOSA-N 2 0 407.480 4.317 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000483743099 899405915 /nfs/dbraw/zinc/40/59/15/899405915.db2.gz MLGKHQODAPISSW-INIZCTEOSA-N 2 0 407.480 4.317 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccccc2C[NH+]2CCCCCC2)C[C@H]1C ZINC000483811738 899489680 /nfs/dbraw/zinc/48/96/80/899489680.db2.gz AHXJDEYJZFVXLZ-NFBKMPQASA-N 2 0 400.611 4.077 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@H](C)c3ccc(OCC[NH+](C)C)cc3)ccc2NC1=O ZINC000483846974 899527596 /nfs/dbraw/zinc/52/75/96/899527596.db2.gz CTNQWZZSRITOMC-JLHGSKIFSA-N 2 0 411.546 4.148 20 0 HIADRP O=C(NC1CC[NH+](C2CCCC2)CC1)N1CC[NH+](Cc2cccc3ccccc32)CC1 ZINC000484019809 899654414 /nfs/dbraw/zinc/65/44/14/899654414.db2.gz ZRPGIZZZYHLBBU-UHFFFAOYSA-N 2 0 420.601 4.074 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccccc3Br)CC2)[C@@H](C)C1 ZINC000484138681 899759196 /nfs/dbraw/zinc/75/91/96/899759196.db2.gz FEENLGLGEIOTJI-PXNSSMCTSA-N 2 0 409.412 4.207 20 0 HIADRP CC[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(Br)cc1 ZINC000484273347 899844744 /nfs/dbraw/zinc/84/47/44/899844744.db2.gz AIBRKXXNPAAEJA-LJQANCHMSA-N 2 0 424.427 4.117 20 0 HIADRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000484278902 899848680 /nfs/dbraw/zinc/84/86/80/899848680.db2.gz PLRHGMSBEVJVSK-SFHVURJKSA-N 2 0 412.405 4.197 20 0 HIADRP CCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cc1OCC ZINC000484481608 899974201 /nfs/dbraw/zinc/97/42/01/899974201.db2.gz WKPVKPHEVNZXCL-LJQANCHMSA-N 2 0 412.574 4.292 20 0 HIADRP C(CCN1CC[NH+](C2CCCCC2)CC1)CCN1CC[NH+](C2CCCCC2)CC1 ZINC000486227823 901410236 /nfs/dbraw/zinc/41/02/36/901410236.db2.gz GIPFDDZGDNQKAA-UHFFFAOYSA-N 2 0 404.687 4.057 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@@H](C)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000486240741 901423560 /nfs/dbraw/zinc/42/35/60/901423560.db2.gz BCUAHZGWSMLSFE-URXFXBBRSA-N 2 0 422.617 4.237 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@H](C)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000486240744 901423775 /nfs/dbraw/zinc/42/37/75/901423775.db2.gz BCUAHZGWSMLSFE-ZJSXRUAMSA-N 2 0 422.617 4.237 20 0 HIADRP C[C@@H]([NH2+]Cc1cnc(-c2ccco2)s1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000487293323 902139029 /nfs/dbraw/zinc/13/90/29/902139029.db2.gz ZHJLZAVBGIQXLO-OAHLLOKOSA-N 2 0 400.523 4.145 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](CCSc2ccc(Cl)cc2)CC1 ZINC000487840516 902400419 /nfs/dbraw/zinc/40/04/19/902400419.db2.gz SKVUQDWUKOVWAB-UHFFFAOYSA-N 2 0 424.054 4.136 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)N[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)CC1 ZINC000488606257 902896435 /nfs/dbraw/zinc/89/64/35/902896435.db2.gz CIPZAJTYZLYGPZ-YADHBBJMSA-N 2 0 422.564 4.052 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489312379 903325120 /nfs/dbraw/zinc/32/51/20/903325120.db2.gz GCIOKPGUSRPEBK-SFTDATJTSA-N 2 0 414.638 4.049 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000489520322 903434147 /nfs/dbraw/zinc/43/41/47/903434147.db2.gz YOSOCIQECMJZHY-QPPBQGQZSA-N 2 0 414.638 4.051 20 0 HIADRP Cc1cc(C(C)(C)C)cc2c1OCCC[C@H]2[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000489558043 903461909 /nfs/dbraw/zinc/46/19/09/903461909.db2.gz NKMPRXVPPAVVDO-HSZRJFAPSA-N 2 0 422.617 4.443 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCOc4c(Cl)cc(C)cc43)cn2)CC1 ZINC000489606103 903495592 /nfs/dbraw/zinc/49/55/92/903495592.db2.gz CLHWWNMDPVGKBS-NRFANRHFSA-N 2 0 414.981 4.189 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000489837687 903622263 /nfs/dbraw/zinc/62/22/63/903622263.db2.gz TZRHPUCUZCCFPG-OFVILXPXSA-N 2 0 422.617 4.238 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC1 ZINC000489930019 903683535 /nfs/dbraw/zinc/68/35/35/903683535.db2.gz AZDFMGNFGAADOD-UHFFFAOYSA-N 2 0 420.601 4.088 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000490120423 903776387 /nfs/dbraw/zinc/77/63/87/903776387.db2.gz UJLIVWULYWALBS-HSZRJFAPSA-N 2 0 401.982 4.055 20 0 HIADRP CCOc1ccc([C@@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2ccccc2Cl)cc1 ZINC000490120860 903776504 /nfs/dbraw/zinc/77/65/04/903776504.db2.gz WWWSJBXEARCNGX-XMMPIXPASA-N 2 0 416.009 4.444 20 0 HIADRP C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506052873 914751222 /nfs/dbraw/zinc/75/12/22/914751222.db2.gz ZYTXMEAMXWPOGD-QGZVFWFLSA-N 2 0 418.969 4.275 20 0 HIADRP O=C(Nc1ccccc1)c1cccc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)c1 ZINC000506056583 914758748 /nfs/dbraw/zinc/75/87/48/914758748.db2.gz NSCDNIOVVVBLCZ-UHFFFAOYSA-N 2 0 421.585 4.263 20 0 HIADRP C[C@H](NC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccccc1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000490810781 904257936 /nfs/dbraw/zinc/25/79/36/904257936.db2.gz HRMKTBYEYQUWQC-GPUOULLFSA-N 2 0 405.586 4.068 20 0 HIADRP C[C@H](NC(=O)[C@H]1CCCC[N@@H+]1Cc1ccccc1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000490810782 904258349 /nfs/dbraw/zinc/25/83/49/904258349.db2.gz HRMKTBYEYQUWQC-GVXSCFBNSA-N 2 0 405.586 4.068 20 0 HIADRP C[C@H](NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000490828613 904272022 /nfs/dbraw/zinc/27/20/22/904272022.db2.gz QKCCSFCKMWUQHF-NKKJXINNSA-N 2 0 423.576 4.065 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000491015707 904369349 /nfs/dbraw/zinc/36/93/49/904369349.db2.gz ALZDWVCRNIOPHD-JPYJTQIMSA-N 2 0 403.973 4.432 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000491026067 904377049 /nfs/dbraw/zinc/37/70/49/904377049.db2.gz XYQNOXOEFUNOJO-JOCHJYFZSA-N 2 0 416.407 4.156 20 0 HIADRP OCC[NH+]1CCC(C[NH2+][C@@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CC1 ZINC000491051549 904397756 /nfs/dbraw/zinc/39/77/56/904397756.db2.gz KDCRANBEAAQXRA-NRFANRHFSA-N 2 0 424.919 4.325 20 0 HIADRP CCOc1ccc([C@@H]([NH2+]C[C@H](C)CN2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000491062835 904404878 /nfs/dbraw/zinc/40/48/78/904404878.db2.gz XKAZDEOCSLFSGO-YADARESESA-N 2 0 416.009 4.301 20 0 HIADRP CCOc1ccc([C@@H]([NH2+]CCCN2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000491330716 904540835 /nfs/dbraw/zinc/54/08/35/904540835.db2.gz VFOFWHJRFUGDAA-HSZRJFAPSA-N 2 0 401.982 4.055 20 0 HIADRP COc1ccc([C@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)c2ccccc2Cl)cc1 ZINC000492255001 904824775 /nfs/dbraw/zinc/82/47/75/904824775.db2.gz XRYIUEGLCQWICK-XXBNENTESA-N 2 0 402.966 4.265 20 0 HIADRP C[C@@]1(CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)CCC[N@@H+]1Cc1ccccc1 ZINC000493382859 905100462 /nfs/dbraw/zinc/10/04/62/905100462.db2.gz IVTGBOFBKPNKOS-SANMLTNESA-N 2 0 405.586 4.070 20 0 HIADRP O=C(C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000493503025 905140188 /nfs/dbraw/zinc/14/01/88/905140188.db2.gz MHNHATJFRCUVAS-ISKFKSNPSA-N 2 0 423.626 4.175 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)CC1 ZINC000493543889 905154940 /nfs/dbraw/zinc/15/49/40/905154940.db2.gz KIBAFHBNVUVPBK-ZEQKJWHPSA-N 2 0 419.613 4.077 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)cc1 ZINC000494067271 905403645 /nfs/dbraw/zinc/40/36/45/905403645.db2.gz WWIOQEAWEZRIJI-UHFFFAOYSA-N 2 0 423.507 4.135 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(-c4ccccc4)cc3OC)cn2)CC1 ZINC000512422143 921149889 /nfs/dbraw/zinc/14/98/89/921149889.db2.gz PFUFHJRZGOIAEZ-UHFFFAOYSA-N 2 0 416.569 4.189 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NCc1ccccc1C[NH+]1CCCCCC1)c1ccsc1 ZINC000494583173 905848830 /nfs/dbraw/zinc/84/88/30/905848830.db2.gz DAQBLLJEDBFGEC-QFIPXVFZSA-N 2 0 414.619 4.226 20 0 HIADRP O[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000494649136 905882514 /nfs/dbraw/zinc/88/25/14/905882514.db2.gz QANHOAHXNATEKW-APHPEJJXSA-N 2 0 407.396 4.053 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000495420542 906440889 /nfs/dbraw/zinc/44/08/89/906440889.db2.gz JBPWCIVBSLYBKH-JQVVWYNYSA-N 2 0 415.603 4.009 20 0 HIADRP CC(C)n1nccc1NC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000495549265 906502888 /nfs/dbraw/zinc/50/28/88/906502888.db2.gz VCLCOPZPWOXMLP-VAMGGRTRSA-N 2 0 411.594 4.059 20 0 HIADRP Cc1ccc([C@@H](OC[C@H](O)C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c2ccccc2)cc1 ZINC000512581664 921248675 /nfs/dbraw/zinc/24/86/75/921248675.db2.gz JGYVEMOWZHUNNL-VOYXVEDVSA-N 2 0 408.586 4.019 20 0 HIADRP Cc1ccccc1[C@H](OC[C@H](O)C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1ccccc1 ZINC000512582123 921248765 /nfs/dbraw/zinc/24/87/65/921248765.db2.gz LAPXAKURYMIOOX-WTNYRSDSSA-N 2 0 408.586 4.019 20 0 HIADRP C[C@H](NC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H](c1ccccc1)[NH+](C)C ZINC000496652421 906729163 /nfs/dbraw/zinc/72/91/63/906729163.db2.gz RYYSPQBIQCBFAE-BCYRTQESSA-N 2 0 420.601 4.173 20 0 HIADRP COc1ccc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1NC(C)=O ZINC000512618016 921263499 /nfs/dbraw/zinc/26/34/99/921263499.db2.gz HKHMVVLBPINYGS-YTFSRNRJSA-N 2 0 407.558 4.044 20 0 HIADRP CCc1noc(C2CCC([NH2+]Cc3ccccc3C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)n1 ZINC000497518448 907009647 /nfs/dbraw/zinc/00/96/47/907009647.db2.gz DZKOLRQEVSDLII-JREAUHRESA-N 2 0 412.578 4.057 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NC2CC[NH+](CC3CCCC3)CC2)[C@@H]1c1cccs1 ZINC000497561643 907049366 /nfs/dbraw/zinc/04/93/66/907049366.db2.gz KTAHGOZSUBSTNB-DENIHFKCSA-N 2 0 418.651 4.085 20 0 HIADRP COc1cc(-c2ccccc2)ccc1C[NH+]1CCC(N2CC[NH+](C(C)C)CC2)CC1 ZINC000512768507 921303989 /nfs/dbraw/zinc/30/39/89/921303989.db2.gz DAJQNZNHZAYLQZ-UHFFFAOYSA-N 2 0 407.602 4.353 20 0 HIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000512827916 921333284 /nfs/dbraw/zinc/33/32/84/921333284.db2.gz MNUVGFFCRMPCER-KRWDZBQOSA-N 2 0 405.384 4.237 20 0 HIADRP CCC[C@H]([NH2+]C(C)C)C(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000498377845 907866806 /nfs/dbraw/zinc/86/68/06/907866806.db2.gz OFJZBDIASXYSCO-YZGWKJHDSA-N 2 0 413.528 4.371 20 0 HIADRP Cc1ccc([C@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N2CCOCC2)cc1 ZINC000499139651 908497671 /nfs/dbraw/zinc/49/76/71/908497671.db2.gz QGZZIEYXKPEJBX-NFGXINMFSA-N 2 0 419.613 4.154 20 0 HIADRP CCN(CC)C(=O)c1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499186104 908538720 /nfs/dbraw/zinc/53/87/20/908538720.db2.gz AMMOMJPIXHAZLL-MPIKPJSNSA-N 2 0 405.586 4.454 20 0 HIADRP CN1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@H]1c1ccc(F)c(F)c1 ZINC000499196760 908551513 /nfs/dbraw/zinc/55/15/13/908551513.db2.gz WNYRMJQNNKXQQQ-XVFVLVJGSA-N 2 0 411.540 4.495 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)c1ccc(-c2ccccc2Cl)o1 ZINC000499505817 908820947 /nfs/dbraw/zinc/82/09/47/908820947.db2.gz DDAXBYZZGOGXAI-KRWDZBQOSA-N 2 0 403.954 4.088 20 0 HIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C1CCN(C(=O)c2cc(Cl)c[nH]2)CC1 ZINC000513017273 921480126 /nfs/dbraw/zinc/48/01/26/921480126.db2.gz PADODYAHIODXQF-UHFFFAOYSA-N 2 0 416.997 4.021 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000513063802 921519869 /nfs/dbraw/zinc/51/98/69/921519869.db2.gz ISRJGVGNFKNFEB-FQEVSTJZSA-N 2 0 412.622 4.391 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NCC1([NH2+][C@H](C)c2ccccc2)CCOCC1)c1ccccc1 ZINC000500495162 909890644 /nfs/dbraw/zinc/89/06/44/909890644.db2.gz UORZLLRQAUWDEY-QPPBQGQZSA-N 2 0 423.601 4.086 20 0 HIADRP CCC[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1ccccn1 ZINC000500645285 909988974 /nfs/dbraw/zinc/98/89/74/909988974.db2.gz CKBRNZOCJQUURG-LJQANCHMSA-N 2 0 406.496 4.483 20 0 HIADRP CC(C)C[NH+]1CCC(NC(=O)NCc2ccc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)CC1 ZINC000500694962 910028371 /nfs/dbraw/zinc/02/83/71/910028371.db2.gz HOUQELYVLBGNKP-OYRHEFFESA-N 2 0 414.638 4.084 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)N2CCC(CCC[NH+](C)C)CC2)c2cccs2)CC1 ZINC000500794565 910083999 /nfs/dbraw/zinc/08/39/99/910083999.db2.gz UEKZCXMULGXLRF-NRFANRHFSA-N 2 0 420.667 4.285 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CCC(CCC[NH+](C)C)CC2)C1 ZINC000500820239 910102226 /nfs/dbraw/zinc/10/22/26/910102226.db2.gz FEHIHTMVDBXIDP-OAQYLSRUSA-N 2 0 414.638 4.182 20 0 HIADRP CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501043783 910257470 /nfs/dbraw/zinc/25/74/70/910257470.db2.gz GJLIODDVUOCUIE-OAQYLSRUSA-N 2 0 408.590 4.056 20 0 HIADRP COCc1cccc(OCC2(C[N@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)CC2)c1 ZINC000501051369 910260456 /nfs/dbraw/zinc/26/04/56/910260456.db2.gz MTCQIZOIXVZZJH-UHFFFAOYSA-N 2 0 409.574 4.235 20 0 HIADRP O=C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)N1CCC([NH+]2CCCCC2)CC1 ZINC000501052929 910263134 /nfs/dbraw/zinc/26/31/34/910263134.db2.gz KGJNOJNQCHXRTG-JOCHJYFZSA-N 2 0 419.013 4.137 20 0 HIADRP COc1ccc(-c2noc([C@@H](C)[N@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)n2)cc1 ZINC000501080131 910281275 /nfs/dbraw/zinc/28/12/75/910281275.db2.gz MROJZWMLRIAIRU-QGZVFWFLSA-N 2 0 407.518 4.050 20 0 HIADRP CC[NH+](CC)CCOc1ccc(NC(=O)NC2CC[NH+](CC3CCCC3)CC2)cc1 ZINC000501237472 910394787 /nfs/dbraw/zinc/39/47/87/910394787.db2.gz WNHAZGSQOWYLHA-UHFFFAOYSA-N 2 0 416.610 4.183 20 0 HIADRP C[C@@H](CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)[N@@H+]1CCC[C@@H](C)C1 ZINC000501488828 910604204 /nfs/dbraw/zinc/60/42/04/910604204.db2.gz CQPUCZQHPQDABY-RTWAWAEBSA-N 2 0 422.617 4.335 20 0 HIADRP C[N@H+](CCCNC(=O)NCc1ccccc1C[NH+]1CCCCC1)C1CCCCC1 ZINC000501582641 910688677 /nfs/dbraw/zinc/68/86/77/910688677.db2.gz SLPIKZIVCCYSRI-UHFFFAOYSA-N 2 0 400.611 4.126 20 0 HIADRP COc1cccc(NC(=O)[C@H](c2ccccc2)[NH+]2CCC(CCC[NH+](C)C)CC2)c1 ZINC000501802191 910854057 /nfs/dbraw/zinc/85/40/57/910854057.db2.gz DRKLYAFTSDKYSA-DEOSSOPVSA-N 2 0 409.574 4.429 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2cc(Cl)ccc2C)CC1 ZINC000501810687 910861368 /nfs/dbraw/zinc/86/13/68/910861368.db2.gz BGQBELCFACMYIO-SFHVURJKSA-N 2 0 410.002 4.046 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000501849195 910882414 /nfs/dbraw/zinc/88/24/14/910882414.db2.gz FRLZFFZXNKAUAA-RUZDIDTESA-N 2 0 420.601 4.309 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](c2cc(F)cc(Br)c2)C2CC2)CC1 ZINC000502005632 910974560 /nfs/dbraw/zinc/97/45/60/910974560.db2.gz OZNFJHIMPBOVJV-FQEVSTJZSA-N 2 0 412.391 4.045 20 0 HIADRP CSc1nnc(CCC[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)n1CC(C)C ZINC000513208701 921624891 /nfs/dbraw/zinc/62/48/91/921624891.db2.gz XJXJNJCNOFAAQZ-ICSRJNTNSA-N 2 0 407.672 4.221 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)C1 ZINC000502646048 911683851 /nfs/dbraw/zinc/68/38/51/911683851.db2.gz APCYTASFZZKUJN-VXKWHMMOSA-N 2 0 406.659 4.042 20 0 HIADRP O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000502651499 911692156 /nfs/dbraw/zinc/69/21/56/911692156.db2.gz QRROOTAGHFAWCP-XMMPIXPASA-N 2 0 412.622 4.121 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)N3CCC[C@@H](C[NH+]4CCCCCC4)C3)CC2)CC1 ZINC000502767734 911789829 /nfs/dbraw/zinc/78/98/29/911789829.db2.gz MQKFOMGJXLAIPS-BOMBAVFCSA-N 2 0 418.670 4.327 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)NC3CC[NH+](C4CCCCC4)CC3)CC2)CC1 ZINC000502767958 911791664 /nfs/dbraw/zinc/79/16/64/911791664.db2.gz NXJVXEIAFAOQOW-UHFFFAOYSA-N 2 0 404.643 4.126 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)NC[C@@H](c3ccccc3)[NH+]3CCCC3)CC2)CC1 ZINC000502774001 911798161 /nfs/dbraw/zinc/79/81/61/911798161.db2.gz XDVAAWJJGUSHQG-VHYCJAOWSA-N 2 0 412.622 4.166 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCC(C)(C)[NH2+][C@H](C)c2ccccc2)[NH+]2CCCC2)o1 ZINC000502781381 911804795 /nfs/dbraw/zinc/80/47/95/911804795.db2.gz LVCVENIZEXYACU-TZIWHRDSSA-N 2 0 412.578 4.154 20 0 HIADRP CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)NC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000502815256 911831131 /nfs/dbraw/zinc/83/11/31/911831131.db2.gz UBOJNXAXKKIWRI-JOCHJYFZSA-N 2 0 421.029 4.237 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000502861286 911869495 /nfs/dbraw/zinc/86/94/95/911869495.db2.gz KKYCEEQGHOTAFV-VXKWHMMOSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000502966319 911947994 /nfs/dbraw/zinc/94/79/94/911947994.db2.gz UCJZRUBLVLNICM-VXKWHMMOSA-N 2 0 414.638 4.051 20 0 HIADRP C[N@H+](Cc1ccccc1)CC(C)(C)CN1CCC(NC(=O)c2ccc(F)cc2)CC1 ZINC000506403041 915016724 /nfs/dbraw/zinc/01/67/24/915016724.db2.gz LHRMPHIKFPSHCI-UHFFFAOYSA-N 2 0 411.565 4.178 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CC[C@H](n2ncc3ccccc32)C1)C1CC[NH+](C)CC1 ZINC000513390714 921761598 /nfs/dbraw/zinc/76/15/98/921761598.db2.gz RYONUTIPEPXTKD-QHCPKHFHSA-N 2 0 403.574 4.014 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)c1)C1CCOCC1 ZINC000513400315 921769407 /nfs/dbraw/zinc/76/94/07/921769407.db2.gz XGJXHQWYKFZOLT-HSZRJFAPSA-N 2 0 416.512 4.232 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000507448183 916217196 /nfs/dbraw/zinc/21/71/96/916217196.db2.gz JMMOPPVBQFDUSO-ZDUSSCGKSA-N 2 0 405.892 4.397 20 0 HIADRP Clc1ccc(-c2noc(CC[NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]34)n2)cc1 ZINC000507508600 916272137 /nfs/dbraw/zinc/27/21/37/916272137.db2.gz JGLUBFRWNFBRGE-CEMLEFRQSA-N 2 0 422.960 4.433 20 0 HIADRP CC(C)(C)OC(=O)C1CCC([NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000507937665 916807373 /nfs/dbraw/zinc/80/73/73/916807373.db2.gz PEWJVXFUJOIAHE-UHFFFAOYSA-N 2 0 402.579 4.151 20 0 HIADRP C[NH+](C)Cc1ccc(-c2noc([C@@H]3C[N@H+](Cc4ccccc4)CCC3(F)F)n2)cc1 ZINC000507994468 916835428 /nfs/dbraw/zinc/83/54/28/916835428.db2.gz GGSJGERVOWYDBK-FQEVSTJZSA-N 2 0 412.484 4.423 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)cc1 ZINC000508307031 917115673 /nfs/dbraw/zinc/11/56/73/917115673.db2.gz CSOMATXCHGISGC-UHFFFAOYSA-N 2 0 411.565 4.406 20 0 HIADRP Cc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(OC[C@@H]2CCOC2)c1 ZINC000508691541 917454635 /nfs/dbraw/zinc/45/46/35/917454635.db2.gz NKODDSQVNLZTFF-PFATUAPWSA-N 2 0 408.586 4.411 20 0 HIADRP COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000508698615 917460466 /nfs/dbraw/zinc/46/04/66/917460466.db2.gz PIEPAXZTLRIPRF-WWNPGLIZSA-N 2 0 423.601 4.030 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1)c1ccco1 ZINC000509612159 918258418 /nfs/dbraw/zinc/25/84/18/918258418.db2.gz WVHMCHXMWUOOFG-NIRIFSCTSA-N 2 0 424.589 4.016 20 0 HIADRP COc1ccc([C@@H](CNC(=O)c2oc3ccccc3c2C[NH+](C)C)[NH+]2CCCC2)cc1 ZINC000510181571 918730694 /nfs/dbraw/zinc/73/06/94/918730694.db2.gz AWCOWPXLZWGNBR-JOCHJYFZSA-N 2 0 421.541 4.070 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCCC12CC[NH+](C)CC2)[NH2+][C@@H](C)c1ccccc1 ZINC000510934714 919455159 /nfs/dbraw/zinc/45/51/59/919455159.db2.gz QYXJCUPPVVXOKY-RBBKRZOGSA-N 2 0 400.611 4.022 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)c1 ZINC000511379201 919980321 /nfs/dbraw/zinc/98/03/21/919980321.db2.gz PJVUMLMOKSNBRM-ZEQRLZLVSA-N 2 0 416.009 4.343 20 0 HIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)cc1 ZINC000511394037 920003927 /nfs/dbraw/zinc/00/39/27/920003927.db2.gz AOSVCRNGUMVCNC-BJKOFHAPSA-N 2 0 416.009 4.343 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2sc3ccccc3c2Cl)CC1 ZINC000511632669 920295597 /nfs/dbraw/zinc/29/55/97/920295597.db2.gz YGVWJOZQNQSOQG-UHFFFAOYSA-N 2 0 422.038 4.471 20 0 HIADRP C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000511939887 920690575 /nfs/dbraw/zinc/69/05/75/920690575.db2.gz QPLJNUUDHWZQLR-ZDUSSCGKSA-N 2 0 405.892 4.397 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000512099218 920859598 /nfs/dbraw/zinc/85/95/98/920859598.db2.gz KZAZFWUUQUMXLE-UONOGXRCSA-N 2 0 405.892 4.397 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000512132464 920880277 /nfs/dbraw/zinc/88/02/77/920880277.db2.gz SCMKJTCGFBUVGB-VHDGCEQUSA-N 2 0 403.876 4.292 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2cc(Cl)ccc2Cl)cc1 ZINC000513540159 921879168 /nfs/dbraw/zinc/87/91/68/921879168.db2.gz UYNGQNBUPQDALJ-UHFFFAOYSA-N 2 0 406.357 4.109 20 0 HIADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000513545341 921883582 /nfs/dbraw/zinc/88/35/82/921883582.db2.gz PTDLBKYSKGYGJO-YGYUYSJASA-N 2 0 411.977 4.230 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)c(C)c1OC ZINC000514089362 922412945 /nfs/dbraw/zinc/41/29/45/922412945.db2.gz PARYZQDSJKYRER-NSHGMRRFSA-N 2 0 412.574 4.472 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H](c2cccs2)N2CCOCC2)CC1 ZINC000514096232 922422127 /nfs/dbraw/zinc/42/21/27/922422127.db2.gz VQJRTKJAVTYNJI-VNXZQDSDSA-N 2 0 413.631 4.154 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC[C@@H](c1ccc(C)cc1)[NH+](C)C)c1ccsc1 ZINC000514221958 922556293 /nfs/dbraw/zinc/55/62/93/922556293.db2.gz LENXOCBKIQEKQZ-SFTDATJTSA-N 2 0 402.608 4.042 20 0 HIADRP CCC1(CC)[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C[C@H]1OC ZINC000515316303 923046222 /nfs/dbraw/zinc/04/62/22/923046222.db2.gz UVJIPWHYELDQLE-YTFSRNRJSA-N 2 0 400.607 4.099 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(=O)Nc1ccc(F)c(F)c1 ZINC000515518761 923149243 /nfs/dbraw/zinc/14/92/43/923149243.db2.gz NDLLWNWSWNJYNT-IRXDYDNUSA-N 2 0 401.501 4.314 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(=O)N1CCc2sccc2C1 ZINC000515757885 923330980 /nfs/dbraw/zinc/33/09/80/923330980.db2.gz VLLRMSFOGIUKAK-MOPGFXCFSA-N 2 0 411.615 4.043 20 0 HIADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2cccc(S(=O)(=O)NC3CCCCCC3)c2)CC1 ZINC000516524603 923778034 /nfs/dbraw/zinc/77/80/34/923778034.db2.gz FTTDESYQCUNBCL-LJQANCHMSA-N 2 0 421.651 4.070 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)NCC2CC[NH+](Cc3ccccc3Cl)CC2)CC1 ZINC000517357933 924130007 /nfs/dbraw/zinc/13/00/07/924130007.db2.gz SDDCEEXDEJHLEZ-UHFFFAOYSA-N 2 0 421.029 4.116 20 0 HIADRP COc1ccc(C2(C[NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CCOCC2)cc1 ZINC000518007664 926948623 /nfs/dbraw/zinc/94/86/23/926948623.db2.gz MSIVWPSSECTOHE-JTHBVZDNSA-N 2 0 408.586 4.244 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC[C@H](c2cccs2)[NH+](C)C)c2ccccc2)CC1 ZINC000518363458 927221949 /nfs/dbraw/zinc/22/19/49/927221949.db2.gz KNYKLIAPVAUFBV-LEWJYISDSA-N 2 0 414.619 4.123 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)c1 ZINC000518403099 927242951 /nfs/dbraw/zinc/24/29/51/927242951.db2.gz FNJOGLOWUVPKQC-YKSBVNFPSA-N 2 0 408.590 4.163 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)C1 ZINC000518629020 927388943 /nfs/dbraw/zinc/38/89/43/927388943.db2.gz YEQNYRIDASVSNS-URXFXBBRSA-N 2 0 412.622 4.078 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2nc(-c3ccccc3)cs2)[C@@H](c2ccccc2)C1 ZINC000518766355 927483591 /nfs/dbraw/zinc/48/35/91/927483591.db2.gz ZTCOHZPSSHHAOR-HSZRJFAPSA-N 2 0 406.599 4.279 20 0 HIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C(=O)Nc2ccc(OC)cc2)c2ccccc2)CC1 ZINC000520791153 928820611 /nfs/dbraw/zinc/82/06/11/928820611.db2.gz CQONUPQYEBOOQX-XMMPIXPASA-N 2 0 409.574 4.429 20 0 HIADRP CCOc1cc(C[NH2+]CCCC[NH+]2CCC(C)CC2)cc(Br)c1OC ZINC000520948862 928885730 /nfs/dbraw/zinc/88/57/30/928885730.db2.gz ARDKYBIMXJZRTI-UHFFFAOYSA-N 2 0 413.400 4.458 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1 ZINC000521070282 928972185 /nfs/dbraw/zinc/97/21/85/928972185.db2.gz NYMPRFLNBKVMQR-IBGZPJMESA-N 2 0 409.018 4.068 20 0 HIADRP CC1(C)CN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000521489814 929248761 /nfs/dbraw/zinc/24/87/61/929248761.db2.gz YGUXLYFHXSYPKI-UHFFFAOYSA-N 2 0 405.586 4.022 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CC[C@@H]([NH+]2CCCCC2)C1)C1CCCCC1 ZINC000521699205 929373546 /nfs/dbraw/zinc/37/35/46/929373546.db2.gz YVKDVUVMAKMXLF-XMMPIXPASA-N 2 0 412.622 4.221 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NCc1ccccc1C[NH+]1CCCC1 ZINC000524884496 929872125 /nfs/dbraw/zinc/87/21/25/929872125.db2.gz JVOYTZODEABOMY-QFIPXVFZSA-N 2 0 420.601 4.088 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000525383899 930210127 /nfs/dbraw/zinc/21/01/27/930210127.db2.gz FXDJRSQXHIGHSN-RDGATRHJSA-N 2 0 405.586 4.022 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NCc1cccc(C[NH+]2CCCC2)c1 ZINC000525400265 930219439 /nfs/dbraw/zinc/21/94/39/930219439.db2.gz KDDDZRIMKLCDMT-JOCHJYFZSA-N 2 0 420.601 4.088 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+][C@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000525858341 930469396 /nfs/dbraw/zinc/46/93/96/930469396.db2.gz GDRUFPGPMGDUSX-IBGZPJMESA-N 2 0 414.819 4.169 20 0 HIADRP C[C@H]1CCc2ccc(Br)cc2[C@@H]([NH2+]CCCC[NH+]2CCN(C)CC2)C1 ZINC000526041613 930513364 /nfs/dbraw/zinc/51/33/64/930513364.db2.gz BICCIZNOMKEBPP-UWJYYQICSA-N 2 0 408.428 4.080 20 0 HIADRP c1nn(-c2ccccc2)cc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000530664677 930791333 /nfs/dbraw/zinc/79/13/33/930791333.db2.gz YSIRIAYTOLOAEI-UHFFFAOYSA-N 2 0 404.558 4.033 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ccc(Br)s3)CC2)CC1 ZINC000530710742 930804137 /nfs/dbraw/zinc/80/41/37/930804137.db2.gz HGQWCZMRILIJQA-UHFFFAOYSA-N 2 0 414.457 4.139 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)Nc2ccc(OCC[NH+]3CCCC3)c(C)c2)CC1 ZINC000530730644 930810847 /nfs/dbraw/zinc/81/08/47/930810847.db2.gz PMWSDDKEMSKHFB-UHFFFAOYSA-N 2 0 422.573 4.028 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(C(F)(F)F)c1 ZINC000530822106 930832158 /nfs/dbraw/zinc/83/21/58/930832158.db2.gz DIEGYHADDRVLKI-NXEWRWPSSA-N 2 0 411.512 4.220 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)C[C@@H]1C ZINC000531140692 930940118 /nfs/dbraw/zinc/94/01/18/930940118.db2.gz FNHLALPFUPLUHT-PZYJALBSSA-N 2 0 410.602 4.267 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1 ZINC000531142102 930942026 /nfs/dbraw/zinc/94/20/26/930942026.db2.gz NDUNVGGRAONGIQ-UHFFFAOYSA-N 2 0 418.029 4.074 20 0 HIADRP COc1ccc([C@@H](CNC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccccc2)[NH+]2CCCC2)cc1 ZINC000531281677 931000038 /nfs/dbraw/zinc/00/00/38/931000038.db2.gz XZYVKKFYFUIDNW-LOSJGSFVSA-N 2 0 421.585 4.003 20 0 HIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3ccc(OCc4ccncc4)cc3)CC2)C[C@H](C)O1 ZINC000531416851 931048788 /nfs/dbraw/zinc/04/87/88/931048788.db2.gz PPZIESRRYCRUDJ-VXKWHMMOSA-N 2 0 423.601 4.372 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cc(OC)c(OC)cc2C)CC1 ZINC000531438278 931057648 /nfs/dbraw/zinc/05/76/48/931057648.db2.gz AYWBWKOKRIXBFM-GOSISDBHSA-N 2 0 415.553 4.144 20 0 HIADRP CCN(CC)[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccsc1 ZINC000531597385 931116724 /nfs/dbraw/zinc/11/67/24/931116724.db2.gz JLFRKQAGLAXMHR-XMMPIXPASA-N 2 0 414.663 4.451 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccc2c(c1)OCCO2 ZINC000531597451 931116839 /nfs/dbraw/zinc/11/68/39/931116839.db2.gz OXGCEBYRHVSFIV-JOCHJYFZSA-N 2 0 409.574 4.229 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000531691541 931156336 /nfs/dbraw/zinc/15/63/36/931156336.db2.gz DXFMSYZQJSLMIB-DLBZAZTESA-N 2 0 410.400 4.268 20 0 HIADRP C[C@@H](c1ccccc1)N1CC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000531785712 931196603 /nfs/dbraw/zinc/19/66/03/931196603.db2.gz YREUVADLRMJCCK-JYFHCDHNSA-N 2 0 421.629 4.483 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000531936224 931252499 /nfs/dbraw/zinc/25/24/99/931252499.db2.gz YBRZRRDEQUQSKS-IRXDYDNUSA-N 2 0 410.400 4.268 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)C(c1ccccc1)c1ccccc1 ZINC000531941664 931255334 /nfs/dbraw/zinc/25/53/34/931255334.db2.gz VAONQSPAARTDIG-NRFANRHFSA-N 2 0 400.570 4.144 20 0 HIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CC(=O)N(C)Cc2cccc(Cl)c2)c1 ZINC000531958481 931264941 /nfs/dbraw/zinc/26/49/41/931264941.db2.gz FMKAWOGJZUVBBK-GOSISDBHSA-N 2 0 401.982 4.319 20 0 HIADRP CCOc1ccc([C@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1OCC ZINC000531965220 931268579 /nfs/dbraw/zinc/26/85/79/931268579.db2.gz YQAUSEAASKQFDS-NZQKXSOJSA-N 2 0 411.590 4.123 20 0 HIADRP O[C@H]1CCC[C@@H]1[NH+]1CCC([NH2+]Cc2cccc(OCCCc3ccccc3)c2)CC1 ZINC000532016277 931284966 /nfs/dbraw/zinc/28/49/66/931284966.db2.gz YBRMHKQDWYRPAR-UIOOFZCWSA-N 2 0 408.586 4.166 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000532016105 931285437 /nfs/dbraw/zinc/28/54/37/931285437.db2.gz QHFBIUMEIHLIGW-DNQXCXABSA-N 2 0 414.977 4.386 20 0 HIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC1 ZINC000532105561 931313202 /nfs/dbraw/zinc/31/32/02/931313202.db2.gz BYCIVDZFINXWPU-UHFFFAOYSA-N 3 0 400.655 4.065 20 0 HIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1 ZINC000532108339 931315446 /nfs/dbraw/zinc/31/54/46/931315446.db2.gz FAUCGFLGPKJHRD-UHFFFAOYSA-N 3 0 408.634 4.349 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000532193082 931343083 /nfs/dbraw/zinc/34/30/83/931343083.db2.gz OBTUIAMRMMMJMX-CSMYWGQOSA-N 2 0 403.876 4.292 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000532197537 931345385 /nfs/dbraw/zinc/34/53/85/931345385.db2.gz XKRKPTVTEOPRJD-LJQANCHMSA-N 2 0 413.993 4.463 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccc(-n3ccnc3C)cc2)CC1 ZINC000532447215 931438479 /nfs/dbraw/zinc/43/84/79/931438479.db2.gz XOLMLCVXUDWROK-NRFANRHFSA-N 2 0 417.601 4.169 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000532548936 931517910 /nfs/dbraw/zinc/51/79/10/931517910.db2.gz KBSNCSAYIORKHT-SFHVURJKSA-N 2 0 406.014 4.464 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000532550613 931519131 /nfs/dbraw/zinc/51/91/31/931519131.db2.gz UDFNBUSWKNVESQ-OAHLLOKOSA-N 2 0 413.484 4.299 20 0 HIADRP Cc1ccc(COc2ccc(C[NH2+]C3CC[NH+]([C@H]4CCCC[C@@H]4O)CC3)cc2)cc1 ZINC000532628286 931559924 /nfs/dbraw/zinc/55/99/24/931559924.db2.gz FJMJODCVSYMLRQ-UIOOFZCWSA-N 2 0 408.586 4.432 20 0 HIADRP CC[N@@H+](Cc1ccc(OCc2nccn2C)cc1)CC1CCN(c2ccccn2)CC1 ZINC000532983285 931725845 /nfs/dbraw/zinc/72/58/45/931725845.db2.gz UCGHVGQNDODUPP-UHFFFAOYSA-N 2 0 419.573 4.133 20 0 HIADRP CC1CC[NH+](CCCC[NH2+][C@@H]2CCCC[C@@H](N3C(=O)c4ccccc4C3=O)C2)CC1 ZINC000533090491 931768784 /nfs/dbraw/zinc/76/87/84/931768784.db2.gz MHWJOCNDKPDXML-NHCUHLMSSA-N 2 0 411.590 4.086 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@H](c1ccccc1)C(C)(C)CO)C1CC[NH+](C)CC1 ZINC000533329419 931839848 /nfs/dbraw/zinc/83/98/48/931839848.db2.gz GOOINXSPOPPLCE-XMMPIXPASA-N 2 0 409.618 4.109 20 0 HIADRP COc1ccc(C(=O)Nc2cccc(CNC[C@H]3CCC[N@H+](CC(C)C)C3)c2)cc1 ZINC000533444590 931871148 /nfs/dbraw/zinc/87/11/48/931871148.db2.gz DQUHOVDJGWCMNZ-OAQYLSRUSA-N 2 0 409.574 4.405 20 0 HIADRP C[C@H]([NH2+][C@H](c1ccccc1)C1CCC1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000533505607 931887266 /nfs/dbraw/zinc/88/72/66/931887266.db2.gz RAXYRQYRCGTWKN-NBGIEHNGSA-N 2 0 405.586 4.287 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000534443286 932456552 /nfs/dbraw/zinc/45/65/52/932456552.db2.gz AFTPYAJTKFYCKQ-NZQKXSOJSA-N 2 0 414.638 4.269 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000534443290 932456876 /nfs/dbraw/zinc/45/68/76/932456876.db2.gz AFTPYAJTKFYCKQ-REWPJTCUSA-N 2 0 414.638 4.269 20 0 HIADRP C[NH+](C)CC[C@H](NC(=O)N1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1)C(C)(C)C ZINC000534957569 932858572 /nfs/dbraw/zinc/85/85/72/932858572.db2.gz ISMHOLVMYQOJRA-QFIPXVFZSA-N 2 0 414.638 4.051 20 0 HIADRP c1ccc(C[N@H+]2CCC3(C2)CC[NH+](CCc2nc(-c4ccccc4)no2)CC3)cc1 ZINC000534968653 932867295 /nfs/dbraw/zinc/86/72/95/932867295.db2.gz RNTYFZGGZNELKT-UHFFFAOYSA-N 2 0 402.542 4.267 20 0 HIADRP CN1CC[C@@H](NC(=O)NC2CC[NH+](CC3CCCC3)CC2)[C@@H]1c1ccc(Cl)cc1 ZINC000535018418 932885862 /nfs/dbraw/zinc/88/58/62/932885862.db2.gz XXTKOFTYZFREAW-YADHBBJMSA-N 2 0 419.013 4.039 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000535176459 932992667 /nfs/dbraw/zinc/99/26/67/932992667.db2.gz ZTOFOPKIKALBRM-TUACAJSNSA-N 2 0 414.638 4.125 20 0 HIADRP C[N@@H+]1CC[C@@H](CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000535703288 933358170 /nfs/dbraw/zinc/35/81/70/933358170.db2.gz XXUZKSVTBKANEG-HNAYVOBHSA-N 2 0 424.992 4.080 20 0 HIADRP CCO[C@@H]1C[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C12CCCC2 ZINC000537293352 933700686 /nfs/dbraw/zinc/70/06/86/933700686.db2.gz ODIWGRHYDAWTJJ-BJKOFHAPSA-N 2 0 416.606 4.004 20 0 HIADRP CSc1ccccc1NC(=O)[C@@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537847030 938389109 /nfs/dbraw/zinc/38/91/09/938389109.db2.gz QTJCUNGGTNRYSF-GOSISDBHSA-N 2 0 412.603 4.369 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)CC(=O)Nc2cccc(Br)c2)C1 ZINC000537950980 938429769 /nfs/dbraw/zinc/42/97/69/938429769.db2.gz UPTRXWFZKCMVJM-IAGOWNOFSA-N 2 0 410.400 4.124 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 ZINC000537971130 938440699 /nfs/dbraw/zinc/44/06/99/938440699.db2.gz AJDPXBNRRBFOEF-NXLVEIQXSA-N 2 0 422.585 4.314 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1 ZINC000537992170 938454189 /nfs/dbraw/zinc/45/41/89/938454189.db2.gz YUXFITAMYWZLEG-SQJMNOBHSA-N 2 0 405.586 4.313 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)NC[C@@H]2CCC[NH+](CC(C)C)C2)CC1)CC(C)C ZINC000538076518 938496152 /nfs/dbraw/zinc/49/61/52/938496152.db2.gz BJSFKHLUBUPVEL-QHCPKHFHSA-N 2 0 408.675 4.144 20 0 HIADRP Cc1nc(CN2CCC(C[NH2+][C@H](c3ccc4[nH]c(=O)oc4c3)C(C)C)CC2)oc1C ZINC000538098993 938501931 /nfs/dbraw/zinc/50/19/31/938501931.db2.gz OVAFIXWKUMKCEH-QFIPXVFZSA-N 2 0 412.534 4.337 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 ZINC000538102718 938503262 /nfs/dbraw/zinc/50/32/62/938503262.db2.gz OJJHUASAQYQTGM-NRFANRHFSA-N 2 0 419.491 4.238 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)NCc2nc(C)c3ccccc3n2)CC1 ZINC000538210549 938557603 /nfs/dbraw/zinc/55/76/03/938557603.db2.gz KFXQDLPSGLZTAN-KRWDZBQOSA-N 2 0 407.537 4.070 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@H]1CCOC3(CCSCC3)C1)c1ccccc1O2 ZINC000538294623 938585559 /nfs/dbraw/zinc/58/55/59/938585559.db2.gz VSYPKCFRLLWLSI-ICSRJNTNSA-N 2 0 402.604 4.009 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCOc1cccc(C(F)(F)F)n1)c1ccccc1O2 ZINC000538308567 938589263 /nfs/dbraw/zinc/58/92/63/938589263.db2.gz XVITTZGFAYMMKK-QGZVFWFLSA-N 2 0 421.463 4.057 20 0 HIADRP C[NH+](C)C1CCN(c2ccc(N[C@H]3CCc4c3cccc4Br)nc2)CC1 ZINC000538587689 938656058 /nfs/dbraw/zinc/65/60/58/938656058.db2.gz VFYRDGRJCPEEKE-FQEVSTJZSA-N 2 0 415.379 4.474 20 0 HIADRP Cc1nccn1-c1ccc([C@@H](C)Nc2ccc(N3CCC([NH+](C)C)CC3)cn2)cc1 ZINC000538590791 938656806 /nfs/dbraw/zinc/65/68/06/938656806.db2.gz SQKYENAMIOYQME-GOSISDBHSA-N 2 0 404.562 4.279 20 0 HIADRP COc1cc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc(OC)c1OC ZINC000538724579 938692675 /nfs/dbraw/zinc/69/26/75/938692675.db2.gz RCIRIDJWUOKCLM-UHFFFAOYSA-N 2 0 410.558 4.201 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)N3CCC([NH+]4CCCCC4)CC3)c2)CC1 ZINC000538773038 938706634 /nfs/dbraw/zinc/70/66/34/938706634.db2.gz WVOYWBQVGFKYBQ-UHFFFAOYSA-N 2 0 412.622 4.443 20 0 HIADRP CC(C)OCc1ccccc1C[NH2+]Cc1c(Cl)cccc1N1CC[NH+](C)CC1 ZINC000538852098 938725130 /nfs/dbraw/zinc/72/51/30/938725130.db2.gz SEFJYPJYJCBHMD-UHFFFAOYSA-N 2 0 401.982 4.307 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000538886581 938730764 /nfs/dbraw/zinc/73/07/64/938730764.db2.gz XGJPAXOLAIEOCT-XMMPIXPASA-N 2 0 408.590 4.230 20 0 HIADRP CCOc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000538943975 938742846 /nfs/dbraw/zinc/74/28/46/938742846.db2.gz YBSMIGPSPCDWOQ-LJQANCHMSA-N 2 0 410.562 4.046 20 0 HIADRP Cc1cc2ncc([C@H](C)[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)c(C)n2n1 ZINC000538988014 938760896 /nfs/dbraw/zinc/76/08/96/938760896.db2.gz WJMJOWOECNLJLU-FQEVSTJZSA-N 2 0 421.589 4.068 20 0 HIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1 ZINC000539060687 938787582 /nfs/dbraw/zinc/78/75/82/938787582.db2.gz ITUGWTNNMXOOGB-QRNPTOLXSA-N 2 0 400.607 4.320 20 0 HIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000539060684 938787750 /nfs/dbraw/zinc/78/77/50/938787750.db2.gz ITUGWTNNMXOOGB-QPFGARHHSA-N 2 0 400.607 4.320 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc(-c2ccccc2)cc1 ZINC000539073840 938794691 /nfs/dbraw/zinc/79/46/91/938794691.db2.gz RPJSCXFRWUPKBN-FQEVSTJZSA-N 2 0 401.554 4.496 20 0 HIADRP CN(c1ccccc1C[N@H+](CCc1ccccc1)[C@@H]1CCOC1)C1CC[NH+](C)CC1 ZINC000539911449 938977171 /nfs/dbraw/zinc/97/71/71/938977171.db2.gz OLHWVDQNDNQGSO-RUZDIDTESA-N 2 0 407.602 4.051 20 0 HIADRP C[C@@H](C(=O)Nc1ccccc1Cl)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540043572 939047242 /nfs/dbraw/zinc/04/72/42/939047242.db2.gz DBXSVMGTQZRHNU-KRWDZBQOSA-N 2 0 400.954 4.301 20 0 HIADRP Cc1ccccc1[C@H](C)NC(=O)[C@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540043724 939047308 /nfs/dbraw/zinc/04/73/08/939047308.db2.gz HBKBZSAEKJVZRL-SFTDATJTSA-N 2 0 408.590 4.194 20 0 HIADRP COc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1Br ZINC000540137651 939087205 /nfs/dbraw/zinc/08/72/05/939087205.db2.gz KIKDSDJXWBFFDH-HNNXBMFYSA-N 2 0 404.352 4.420 20 0 HIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C3CCN(C(=O)CCc4ccccc4)CC3)CC2)C1 ZINC000540192308 939117685 /nfs/dbraw/zinc/11/76/85/939117685.db2.gz DHKVIPDLNBRQMU-BWKNWUBXSA-N 2 0 411.634 4.243 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1nc2ccc(Cl)cc2n1C ZINC000540302957 939187841 /nfs/dbraw/zinc/18/78/41/939187841.db2.gz VGAKORWGMUKIRJ-MRXNPFEDSA-N 2 0 400.954 4.408 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@H]1CCCN(Cc3ccccc3)C1)c1ccccc1O2 ZINC000540461015 939261193 /nfs/dbraw/zinc/26/11/93/939261193.db2.gz IRDYJCJBYUSGPZ-LADGPHEKSA-N 2 0 405.586 4.229 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@@H]1CCN(c3ccc(F)cc3)C1)c1ccccc1O2 ZINC000540475387 939267576 /nfs/dbraw/zinc/26/75/76/939267576.db2.gz UIMFEMQPMSERPN-CVDCTZTESA-N 2 0 409.549 4.230 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@H](c1ccccc1)C(C)(C)CO)c1ccccc1O2 ZINC000540494302 939274918 /nfs/dbraw/zinc/27/49/18/939274918.db2.gz VMTIPZJWTDICBZ-PKTZIBPZSA-N 2 0 408.586 4.367 20 0 HIADRP Cc1cc([C@@H]([NH2+][C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C2CC2)ccc1F ZINC000540523147 939286634 /nfs/dbraw/zinc/28/66/34/939286634.db2.gz LEFAVKPOYCYDBU-DFBJGRDBSA-N 2 0 423.576 4.344 20 0 HIADRP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc2cc(Br)ccc2o1 ZINC000540605322 939317451 /nfs/dbraw/zinc/31/74/51/939317451.db2.gz HWWOYCIJTZVUGZ-CQSZACIVSA-N 2 0 418.335 4.382 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)CC3 ZINC000540988042 939425799 /nfs/dbraw/zinc/42/57/99/939425799.db2.gz FPXXQTRCLQSPLT-FGZHOGPDSA-N 2 0 403.570 4.080 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(OCC(F)(F)F)cc1 ZINC000540991125 939426827 /nfs/dbraw/zinc/42/68/27/939426827.db2.gz XZXOIPRFNBAXHR-DYESRHJHSA-N 2 0 422.491 4.435 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3c(Br)cccc32)C1 ZINC000541247000 939487475 /nfs/dbraw/zinc/48/74/75/939487475.db2.gz OOQFBLPRDDFEIW-XMSQKQJNSA-N 2 0 415.375 4.183 20 0 HIADRP O=C1CC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c2ccccc2N1 ZINC000541541517 939547786 /nfs/dbraw/zinc/54/77/86/939547786.db2.gz FFVBWNFWPARRDA-HSZRJFAPSA-N 2 0 407.558 4.121 20 0 HIADRP CCC[NH+]1CCN(C(=O)Nc2ccc(C[N@H+](C[C@H]3CCCCO3)C(C)C)cc2)CC1 ZINC000541962029 939663323 /nfs/dbraw/zinc/66/33/23/939663323.db2.gz IIVDTLFDTUNYAJ-HSZRJFAPSA-N 2 0 416.610 4.026 20 0 HIADRP COc1cc(Br)ccc1CCC[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000542301674 939791525 /nfs/dbraw/zinc/79/15/25/939791525.db2.gz DOEAMGBLIPSOHC-UHFFFAOYSA-N 2 0 415.335 4.069 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000542306992 939792969 /nfs/dbraw/zinc/79/29/69/939792969.db2.gz LQAOGQMVRWHJIV-VGSWGCGISA-N 2 0 413.928 4.151 20 0 HIADRP CCOc1ccccc1Oc1ccc(C[NH2+]Cc2cn(-c3cc[nH+]cc3)nc2C)cn1 ZINC000542318330 939798662 /nfs/dbraw/zinc/79/86/62/939798662.db2.gz QWXPBFPHGTVFGW-UHFFFAOYSA-N 2 0 415.497 4.452 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000542477663 939829751 /nfs/dbraw/zinc/82/97/51/939829751.db2.gz ONHWXRARZDNNKO-WOJBJXKFSA-N 2 0 410.558 4.321 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCOc2cc(Cl)ccc21 ZINC000542845666 939862446 /nfs/dbraw/zinc/86/24/46/939862446.db2.gz GUTRSEKEKNIVKZ-IRLDBZIGSA-N 2 0 400.950 4.300 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1 ZINC000542852322 939863168 /nfs/dbraw/zinc/86/31/68/939863168.db2.gz YRBNACNTIMDHQF-YADARESESA-N 2 0 424.589 4.024 20 0 HIADRP CCc1ccc([C@H](CN2CCOCC2)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000543407420 940055382 /nfs/dbraw/zinc/05/53/82/940055382.db2.gz UCNVZMVCKYUHAN-SANMLTNESA-N 2 0 407.602 4.008 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCOc3cc4c(cc32)CCCC4)C1 ZINC000543777607 940184311 /nfs/dbraw/zinc/18/43/11/940184311.db2.gz URGBUPAZUIIOAD-NOZRDPDXSA-N 2 0 406.570 4.136 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CCC[C@H]2C[NH+]2CCCCC2)c1 ZINC000544236578 940364210 /nfs/dbraw/zinc/36/42/10/940364210.db2.gz VPWQPOPFDAUXKU-VWLOTQADSA-N 2 0 405.586 4.409 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000544357686 940399770 /nfs/dbraw/zinc/39/97/70/940399770.db2.gz WUSHMHCNFZEEFF-ZCYQVOJMSA-N 2 0 407.533 4.290 20 0 HIADRP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000544621672 940492462 /nfs/dbraw/zinc/49/24/62/940492462.db2.gz FTZBMZQFVORECR-FQEVSTJZSA-N 2 0 422.617 4.287 20 0 HIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+][C@@H]2CCO[C@H](c3ccc(F)cc3)C2)CC1 ZINC000544623475 940492823 /nfs/dbraw/zinc/49/28/23/940492823.db2.gz CPRAANKIKLIPGZ-XXBNENTESA-N 2 0 417.956 4.241 20 0 HIADRP CC(C)C[C@H](CNC(=O)N(C)[C@@H](C)C1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000544650518 940498696 /nfs/dbraw/zinc/49/86/96/940498696.db2.gz PBVICVUCJGAXKF-ZRCGQRJVSA-N 2 0 402.627 4.124 20 0 HIADRP C[NH+](C)Cc1cc(-c2noc(-c3ccc(C[NH+]4CCSCC4)cc3)n2)ccc1F ZINC000545749887 940583700 /nfs/dbraw/zinc/58/37/00/940583700.db2.gz AOGOHMPSWHBKKB-UHFFFAOYSA-N 2 0 412.534 4.153 20 0 HIADRP CN1CC[NH+](CCCC[NH2+]Cc2ccccc2Oc2ccc(F)cc2Cl)CC1 ZINC000545894539 940654246 /nfs/dbraw/zinc/65/42/46/940654246.db2.gz PLSZUEKGFCJBDE-UHFFFAOYSA-N 2 0 405.945 4.389 20 0 HIADRP COc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)CC3 ZINC000546606676 940860733 /nfs/dbraw/zinc/86/07/33/940860733.db2.gz JOQGVMWSQPXTFZ-LEWJYISDSA-N 2 0 403.570 4.188 20 0 HIADRP C[C@H]([NH2+]C[C@H](CO)Cc1c(F)cccc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548155675 941089457 /nfs/dbraw/zinc/08/94/57/941089457.db2.gz UGPTVXTVQGYDSK-DFQSSKMNSA-N 2 0 404.957 4.130 20 0 HIADRP Cc1nc(-c2ccc([C@@H](C)[NH2+]CC(=O)NC[C@H](c3ccccc3)[NH+](C)C)cc2)cs1 ZINC000548442493 941104524 /nfs/dbraw/zinc/10/45/24/941104524.db2.gz DZERXWBDOTURAT-UZUQRXQVSA-N 2 0 422.598 4.188 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483447 941107796 /nfs/dbraw/zinc/10/77/96/941107796.db2.gz MEIFUGFPOAAPHP-HYBUGGRVSA-N 2 0 414.553 4.334 20 0 HIADRP O=C(c1ccccc1)N1CC[C@H](C[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)C1 ZINC000548919266 941128956 /nfs/dbraw/zinc/12/89/56/941128956.db2.gz OQDXBKYHWLTXCX-SQHAQQRYSA-N 2 0 417.597 4.137 20 0 HIADRP C[NH+](C)CCCC1CCN(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000549203950 941170783 /nfs/dbraw/zinc/17/07/83/941170783.db2.gz DNRNRXBKWQDSGU-HSZRJFAPSA-N 2 0 414.638 4.051 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000549204783 941170823 /nfs/dbraw/zinc/17/08/23/941170823.db2.gz NDOPQYLPLHSCKU-HSZRJFAPSA-N 2 0 414.638 4.051 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)CC2(C)C)CC1 ZINC000549588631 941200555 /nfs/dbraw/zinc/20/05/55/941200555.db2.gz HFADMIBIVNNEQR-QHCPKHFHSA-N 2 0 414.638 4.049 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccc(OC(F)F)c(F)c1)C1CC[NH+](C)CC1 ZINC000549888771 941228964 /nfs/dbraw/zinc/22/89/64/941228964.db2.gz CMYULZGLUWXXAN-UHFFFAOYSA-N 2 0 407.480 4.247 20 0 HIADRP CC(C)[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccc(F)cn1 ZINC000550883330 941378670 /nfs/dbraw/zinc/37/86/70/941378670.db2.gz YPOXYHYYOKBCLO-XUZZJYLKSA-N 2 0 411.565 4.436 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1OCC(C)C ZINC000551219400 941430060 /nfs/dbraw/zinc/43/00/60/941430060.db2.gz MSQZRLYIQZNQGC-UHFFFAOYSA-N 2 0 412.574 4.493 20 0 HIADRP Cc1ccnc(-c2n[nH]c([C@@H](C)[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)n2)c1 ZINC000551277247 941442066 /nfs/dbraw/zinc/44/20/66/941442066.db2.gz BUAIJXXJLIVEHU-KMFTYDHNSA-N 2 0 404.562 4.269 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1OC(F)F ZINC000551615686 941512605 /nfs/dbraw/zinc/51/26/05/941512605.db2.gz RVIFUKLXGSOVDE-UHFFFAOYSA-N 2 0 406.473 4.059 20 0 HIADRP O[C@@H](C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)COc1ccc2ccccc2c1 ZINC000552190263 941599089 /nfs/dbraw/zinc/59/90/89/941599089.db2.gz FSALOEQQCPVYHY-VWLOTQADSA-N 2 0 404.554 4.355 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1nc(-c2cccc(Cl)c2)no1 ZINC000552571908 941710553 /nfs/dbraw/zinc/71/05/53/941710553.db2.gz VOGPWOHTNBAAIQ-LAUBAEHRSA-N 2 0 410.949 4.433 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1)C1CC1 ZINC000553173538 941844851 /nfs/dbraw/zinc/84/48/51/941844851.db2.gz OUHXIJBMAFUPEA-MHZLTWQESA-N 2 0 417.597 4.409 20 0 HIADRP COc1ccc(C[N@@H+]2CCCN(C(=O)c3ccc(C[NH+]4CCCCC4)cc3)CC2)cc1 ZINC000553970593 942010422 /nfs/dbraw/zinc/01/04/22/942010422.db2.gz ZAUXTWJTONLZTJ-UHFFFAOYSA-N 2 0 421.585 4.029 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(NC2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)c1 ZINC000554392361 942124430 /nfs/dbraw/zinc/12/44/30/942124430.db2.gz MUAWPPYFXQOQPV-WMZHIEFXSA-N 2 0 400.611 4.422 20 0 HIADRP Cc1ccccc1-n1cc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)nn1 ZINC000554855902 942291654 /nfs/dbraw/zinc/29/16/54/942291654.db2.gz FPQORAJLTUYZIQ-UHFFFAOYSA-N 2 0 401.558 4.064 20 0 HIADRP Cc1cc2ncn(C[C@H](O)C[NH2+]Cc3ccc(C[N@H+]4CCCC[C@H]4C)cc3)c2cc1C ZINC000554863412 942297203 /nfs/dbraw/zinc/29/72/03/942297203.db2.gz RQDHSDNBVGDFDD-ZJSXRUAMSA-N 2 0 420.601 4.178 20 0 HIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(OC(F)F)c(Br)c3)C2)CC1 ZINC000554881004 942306305 /nfs/dbraw/zinc/30/63/05/942306305.db2.gz UCHZWZHLTHLQCS-OAHLLOKOSA-N 2 0 403.311 4.214 20 0 HIADRP c1c(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)[nH]nc1-c1ccccc1 ZINC000555611779 942670184 /nfs/dbraw/zinc/67/01/84/942670184.db2.gz BZDJTSWXPKKADF-QHCPKHFHSA-N 2 0 416.569 4.095 20 0 HIADRP Fc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c2ncccc12 ZINC000555617816 942671839 /nfs/dbraw/zinc/67/18/39/942671839.db2.gz WJFHKAUCNAEVDP-QFIPXVFZSA-N 2 0 419.544 4.392 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000556412208 942859484 /nfs/dbraw/zinc/85/94/84/942859484.db2.gz MZXULOWUILHQEM-FQEVSTJZSA-N 2 0 413.974 4.320 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2cnc(OC)c(Cl)c2)CC1 ZINC000556582632 942905842 /nfs/dbraw/zinc/90/58/42/942905842.db2.gz CDAVZKPUMBMOSM-CVEARBPZSA-N 2 0 420.960 4.436 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H]3CCC[C@H]3c3cccc(C(F)(F)F)c3)ccn2)CC1 ZINC000556587139 942907051 /nfs/dbraw/zinc/90/70/51/942907051.db2.gz OKXXYLYXAJFJDH-LEWJYISDSA-N 2 0 418.507 4.278 20 0 HIADRP C[N@H+](CCCN1CC[NH+](C)CC1)Cc1ccc(OCc2c(F)cccc2Cl)cc1 ZINC000558422352 943555863 /nfs/dbraw/zinc/55/58/63/943555863.db2.gz PRZOWLHOPBTTCK-UHFFFAOYSA-N 2 0 419.972 4.127 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000558781508 943661440 /nfs/dbraw/zinc/66/14/40/943661440.db2.gz UJEHADZZYLHGQG-WMZHIEFXSA-N 2 0 403.574 4.274 20 0 HIADRP Cc1ccc2c(C[NH+]3CCC4(C[C@H]4N(C)Cc4nccs4)CC3)ccc(O)c2n1 ZINC000558897325 943732713 /nfs/dbraw/zinc/73/27/13/943732713.db2.gz QOAULQXCYSUUBS-HXUWFJFHSA-N 2 0 408.571 4.192 20 0 HIADRP CCN(CC)C(=O)C[C@@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000558967343 943774046 /nfs/dbraw/zinc/77/40/46/943774046.db2.gz JABPOKFHEWITNM-QUIDZOEXSA-N 2 0 406.014 4.491 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H]2CCCCc3cc(Br)ccc32)ccn1 ZINC000558973005 943778159 /nfs/dbraw/zinc/77/81/59/943778159.db2.gz WDWPQTMOBFKEQV-HXUWFJFHSA-N 2 0 418.379 4.342 20 0 HIADRP Fc1cc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)ccc1Cl ZINC000559332130 943897742 /nfs/dbraw/zinc/89/77/42/943897742.db2.gz XVFKXTQSIPATSO-HXUWFJFHSA-N 2 0 402.941 4.498 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCc3sc(Br)cc32)(N2CCCCC2)CC1 ZINC000559767215 944047070 /nfs/dbraw/zinc/04/70/70/944047070.db2.gz RLDVBLJYEWTCHA-MRXNPFEDSA-N 2 0 412.441 4.038 20 0 HIADRP COc1cccc2c1CC[C@H]([NH2+]C[C@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)C2 ZINC000559891077 944076775 /nfs/dbraw/zinc/07/67/75/944076775.db2.gz NAZJQDMPOQBEMH-ZEQRLZLVSA-N 2 0 420.597 4.071 20 0 HIADRP C[NH+](C)C1CCN(c2ccc(NC3CCC([N@H+](C)Cc4ccccc4)CC3)nc2)CC1 ZINC000559922176 944085850 /nfs/dbraw/zinc/08/58/50/944085850.db2.gz PSOLYKKDZFVYHW-UHFFFAOYSA-N 2 0 421.633 4.467 20 0 HIADRP COCC[C@H](Cc1cccc(F)c1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000560268348 944213195 /nfs/dbraw/zinc/21/31/95/944213195.db2.gz LKOVKFWLNNKGRK-JOCHJYFZSA-N 2 0 400.538 4.036 20 0 HIADRP C[C@H](Cc1ccc(F)cc1Br)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000564123486 945388570 /nfs/dbraw/zinc/38/85/70/945388570.db2.gz ORZIOQNKIIXTJY-OAHLLOKOSA-N 2 0 406.343 4.420 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(Br)cc1 ZINC000564149493 945401781 /nfs/dbraw/zinc/40/17/81/945401781.db2.gz WEWIECWPCMOGCB-LJQANCHMSA-N 2 0 406.368 4.416 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]C[C@H]4CC[C@@H](c5nc(C6CC6)no5)O4)[C@@H]3C2)cc1 ZINC000565673197 945864024 /nfs/dbraw/zinc/86/40/24/945864024.db2.gz CDRSJZOOMPGPTH-BUPNWXMQSA-N 2 0 422.573 4.057 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000568017956 946444438 /nfs/dbraw/zinc/44/44/38/946444438.db2.gz YHPZPIFDFPEYNH-IRLDBZIGSA-N 2 0 408.590 4.289 20 0 HIADRP CCCOc1ccc(Br)cc1C[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000570012688 947073338 /nfs/dbraw/zinc/07/33/38/947073338.db2.gz SZBAANJMZXLOGQ-UHFFFAOYSA-N 2 0 401.414 4.155 20 0 HIADRP COc1ncc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)cc1Cl ZINC000570913673 947392456 /nfs/dbraw/zinc/39/24/56/947392456.db2.gz OATQVNLAJMQYKV-ZACQAIPSSA-N 2 0 403.954 4.204 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(Br)cn1 ZINC000572503063 947918108 /nfs/dbraw/zinc/91/81/08/947918108.db2.gz ZWTDKLLCIZNMIJ-HNNXBMFYSA-N 2 0 404.352 4.168 20 0 HIADRP C[NH+](C)C[C@H](NC(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccc(Cl)cc1 ZINC000572902960 948034977 /nfs/dbraw/zinc/03/49/77/948034977.db2.gz YUNZJTPBELPMRB-NRFANRHFSA-N 2 0 407.002 4.039 20 0 HIADRP C[NH+](C)CCCCC(=O)N(CC[NH+]1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000573467248 948208358 /nfs/dbraw/zinc/20/83/58/948208358.db2.gz SDCDTGYWBKYPKS-UHFFFAOYSA-N 2 0 400.394 4.150 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+](C[C@H]2CN(Cc3ccccc3)CCCO2)CC1 ZINC000574553053 948470207 /nfs/dbraw/zinc/47/02/07/948470207.db2.gz YMMBLWDNPPVBSL-VWLOTQADSA-N 2 0 401.639 4.112 20 0 HIADRP COC[C@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1[nH+]c(N3CCCC3)cc3ccccc31)C2 ZINC001164815051 720175306 /nfs/dbraw/zinc/17/53/06/720175306.db2.gz HJEJBFIEQFGVPT-GJZUVCINSA-N 2 0 420.601 4.020 20 0 HIADRP c1cn(Cc2ccccc2)c2cc[nH+]c(N3CC[C@@H]4[C@H]3CC[N@@H+]4Cc3cccnc3)c12 ZINC001164724723 720398222 /nfs/dbraw/zinc/39/82/22/720398222.db2.gz LFWAEJCPLJUOBT-JWQCQUIFSA-N 2 0 409.537 4.333 20 0 HIADRP CC[N@@H+]1CCCC[C@@H]1c1ccc(-n2nc(-c3ccc(F)cc3)c3c2CC[NH2+]CC3)nc1 ZINC001164797327 721597300 /nfs/dbraw/zinc/59/73/00/721597300.db2.gz GGOSHOAZTRZVFY-JOCHJYFZSA-N 2 0 419.548 4.309 20 0 HIADRP CC(C)Oc1cc[nH+]c(N2CCC(F)(F)[C@]3(CC[N@H+](Cc4ccccn4)C3)C2)c1 ZINC001164908940 721710260 /nfs/dbraw/zinc/71/02/60/721710260.db2.gz ZTDPIKKESTYJHI-NRFANRHFSA-N 2 0 402.489 4.002 20 0 HIADRP c1ccc(C[N@@H+]2CCc3nc(N4CCCC[C@H]4CC[NH+]4CCCC4)ccc3C2)cc1 ZINC001165049011 721968360 /nfs/dbraw/zinc/96/83/60/721968360.db2.gz QTMCHDMTZADGHG-DEOSSOPVSA-N 2 0 404.602 4.485 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3CC[C@@H](OCC4CC4)[C@H]3Cc3ccccc3)c2)CC1 ZINC001165006230 722271884 /nfs/dbraw/zinc/27/18/84/722271884.db2.gz MFZATZKQXZVMNO-JWQCQUIFSA-N 2 0 421.585 4.171 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000042127400 848290125 /nfs/dbraw/zinc/29/01/25/848290125.db2.gz HITNBIBAMXGJMM-UHFFFAOYSA-N 2 0 405.586 4.375 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000047777565 849109491 /nfs/dbraw/zinc/10/94/91/849109491.db2.gz PMKQBBFCPCYNNA-RTBURBONSA-N 2 0 416.591 4.004 20 0 HIADRP CC(C)[NH+](C)Cc1ccccc1CNC(=O)NCc1ccccc1C[N@@H+](C)C(C)C ZINC000048828746 849272794 /nfs/dbraw/zinc/27/27/94/849272794.db2.gz CMIGPDHOWMGKDO-UHFFFAOYSA-N 2 0 410.606 4.366 20 0 HIADRP Cc1c(O)ccc2c(C[NH2+]Cc3ccccc3C[N@H+]3CCC[C@H](C)C3)cc(=O)oc12 ZINC000056156174 850261245 /nfs/dbraw/zinc/26/12/45/850261245.db2.gz DSZBGOCTIGOPLW-KRWDZBQOSA-N 2 0 406.526 4.329 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)NC2CC[NH+](Cc3ccccc3C)CC2)cc1 ZINC000058400413 850816324 /nfs/dbraw/zinc/81/63/24/850816324.db2.gz FGYLSYOOXKKDDV-UHFFFAOYSA-N 2 0 423.601 4.110 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CCC[NH+](C(C)(C)C)CC1)C1CCCCC1 ZINC000060558263 851146602 /nfs/dbraw/zinc/14/66/02/851146602.db2.gz YBHLQXLOJNYTPI-UHFFFAOYSA-N 2 0 414.638 4.467 20 0 HIADRP CCc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCCC[NH+]2CCOCC2)cc1 ZINC000060979315 851265577 /nfs/dbraw/zinc/26/55/77/851265577.db2.gz OQEVMHQXCSIRNR-UHFFFAOYSA-N 2 0 418.585 4.304 20 0 HIADRP Brc1ccc(-c2ccc(C[NH2+]CCCC[NH+]3CCOCC3)s2)cc1 ZINC000060979260 851265691 /nfs/dbraw/zinc/26/56/91/851265691.db2.gz PKJIXANTHXZFAH-UHFFFAOYSA-N 2 0 409.393 4.380 20 0 HIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[NH2+]CCCC[NH+]2CCOCC2)c1 ZINC000060979270 851265731 /nfs/dbraw/zinc/26/57/31/851265731.db2.gz PRYQMZKNVBDWLP-UHFFFAOYSA-N 2 0 418.585 4.109 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)C1 ZINC000061868845 851464263 /nfs/dbraw/zinc/46/42/63/851464263.db2.gz QXNQEGFIZCHAQQ-GCJKJVERSA-N 2 0 414.619 4.082 20 0 HIADRP C[NH+]1CCC(NC(=S)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000063147131 851621251 /nfs/dbraw/zinc/62/12/51/851621251.db2.gz MZZDNGORRWAVDE-UHFFFAOYSA-N 2 0 422.642 4.008 20 0 HIADRP Ic1ccccc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000063551755 851712928 /nfs/dbraw/zinc/71/29/28/851712928.db2.gz CDGALPVJDDOTBA-UHFFFAOYSA-N 2 0 420.338 4.293 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)[NH+]2CCCC2)cc1 ZINC000064237633 851855223 /nfs/dbraw/zinc/85/52/23/851855223.db2.gz SYECGFZAOUDREF-GOTSBHOMSA-N 2 0 424.589 4.251 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)CC1 ZINC000065869125 852292868 /nfs/dbraw/zinc/29/28/68/852292868.db2.gz QVJAQDKQJRCZNP-HSZRJFAPSA-N 2 0 423.576 4.127 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+](C2CC2)[C@H]2CCc3ccccc32)CC1 ZINC000065951525 852332947 /nfs/dbraw/zinc/33/29/47/852332947.db2.gz VJGNJEMFQGMKMA-SANMLTNESA-N 2 0 417.597 4.228 20 0 HIADRP C[C@@H](C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000071997650 852456687 /nfs/dbraw/zinc/45/66/87/852456687.db2.gz DTKADZOJEFFOOF-ZDUSSCGKSA-N 2 0 405.892 4.350 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000109339708 852955449 /nfs/dbraw/zinc/95/54/49/852955449.db2.gz ZKYKBUWJUPIWDI-QHCPKHFHSA-N 2 0 411.565 4.196 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CC2CCN(C(=O)OC(C)(C)C)CC2)CC1 ZINC000116792578 853333599 /nfs/dbraw/zinc/33/35/99/853333599.db2.gz WZUCHWBEXMHFBX-UHFFFAOYSA-N 2 0 415.622 4.478 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCC2)c1)N1CCC[N@H+](CC2CCCCC2)CC1 ZINC000195548887 853679529 /nfs/dbraw/zinc/67/95/29/853679529.db2.gz NOMMGJPSOZSACW-UHFFFAOYSA-N 2 0 412.622 4.080 20 0 HIADRP Brc1ccccc1N1CC[C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000236581599 853899687 /nfs/dbraw/zinc/89/96/87/853899687.db2.gz MLVLNRGFGBKDPK-SFHVURJKSA-N 2 0 406.412 4.415 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cnc3c(cnn3C(C)C)c2)CC1 ZINC000236851728 853929071 /nfs/dbraw/zinc/92/90/71/853929071.db2.gz MTYWJFNIIQZSNP-GOSISDBHSA-N 2 0 424.568 4.144 20 0 HIADRP CCOc1cc(C[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)ccc1OC ZINC000236880967 853931905 /nfs/dbraw/zinc/93/19/05/853931905.db2.gz AMKARLBAPPZCEF-SFHVURJKSA-N 2 0 415.553 4.226 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2ccc(CSC(F)F)o2)CC1 ZINC000236957368 853942697 /nfs/dbraw/zinc/94/26/97/853942697.db2.gz UKBBYVAURSRRHJ-UHFFFAOYSA-N 2 0 409.546 4.163 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(OC(F)F)cc2)CC1 ZINC000236981661 853946451 /nfs/dbraw/zinc/94/64/51/853946451.db2.gz QMKJNQFSZYALIP-MRXNPFEDSA-N 2 0 407.480 4.420 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(OC(F)F)cc2)CC1 ZINC000236984920 853947587 /nfs/dbraw/zinc/94/75/87/853947587.db2.gz QMKJNQFSZYALIP-INIZCTEOSA-N 2 0 407.480 4.420 20 0 HIADRP Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1C[NH2+]CC1CC[NH+](C)CC1 ZINC000237161105 853974494 /nfs/dbraw/zinc/97/44/94/853974494.db2.gz STLUKAZEZRKCFT-UHFFFAOYSA-N 2 0 400.876 4.284 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)o2)cc1 ZINC000237177357 853976292 /nfs/dbraw/zinc/97/62/92/853976292.db2.gz YOLIJXQZUYEUNA-UHFFFAOYSA-N 2 0 411.933 4.181 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2ccc(Cl)c(F)c2)c1)C1CCOCC1 ZINC000237203175 853981300 /nfs/dbraw/zinc/98/13/00/853981300.db2.gz LUCMIMMILUFITL-UHFFFAOYSA-N 2 0 406.929 4.259 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2ccc(C(F)(F)F)cc2)c1)C1CCOCC1 ZINC000237203027 853981335 /nfs/dbraw/zinc/98/13/35/853981335.db2.gz TYBZMPUCRINYDG-UHFFFAOYSA-N 2 0 422.491 4.485 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)ccc1OC(C)C ZINC000237215524 853984814 /nfs/dbraw/zinc/98/48/14/853984814.db2.gz ZKWOQCNSRJIMIY-WOJBJXKFSA-N 2 0 412.574 4.381 20 0 HIADRP COc1cccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)c1OC(F)F ZINC000237388392 854020322 /nfs/dbraw/zinc/02/03/22/854020322.db2.gz QDQZEQSWMCUKPM-IRXDYDNUSA-N 2 0 420.500 4.196 20 0 HIADRP COc1cccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)c1OC(C)C ZINC000237388213 854020627 /nfs/dbraw/zinc/02/06/27/854020627.db2.gz UYBKALQPVJQDOL-WOJBJXKFSA-N 2 0 412.574 4.381 20 0 HIADRP C[C@H](C[NH2+]Cc1ccc(-c2ccccc2Br)s1)CN1CC[NH+](C)CC1 ZINC000237580629 854058142 /nfs/dbraw/zinc/05/81/42/854058142.db2.gz FPTBQXTXEIAVBS-MRXNPFEDSA-N 2 0 422.436 4.151 20 0 HIADRP Cc1ncccc1C[NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000237594558 854059599 /nfs/dbraw/zinc/05/95/99/854059599.db2.gz YAPQDQKKRGWJEX-UHFFFAOYSA-N 2 0 406.496 4.101 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2cc(Cl)ccc2OCc2cccnc2)C[C@H](C)O1 ZINC000237608330 854061353 /nfs/dbraw/zinc/06/13/53/854061353.db2.gz PYXPRRAZTSFRTN-KDURUIRLSA-N 2 0 417.981 4.293 20 0 HIADRP O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000237723871 854083684 /nfs/dbraw/zinc/08/36/84/854083684.db2.gz PYZXBGOFXDCSEB-UHFFFAOYSA-N 2 0 417.937 4.409 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2ccc(-c3ccccc3)cc2)cc1 ZINC000238076195 854140951 /nfs/dbraw/zinc/14/09/51/854140951.db2.gz FZHJYVDPWADVIS-UHFFFAOYSA-N 2 0 413.565 4.469 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)cc1 ZINC000303080269 854751173 /nfs/dbraw/zinc/75/11/73/854751173.db2.gz UPGXLUGIEAFEGV-HSZRJFAPSA-N 2 0 411.565 4.196 20 0 HIADRP O=C(C[NH+]1CCC(C[NH+]2CCCC2)CC1)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000303222077 854823481 /nfs/dbraw/zinc/82/34/81/854823481.db2.gz VMXKEOMQKHEFAH-UHFFFAOYSA-N 2 0 423.523 4.004 20 0 HIADRP O=C(NCCCCC[NH+]1CCCCC1)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000303474442 854970769 /nfs/dbraw/zinc/97/07/69/854970769.db2.gz OMCJUMFQXCKTCX-UHFFFAOYSA-N 2 0 421.029 4.260 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1Cc1ccccc1 ZINC000303725054 855152530 /nfs/dbraw/zinc/15/25/30/855152530.db2.gz BUVBWRNANKAKGO-PXDATVDWSA-N 2 0 405.586 4.408 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309906950 855365435 /nfs/dbraw/zinc/36/54/35/855365435.db2.gz KRSAUYKAOCEPRC-VXSCBNMQSA-N 2 0 401.595 4.323 20 0 HIADRP COc1cc(C[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)cc(Br)c1O ZINC000388523464 855446456 /nfs/dbraw/zinc/44/64/56/855446456.db2.gz MQCKIUJEFDJREW-OAQYLSRUSA-N 2 0 419.363 4.165 20 0 HIADRP OC1(C[NH2+]Cc2cc(Br)ccc2Cl)CC[NH+](Cc2ccccc2)CC1 ZINC000397503914 855472799 /nfs/dbraw/zinc/47/27/99/855472799.db2.gz BMJCDQLBTCLIGU-UHFFFAOYSA-N 2 0 423.782 4.219 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc(I)c1 ZINC000398013741 855473996 /nfs/dbraw/zinc/47/39/96/855473996.db2.gz FBZSDXYUCAAEJF-UZLBHIALSA-N 2 0 420.338 4.291 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCN(C(=O)OC(C)(C)C)CC1 ZINC000398047817 855474855 /nfs/dbraw/zinc/47/48/55/855474855.db2.gz WLNSKVCSXKPDTR-KNQAVFIVSA-N 2 0 401.595 4.134 20 0 HIADRP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CN1C(=O)OC(C)(C)C ZINC000399026197 855477560 /nfs/dbraw/zinc/47/75/60/855477560.db2.gz JIPKRDBNTGUUMI-CEMLEFRQSA-N 2 0 401.595 4.276 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)CC1 ZINC000410336067 855935308 /nfs/dbraw/zinc/93/53/08/855935308.db2.gz CDZXNUVRTINJHW-NRFANRHFSA-N 2 0 414.638 4.324 20 0 HIADRP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)NCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000410346190 855940680 /nfs/dbraw/zinc/94/06/80/855940680.db2.gz UODFTPZHHYZHNV-NHCUHLMSSA-N 2 0 400.611 4.125 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)Nc1cccc(OCC[NH+](C)C)c1 ZINC000410354306 855945844 /nfs/dbraw/zinc/94/58/44/855945844.db2.gz PDRNLWVGZGFVSK-FQEVSTJZSA-N 2 0 424.589 4.323 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1 ZINC000410357485 855948019 /nfs/dbraw/zinc/94/80/19/855948019.db2.gz APENUMCKLXGFKB-DEOSSOPVSA-N 2 0 408.590 4.163 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC[C@H](c3ccsc3)[NH+](C)C)cc2)C1 ZINC000410370095 855956337 /nfs/dbraw/zinc/95/63/37/855956337.db2.gz XFSICNWKCDANDI-PGRDOPGGSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)NCc2ccccc2C[NH+]2CCCC[C@@H]2C)C1 ZINC000410372531 855958078 /nfs/dbraw/zinc/95/80/78/855958078.db2.gz OHGYXUOZQQSRGU-VXKWHMMOSA-N 2 0 414.638 4.372 20 0 HIADRP COc1cccc2c1CC[C@@H]([NH2+]CCCOC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC000426022815 856053288 /nfs/dbraw/zinc/05/32/88/856053288.db2.gz PAYKQEVYJGWHHR-HSZRJFAPSA-N 2 0 408.586 4.213 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000426049747 856072893 /nfs/dbraw/zinc/07/28/93/856072893.db2.gz JXVLDVJWQFRXPT-LOSJGSFVSA-N 2 0 421.972 4.375 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000426632550 856383705 /nfs/dbraw/zinc/38/37/05/856383705.db2.gz XMCUFEIFAHUVON-UHFFFAOYSA-N 2 0 405.586 4.409 20 0 HIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3cc(-c4ccc(F)cc4)no3)CC2)C[C@H](C)O1 ZINC000426778070 856473393 /nfs/dbraw/zinc/47/33/93/856473393.db2.gz UEJVRDDBBAHGEB-HDICACEKSA-N 2 0 401.526 4.192 20 0 HIADRP C[C@@H]1CCN(C(=O)[C@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000437461964 862825920 /nfs/dbraw/zinc/82/59/20/862825920.db2.gz MFRQAUSGUFOXBS-QPPBQGQZSA-N 2 0 423.576 4.161 20 0 HIADRP Cc1ccc([C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C2CCC2)cc1 ZINC000427698968 856913977 /nfs/dbraw/zinc/91/39/77/856913977.db2.gz RZCNZMIFIRJHBA-RUZDIDTESA-N 2 0 405.586 4.452 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CC[C@@H](C)[NH+](Cc3ccccc3)CC2)cc1)C1CC1 ZINC000437503725 862856557 /nfs/dbraw/zinc/85/65/57/862856557.db2.gz YKQDNXQOVLDFKG-OAQYLSRUSA-N 2 0 405.586 4.408 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+]C4CCN(c5ccccn5)CC4)[C@H]3C2)cc1 ZINC000428243432 857123772 /nfs/dbraw/zinc/12/37/72/857123772.db2.gz BTXPUQPNLDRGHG-HVCNVCAESA-N 2 0 404.602 4.331 20 0 HIADRP C[C@@H]([NH2+]C/C=C\C[NH2+][C@@H](C)[C@H]1OCCc2sccc21)[C@@H]1OCCc2sccc21 ZINC000429124961 857521718 /nfs/dbraw/zinc/52/17/18/857521718.db2.gz XQOWHFFXKUUUQA-ORBBWOHGSA-N 2 0 418.628 4.250 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](Cc3ccccc3F)c3ccccc3)cn2)CC1 ZINC000429430098 857661867 /nfs/dbraw/zinc/66/18/67/857661867.db2.gz AHNOIAGSKJHSAN-XMMPIXPASA-N 2 0 404.533 4.046 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](Cc3ccccc3F)c3ccccc3)cn2)CC1 ZINC000429430095 857662184 /nfs/dbraw/zinc/66/21/84/857662184.db2.gz AHNOIAGSKJHSAN-DEOSSOPVSA-N 2 0 404.533 4.046 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)c1 ZINC000429542355 857733690 /nfs/dbraw/zinc/73/36/90/857733690.db2.gz XXOHFNYPGXQVAY-RUZDIDTESA-N 2 0 419.544 4.191 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(O)c3nc(C)ccc23)CC1 ZINC000429700028 857840567 /nfs/dbraw/zinc/84/05/67/857840567.db2.gz PXRNNNDVJWUYMI-GOSISDBHSA-N 2 0 422.548 4.381 20 0 HIADRP C[C@H]1C[C@H](NC(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000430642075 858244413 /nfs/dbraw/zinc/24/44/13/858244413.db2.gz UPZXOBRNGVKJCA-AZUAARDMSA-N 2 0 405.542 4.277 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000430669725 858260379 /nfs/dbraw/zinc/26/03/79/858260379.db2.gz ULBZCNLQSYJRER-SDUSCBPUSA-N 2 0 405.586 4.068 20 0 HIADRP Cc1ccc(C)c(OCCC[N@@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c1 ZINC000430949914 858379443 /nfs/dbraw/zinc/37/94/43/858379443.db2.gz FKAOWCIVUKXFGL-UHFFFAOYSA-N 2 0 401.639 4.200 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000431677858 858733357 /nfs/dbraw/zinc/73/33/57/858733357.db2.gz FPIYIDGZXIACFF-XUZZJYLKSA-N 2 0 414.638 4.193 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000431695027 858743310 /nfs/dbraw/zinc/74/33/10/858743310.db2.gz VXWCOSYSNKHUBE-MZYLBHOOSA-N 2 0 424.589 4.159 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccco1 ZINC000431697476 858746991 /nfs/dbraw/zinc/74/69/91/858746991.db2.gz IDZALAPNPQKZNV-BAGYTPMASA-N 2 0 412.578 4.015 20 0 HIADRP C[C@@H]1C[N@H+](CCC[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CCCO1 ZINC000432347743 859113425 /nfs/dbraw/zinc/11/34/25/859113425.db2.gz QKHRSQYIYYNAQY-JOCHJYFZSA-N 2 0 418.585 4.189 20 0 HIADRP COc1ccc(NC(=O)CC[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000433048859 859500136 /nfs/dbraw/zinc/50/01/36/859500136.db2.gz YYJPKTGUIKDTIE-UHFFFAOYSA-N 2 0 407.558 4.012 20 0 HIADRP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC000433077568 859511724 /nfs/dbraw/zinc/51/17/24/859511724.db2.gz ORJHTAUXDCGILV-URXFXBBRSA-N 2 0 405.586 4.035 20 0 HIADRP COc1ccccc1NC(=O)[C@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433177463 859555215 /nfs/dbraw/zinc/55/52/15/859555215.db2.gz QRXYCJLPMHGXQI-FQEVSTJZSA-N 2 0 407.558 4.010 20 0 HIADRP Cc1ccc(CN(C(=O)C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C2CC2)o1 ZINC000433177372 859555334 /nfs/dbraw/zinc/55/53/34/859555334.db2.gz SEXMVICPQXJHHO-UHFFFAOYSA-N 2 0 421.585 4.067 20 0 HIADRP O=C(CC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)N1CCc2sccc2C1 ZINC000433211859 859568091 /nfs/dbraw/zinc/56/80/91/859568091.db2.gz CJZMYMVEYAXMKB-UHFFFAOYSA-N 2 0 423.626 4.011 20 0 HIADRP Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1 ZINC000433355086 859657881 /nfs/dbraw/zinc/65/78/81/859657881.db2.gz PRDVTBLTDSZGIA-JOCHJYFZSA-N 2 0 401.620 4.279 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccccc2)C1 ZINC000438563892 863996651 /nfs/dbraw/zinc/99/66/51/863996651.db2.gz PKMJMVVHEGYGJD-JOCHJYFZSA-N 2 0 419.491 4.184 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)Nc1ccc(F)c(F)c1 ZINC000439597336 864919926 /nfs/dbraw/zinc/91/99/26/864919926.db2.gz PVYLOMQOGPUHJQ-INIZCTEOSA-N 2 0 413.468 4.307 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCCN(c2cccc(F)c2)C1=O ZINC000439599148 864920873 /nfs/dbraw/zinc/92/08/73/864920873.db2.gz ROFJLVWSAFXBML-DEOSSOPVSA-N 2 0 421.516 4.336 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)Nc1ccc(F)cc1F ZINC000439608726 864930239 /nfs/dbraw/zinc/93/02/39/864930239.db2.gz BMEASFVYLNZTRP-MRXNPFEDSA-N 2 0 413.468 4.307 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(Cl)c(Cl)cc1F ZINC000439967324 865258833 /nfs/dbraw/zinc/25/88/33/865258833.db2.gz NMTVQDWGMXPFIA-ZDUSSCGKSA-N 2 0 405.345 4.012 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000468022842 881857974 /nfs/dbraw/zinc/85/79/74/881857974.db2.gz RWMQLZZOQGYWMC-QPTUXGOLSA-N 2 0 414.638 4.412 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000468022841 881858115 /nfs/dbraw/zinc/85/81/15/881858115.db2.gz RWMQLZZOQGYWMC-JRFVFWCSSA-N 2 0 414.638 4.412 20 0 HIADRP C[C@H]1C[C@@H](C(=O)N(CCC[NH+](C)C)Cc2ccc(Cl)c(Cl)c2)CC[N@@H+]1C ZINC000468101983 881911752 /nfs/dbraw/zinc/91/17/52/881911752.db2.gz MCVNCZXVBSNPMF-RDJZCZTQSA-N 2 0 400.394 4.004 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2CCCCOc1cccc(C(F)(F)F)c1 ZINC000441267002 866342721 /nfs/dbraw/zinc/34/27/21/866342721.db2.gz OQWCXGSBISFRCC-YZGWKJHDSA-N 2 0 400.485 4.048 20 0 HIADRP Cc1ccccc1[C@H](OC[C@H](O)C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1)c1ccccc1 ZINC000441455367 866529166 /nfs/dbraw/zinc/52/91/66/866529166.db2.gz YPBGUXFOZDBQLG-DFZDUAMZSA-N 2 0 422.613 4.270 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442779274 867672605 /nfs/dbraw/zinc/67/26/05/867672605.db2.gz LSZNELKVUVEXSB-WIYYLYMNSA-N 2 0 418.507 4.278 20 0 HIADRP CC[C@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1ccc(Br)cc1Cl ZINC000442873754 867709371 /nfs/dbraw/zinc/70/93/71/867709371.db2.gz LIGGTIZBZWWROH-KRWDZBQOSA-N 2 0 402.808 4.169 20 0 HIADRP CC[NH+](CC)CCOc1ccc(-c2noc([C@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)cc1OC ZINC000443201175 867873157 /nfs/dbraw/zinc/87/31/57/867873157.db2.gz HQPNVTDTVXQHHM-KSZLIROESA-N 2 0 416.566 4.400 20 0 HIADRP C[N@H+](C[C@@H](O)Cc1ccccc1C(F)(F)F)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000443609407 868172222 /nfs/dbraw/zinc/17/22/22/868172222.db2.gz MCYQQLIRWHRCAX-CTNGQTDRSA-N 2 0 406.492 4.063 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CC[C@@H](n3c(C)[nH+]c4c3CCCC4)C2)cc1)C1CC1 ZINC000468451601 882389730 /nfs/dbraw/zinc/38/97/30/882389730.db2.gz ZYJUKFKCCPHMNA-JOCHJYFZSA-N 2 0 406.574 4.142 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC(=O)Nc1ccccc1CC[NH+](C)C ZINC000446565578 870477349 /nfs/dbraw/zinc/47/73/49/870477349.db2.gz PLMUMQXRRZKQSI-WOJBJXKFSA-N 2 0 408.590 4.069 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)Nc2ccccc2CC[NH+](C)C)C1 ZINC000446573974 870484819 /nfs/dbraw/zinc/48/48/19/870484819.db2.gz YUEGXJBFQXGACI-HXUWFJFHSA-N 2 0 408.590 4.344 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000446589434 870498150 /nfs/dbraw/zinc/49/81/50/870498150.db2.gz KLVYEENQOPJOFW-UHFFFAOYSA-N 2 0 408.590 4.488 20 0 HIADRP Cc1ccc([C@@H](CCn2cncn2)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC000446748935 870656432 /nfs/dbraw/zinc/65/64/32/870656432.db2.gz VNGMFDAVCCQTTP-RUZDIDTESA-N 2 0 403.574 4.494 20 0 HIADRP COC[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)C1CCOCC1 ZINC000446757848 870670998 /nfs/dbraw/zinc/67/09/98/870670998.db2.gz XBHUSMSMIBRJGT-AREMUKBSSA-N 2 0 408.586 4.481 20 0 HIADRP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446887211 870806865 /nfs/dbraw/zinc/80/68/65/870806865.db2.gz PLLFCJZZJVATHP-UHFFFAOYSA-N 2 0 417.395 4.216 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](Cc3ccc(F)cc3)c3ccccc3)cn2)CC1 ZINC000447529559 871393104 /nfs/dbraw/zinc/39/31/04/871393104.db2.gz KRCNIFCASCJZNI-DEOSSOPVSA-N 2 0 404.533 4.046 20 0 HIADRP C[NH+](C)CCOCC[NH2+][C@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000447600048 871508519 /nfs/dbraw/zinc/50/85/19/871508519.db2.gz ZFDPDXBCGBYMDC-INIZCTEOSA-N 2 0 424.408 4.118 20 0 HIADRP FC(F)(F)[C@]1(c2nc(-c3ccn4c[nH+]cc4c3)no2)CC[N@H+](Cc2ccccc2)C1 ZINC000447949467 871820102 /nfs/dbraw/zinc/82/01/02/871820102.db2.gz YGFCLIKCAVBPGT-HXUWFJFHSA-N 2 0 413.403 4.090 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000448211747 872112642 /nfs/dbraw/zinc/11/26/42/872112642.db2.gz FAAADLDHVQNQHR-PBXXJUDPSA-N 2 0 424.633 4.219 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@H](C)C2)[C@H](C)C1 ZINC000448461586 872421932 /nfs/dbraw/zinc/42/19/32/872421932.db2.gz MKENMWCUFRBYTG-WHLIWEHUSA-N 2 0 414.638 4.036 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)[C@H](C)C1 ZINC000448464030 872431960 /nfs/dbraw/zinc/43/19/60/872431960.db2.gz BZFHXKKQSRSFQX-NLFFAJNJSA-N 2 0 422.617 4.287 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N(C)[C@@H]2CC[NH+](CC)C[C@@H]2C)c1 ZINC000448524493 872515932 /nfs/dbraw/zinc/51/59/32/872515932.db2.gz IOANNEJWNFWKFD-NZQKXSOJSA-N 2 0 402.627 4.180 20 0 HIADRP Cc1cccc(NC[C@@H]2CCN(Cc3nnc(-c4cc5c(s4)CCCC5)o3)C2)[nH+]1 ZINC000461394929 874402250 /nfs/dbraw/zinc/40/22/50/874402250.db2.gz RBBNZLPBAKKNEY-INIZCTEOSA-N 2 0 409.559 4.314 20 0 HIADRP FC(F)c1ccc(C[N@@H+]2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)cc1 ZINC000461394531 874402662 /nfs/dbraw/zinc/40/26/62/874402662.db2.gz LLLNGIDASWOYAZ-HXUWFJFHSA-N 2 0 400.517 4.053 20 0 HIADRP CCC(CC)(C[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C)c1ccc(OC)c(OC)c1 ZINC000461400721 874411713 /nfs/dbraw/zinc/41/17/13/874411713.db2.gz OGHMMDNMGAOWFX-UHFFFAOYSA-N 2 0 408.546 4.441 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2C[C@@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)cc1)C1CC1 ZINC000461444507 874500093 /nfs/dbraw/zinc/50/00/93/874500093.db2.gz LJQVZUJUNIMDDS-RPBOFIJWSA-N 2 0 417.597 4.265 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)cnn1C(C)C ZINC000468777948 882855361 /nfs/dbraw/zinc/85/53/61/882855361.db2.gz BFORKUWIAXWYKQ-LJQANCHMSA-N 2 0 414.594 4.113 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cnn1C(C)C ZINC000468784126 882858476 /nfs/dbraw/zinc/85/84/76/882858476.db2.gz BKFIHHUHVIVSJS-INIZCTEOSA-N 2 0 423.527 4.394 20 0 HIADRP O=C(c1ccc(Nc2cc[nH+]cc2)cc1)N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000462017784 875134620 /nfs/dbraw/zinc/13/46/20/875134620.db2.gz XMWDUOYCNTWCLY-UHFFFAOYSA-N 2 0 414.553 4.028 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000462166206 875263784 /nfs/dbraw/zinc/26/37/84/875263784.db2.gz FAYRDBDQJNPWIQ-OTPAQWSUSA-N 2 0 420.601 4.032 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]CC2=Cc3ccccc3OC2)CC1 ZINC000462716544 875797432 /nfs/dbraw/zinc/79/74/32/875797432.db2.gz CNLSTZGEAHBFKM-UHFFFAOYSA-N 2 0 417.475 4.023 20 0 HIADRP Cc1cc(N2CCN(c3ccc(C[NH+](C)C)cn3)CC2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000462823303 875862149 /nfs/dbraw/zinc/86/21/49/875862149.db2.gz ZXMNEBGEABQBDN-UHFFFAOYSA-N 2 0 409.965 4.288 20 0 HIADRP C[C@@H]([NH2+]Cc1cc(Br)cc2c1OCC2)c1cccc(OCC[NH+](C)C)c1 ZINC000462835621 875869967 /nfs/dbraw/zinc/86/99/67/875869967.db2.gz BXULFUUNCUTFAP-OAHLLOKOSA-N 2 0 419.363 4.175 20 0 HIADRP Cc1cc(N2CCC(C(=O)NCC[N@@H+](C)Cc3ccccc3)CC2)c2ccccc2[nH+]1 ZINC000462914732 875941833 /nfs/dbraw/zinc/94/18/33/875941833.db2.gz YWPLKYHCCRIJRB-UHFFFAOYSA-N 2 0 416.569 4.008 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+]C1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000463114422 876154852 /nfs/dbraw/zinc/15/48/52/876154852.db2.gz SVFNLAYGOQIENL-UHFFFAOYSA-N 2 0 401.982 4.035 20 0 HIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CCC(N2CC[NH+](C(C)C)CC2)CC1 ZINC000463151089 876203487 /nfs/dbraw/zinc/20/34/87/876203487.db2.gz XXLYCHSSTRCKME-UHFFFAOYSA-N 2 0 411.638 4.005 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC1CC[NH+](CCc2ccccc2)CC1 ZINC000463203655 876264834 /nfs/dbraw/zinc/26/48/34/876264834.db2.gz GSAWFHRPAKSCIQ-DHIUTWEWSA-N 2 0 405.630 4.440 20 0 HIADRP Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)c(-n2cc(Cl)cn2)n1 ZINC000468994675 883060602 /nfs/dbraw/zinc/06/06/02/883060602.db2.gz QQHCJPLRCFBBSH-YMPZKCBVSA-N 2 0 421.976 4.229 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)c1cccc(F)c1 ZINC000463699927 876819081 /nfs/dbraw/zinc/81/90/81/876819081.db2.gz RVUXSHNEWYUVIR-JOCHJYFZSA-N 2 0 421.520 4.450 20 0 HIADRP CC(C)C[N@@H+]1CC[C@@H](CNC(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000464827306 878080039 /nfs/dbraw/zinc/08/00/39/878080039.db2.gz HCTFLRSLIKXPCQ-QFIPXVFZSA-N 2 0 422.617 4.192 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000465428205 878859460 /nfs/dbraw/zinc/85/94/60/878859460.db2.gz ZHODTKCVGHXTEU-ILBGXUMGSA-N 2 0 422.617 4.233 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)C1 ZINC000465540515 879002911 /nfs/dbraw/zinc/00/29/11/879002911.db2.gz LLJQDRMXEFCOHR-PQNGQFLHSA-N 2 0 414.638 4.180 20 0 HIADRP CCC(CC)[C@H](CNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCCC1 ZINC000465571643 879044993 /nfs/dbraw/zinc/04/49/93/879044993.db2.gz HKXDADNRGAMBLP-UPVQGACJSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@H]1CCN(C(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000465607277 879099665 /nfs/dbraw/zinc/09/96/65/879099665.db2.gz UJQMVZNFOMTWPC-DHLKQENFSA-N 2 0 420.601 4.130 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCC[NH+]1CCC[C@@H](C)C1 ZINC000465612039 879109503 /nfs/dbraw/zinc/10/95/03/879109503.db2.gz YEHMAGCTGLRQJQ-ISKFKSNPSA-N 2 0 414.638 4.052 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000503431651 912432227 /nfs/dbraw/zinc/43/22/27/912432227.db2.gz GSKOEBMZXSKLOS-JOCHJYFZSA-N 2 0 414.638 4.326 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)NC[C@@H]2CCC[NH+](C)[C@@H]2c2cccs2)C1 ZINC000465750033 879338584 /nfs/dbraw/zinc/33/85/84/879338584.db2.gz HLGREOGHLICGCZ-JTJHWIPRSA-N 2 0 420.667 4.187 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCC(C)(C)[NH+]1CCC[C@@H](C)C1 ZINC000465759966 879355107 /nfs/dbraw/zinc/35/51/07/879355107.db2.gz QDTADUXXGDYWPT-FYYLOGMGSA-N 2 0 414.638 4.051 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCC1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000503439571 912452472 /nfs/dbraw/zinc/45/24/72/912452472.db2.gz BIDKDKLPEOTDAT-QFIPXVFZSA-N 2 0 412.622 4.080 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@H]2CCC[NH+](C)[C@H]2c2cccs2)c1 ZINC000465818513 879444679 /nfs/dbraw/zinc/44/46/79/879444679.db2.gz UJENEOBKUQHAFH-IFMALSPDSA-N 2 0 414.619 4.082 20 0 HIADRP CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000465910483 879571995 /nfs/dbraw/zinc/57/19/95/879571995.db2.gz NFHRFPIUOGQZRK-OAQYLSRUSA-N 2 0 421.029 4.068 20 0 HIADRP C[C@@H](C(=O)Nc1ccccc1-c1ccccc1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000467212345 880941936 /nfs/dbraw/zinc/94/19/36/880941936.db2.gz WEXPVTDYIQWIRM-NRFANRHFSA-N 2 0 421.585 4.257 20 0 HIADRP C[C@H](CCCOc1ccccc1C(N)=O)[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000469263636 883361195 /nfs/dbraw/zinc/36/11/95/883361195.db2.gz NPSDKLLCWHMCMU-QDMVCWPOSA-N 2 0 423.601 4.079 20 0 HIADRP C[C@@H](Cn1cc(Br)cn1)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000469302547 883401677 /nfs/dbraw/zinc/40/16/77/883401677.db2.gz SPDYLLUDOZCNOK-INIZCTEOSA-N 2 0 417.351 4.049 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+](C/C=C\c2ccc(Cl)cc2)CC1 ZINC000469723443 883886911 /nfs/dbraw/zinc/88/69/11/883886911.db2.gz SUCUKFOPQPRWBB-XQRVVYSFSA-N 2 0 403.998 4.057 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NCC(=O)N(C)Cc1ccc(Cl)s1 ZINC000469766239 883936317 /nfs/dbraw/zinc/93/63/17/883936317.db2.gz BCRBBKHGJNSLAR-YPGOJHLTSA-N 2 0 420.022 4.106 20 0 HIADRP C[NH+](C)CCOc1ccc(NC(=O)[C@H]2CCCC[N@@H+]2Cc2ccccc2)cc1Cl ZINC000469903093 884092887 /nfs/dbraw/zinc/09/28/87/884092887.db2.gz YXJJFXPTCDJZQV-OAQYLSRUSA-N 2 0 415.965 4.274 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)N1CCC[C@H](C[NH+]2CCC(C)CC2)C1)c1ccccc1 ZINC000503690509 912794241 /nfs/dbraw/zinc/79/42/41/912794241.db2.gz PJFUWUMXCXBHGW-FGZHOGPDSA-N 2 0 414.638 4.269 20 0 HIADRP O=C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(Nc2cc[nH+]cc2)cc1 ZINC000469963927 884170659 /nfs/dbraw/zinc/17/06/59/884170659.db2.gz JKCGNCLPQPMVJY-QILAJZQNSA-N 2 0 412.537 4.173 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC[C@H]([NH+]2CCCC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000503723999 912810489 /nfs/dbraw/zinc/81/04/89/912810489.db2.gz HQVJYAVOMHMCMS-UNMCSNQZSA-N 2 0 400.611 4.166 20 0 HIADRP O[C@H](C(F)F)[C@@H](Cc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000470253989 884590823 /nfs/dbraw/zinc/59/08/23/884590823.db2.gz GOKQWKWHABRRDQ-NQNKTMCVSA-N 2 0 400.513 4.009 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)[C@@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)C1 ZINC000470540755 884944578 /nfs/dbraw/zinc/94/45/78/884944578.db2.gz YOYKGMHILVEVIN-FXAWDEMLSA-N 2 0 413.528 4.279 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)CC1 ZINC000503973483 912891458 /nfs/dbraw/zinc/89/14/58/912891458.db2.gz FPDDFEOPXRCHDE-UHFFFAOYSA-N 2 0 421.029 4.068 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1)C1CCCCC1 ZINC000470734875 885189737 /nfs/dbraw/zinc/18/97/37/885189737.db2.gz VRVGCDQMWOHDLC-NRFANRHFSA-N 2 0 412.622 4.078 20 0 HIADRP CN(C(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470747231 885210713 /nfs/dbraw/zinc/21/07/13/885210713.db2.gz ZHRIEEPZCSIAAK-RPBOFIJWSA-N 2 0 420.601 4.130 20 0 HIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CCC(=O)N[C@@H](c2cccs2)c2ccccc2)C1 ZINC000470972618 885473234 /nfs/dbraw/zinc/47/32/34/885473234.db2.gz YMLJBYREDZMTSM-GBXCKJPGSA-N 2 0 411.615 4.008 20 0 HIADRP Cc1cccc(-c2n[nH]cc2C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)c1 ZINC000504087414 912995183 /nfs/dbraw/zinc/99/51/83/912995183.db2.gz NYBJDZFQIUWNEF-UHFFFAOYSA-N 2 0 417.601 4.073 20 0 HIADRP C[C@H](CCCCN1C(=O)c2ccccc2C1=O)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000471618994 886336407 /nfs/dbraw/zinc/33/64/07/886336407.db2.gz LQYZZPZRSVLFIU-AQNXPRMDSA-N 2 0 411.590 4.084 20 0 HIADRP C[N@@H+]1CC[C@H](NC(=O)Nc2ccc(OCC[NH+]3CCCCC3)cc2)[C@@H]1c1ccccc1 ZINC000471929860 886722866 /nfs/dbraw/zinc/72/28/66/886722866.db2.gz NRCGJBUWBWXBRQ-ZEQRLZLVSA-N 2 0 422.573 4.118 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NCc2cccc(C[NH+](C)C)c2)c2cccs2)CC1 ZINC000504202629 913084422 /nfs/dbraw/zinc/08/44/22/913084422.db2.gz DGBMGBWPYSMEMG-OAQYLSRUSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccc(Br)cc2)s1 ZINC000472166565 886965153 /nfs/dbraw/zinc/96/51/53/886965153.db2.gz YQGUZFXYHNZGEN-MRXNPFEDSA-N 2 0 422.436 4.293 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000472601394 887472712 /nfs/dbraw/zinc/47/27/12/887472712.db2.gz YHNXQNWVLFYSJK-BBVWWWHTSA-N 2 0 419.613 4.157 20 0 HIADRP C[C@@H](CCNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[N@H+](C)Cc1ccccc1 ZINC000473014620 887841892 /nfs/dbraw/zinc/84/18/92/887841892.db2.gz KMBCGDFOXKPVTD-QFIPXVFZSA-N 2 0 422.617 4.203 20 0 HIADRP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000473506578 888234711 /nfs/dbraw/zinc/23/47/11/888234711.db2.gz IQHYMMQQLWSPDT-HHHXNRCGSA-N 2 0 417.597 4.411 20 0 HIADRP O=C(NC1CC([NH+]2CCC(C(F)(F)F)CC2)C1)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000473509869 888238879 /nfs/dbraw/zinc/23/88/79/888238879.db2.gz DPJFNMMRGAWAJC-UHFFFAOYSA-N 2 0 423.523 4.208 20 0 HIADRP CCN(C(=O)NC[C@H](c1ccsc1)[NH+](C)C)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473886944 888755546 /nfs/dbraw/zinc/75/55/46/888755546.db2.gz RACGCJVCGFLBCF-VLCRHTCISA-N 2 0 414.619 4.218 20 0 HIADRP CCN(C(=O)NC1CC[NH+](C(C)(C)C)CC1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473937238 888815598 /nfs/dbraw/zinc/81/55/98/888815598.db2.gz BCNOENKDIGLUNR-KNQAVFIVSA-N 2 0 400.611 4.116 20 0 HIADRP C[C@H](CCc1ccc(I)cc1)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000474606255 889473514 /nfs/dbraw/zinc/47/35/14/889473514.db2.gz SRQYTCWBNSEDRG-OAHLLOKOSA-N 2 0 412.359 4.219 20 0 HIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2ccc(Cl)cc2-n2cncn2)C[N@@H+]1Cc1ccccc1 ZINC000474874314 889727540 /nfs/dbraw/zinc/72/75/40/889727540.db2.gz AASYCWRUNTWPHX-AZUAARDMSA-N 2 0 409.965 4.311 20 0 HIADRP COc1cc(C[N@@H+]2CCCC23CC[NH+](C)CC3)cc(OC)c1OCc1ccccc1 ZINC000475125265 889986013 /nfs/dbraw/zinc/98/60/13/889986013.db2.gz PUYDMXFDWUQAIG-UHFFFAOYSA-N 2 0 410.558 4.343 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)C[NH2+][C@@H](Cc1ccccc1)c1cccs1)c1ccccc1 ZINC000475142523 890009681 /nfs/dbraw/zinc/00/96/81/890009681.db2.gz ZGEVXTYVYKNBGG-FCHUYYIVSA-N 2 0 407.583 4.041 20 0 HIADRP C[C@@H](CCc1ccc(I)cc1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000475190637 890060805 /nfs/dbraw/zinc/06/08/05/890060805.db2.gz GZDVIGVUEJEUDF-HNNXBMFYSA-N 2 0 412.359 4.076 20 0 HIADRP O=C(NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000475318392 890235206 /nfs/dbraw/zinc/23/52/06/890235206.db2.gz IPSSUGDBCMEZKJ-IBGZPJMESA-N 2 0 418.651 4.056 20 0 HIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC(NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)CC1 ZINC000475333886 890254928 /nfs/dbraw/zinc/25/49/28/890254928.db2.gz JQQRXUMGHXKBOM-XZSMBWTPSA-N 2 0 401.561 4.424 20 0 HIADRP C[C@@H]1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000475994080 890915167 /nfs/dbraw/zinc/91/51/67/890915167.db2.gz AICDKMOBTZBSJB-OAQYLSRUSA-N 2 0 412.622 4.090 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000476001989 890928312 /nfs/dbraw/zinc/92/83/12/890928312.db2.gz BCXXJBRSYZVYOU-UHFFFAOYSA-N 2 0 400.611 4.077 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)[C@@H]2CC[NH+](C3CCCCC3)C2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000476977603 891903843 /nfs/dbraw/zinc/90/38/43/891903843.db2.gz ASKXHEPWSUOTAN-JBYIUTFZSA-N 2 0 421.988 4.243 20 0 HIADRP Cc1ccc(CN(C(=O)C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)C2CC2)o1 ZINC000476987794 891914031 /nfs/dbraw/zinc/91/40/31/891914031.db2.gz RLJXHBCCHOQNRZ-LJQANCHMSA-N 2 0 401.595 4.056 20 0 HIADRP O=C([C@H]1CC[N@@H+](C2CCCCC2)C1)N1CCC2(CC[NH+](Cc3ccccc3)C2)CC1 ZINC000477064525 891997740 /nfs/dbraw/zinc/99/77/40/891997740.db2.gz KISZEQMFKIVCTH-QHCPKHFHSA-N 2 0 409.618 4.156 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cc(F)ccc1F ZINC000479063770 894324107 /nfs/dbraw/zinc/32/41/07/894324107.db2.gz PIVLSUMINWWNMD-AUSIDOKSSA-N 2 0 415.528 4.149 20 0 HIADRP C[C@@H](Cc1ccc(Br)cc1)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000479254926 894521334 /nfs/dbraw/zinc/52/13/34/894521334.db2.gz OAPDZYARGCVKKL-KRWDZBQOSA-N 2 0 417.391 4.127 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479268307 894540966 /nfs/dbraw/zinc/54/09/66/894540966.db2.gz ZOBLIYGPUSJXMO-JOCHJYFZSA-N 2 0 416.407 4.156 20 0 HIADRP C[C@H]1CCCC[NH+]1CCC1CCN(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000479436159 894751184 /nfs/dbraw/zinc/75/11/84/894751184.db2.gz IYDLCJYQENUQPG-VXKWHMMOSA-N 2 0 406.659 4.327 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](NC[C@@H](c2cccs2)[NH+]2CCC(C)CC2)[C@H](C)C1 ZINC000479848539 895179423 /nfs/dbraw/zinc/17/94/23/895179423.db2.gz FSPCAPAQRGOMPP-FSSWDIPSSA-N 2 0 407.668 4.248 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](NC[C@H](c2cccs2)[NH+]2CCC(C)CC2)[C@@H](C)C1 ZINC000479848535 895180064 /nfs/dbraw/zinc/18/00/64/895180064.db2.gz FSPCAPAQRGOMPP-FDFHNCONSA-N 2 0 407.668 4.248 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480254400 895664266 /nfs/dbraw/zinc/66/42/66/895664266.db2.gz IHKSELZONWBVLH-IBGZPJMESA-N 2 0 415.603 4.141 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480254403 895664491 /nfs/dbraw/zinc/66/44/91/895664491.db2.gz IHKSELZONWBVLH-LJQANCHMSA-N 2 0 415.603 4.141 20 0 HIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCN(Cc4ccccn4)C[C@@H]3C)cc2)CC1 ZINC000480256290 895667001 /nfs/dbraw/zinc/66/70/01/895667001.db2.gz ACENQHLYTYGUPE-NVQXNPDNSA-N 2 0 406.618 4.314 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(OCc2nccn2C)cc1 ZINC000480266964 895676115 /nfs/dbraw/zinc/67/61/15/895676115.db2.gz QDNRKPHMAUJVFU-HXUWFJFHSA-N 2 0 404.558 4.446 20 0 HIADRP c1cn(-c2ccccc2)c(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000480386195 895792738 /nfs/dbraw/zinc/79/27/38/895792738.db2.gz LCKAEIVSMUKSGD-UHFFFAOYSA-N 2 0 404.558 4.033 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H]1CCCOc2c(Cl)c(Cl)ccc21)N1CC[NH+](C)CC1 ZINC000480520716 895884053 /nfs/dbraw/zinc/88/40/53/895884053.db2.gz CIKBTMPCVUKHTO-ZWKOTPCHSA-N 2 0 400.394 4.069 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H]1CCCOc2c(Cl)c(Cl)ccc21)N1CC[NH+](C)CC1 ZINC000480520711 895884117 /nfs/dbraw/zinc/88/41/17/895884117.db2.gz CIKBTMPCVUKHTO-MSOLQXFVSA-N 2 0 400.394 4.069 20 0 HIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480548077 895908718 /nfs/dbraw/zinc/90/87/18/895908718.db2.gz CLINVAPDRDLOLN-OXJNMPFZSA-N 2 0 404.599 4.180 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C1CCN(CC[NH+](C)C)CC1 ZINC000480554662 895915326 /nfs/dbraw/zinc/91/53/26/895915326.db2.gz ODXWBWSQQREPFR-HNNXBMFYSA-N 2 0 407.027 4.449 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1ccc(NS(C)(=O)=O)cc1 ZINC000480615730 895982710 /nfs/dbraw/zinc/98/27/10/895982710.db2.gz UQLVENUWUIBCGA-RBUKOAKNSA-N 2 0 415.603 4.283 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000480638097 896007473 /nfs/dbraw/zinc/00/74/73/896007473.db2.gz HJGOIEWUYCCRQI-KBPBESRZSA-N 2 0 411.434 4.401 20 0 HIADRP FC(F)(F)COc1ccc(CC[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000480668539 896033507 /nfs/dbraw/zinc/03/35/07/896033507.db2.gz SXYMEVBUONYIBB-PWRODBHTSA-N 2 0 419.491 4.065 20 0 HIADRP Cc1ccc(OCCCC(=O)Nc2ccc(C[NH2+][C@H]3CC[N@@H+](C)C[C@@H]3C)cc2)cc1 ZINC000480694051 896056608 /nfs/dbraw/zinc/05/66/08/896056608.db2.gz KXLNFPZRGDUHTQ-RDPSFJRHSA-N 2 0 409.574 4.223 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3ccccc3OC(F)F)cc2)CC1 ZINC000480693639 896057057 /nfs/dbraw/zinc/05/70/57/896057057.db2.gz MHHLTLNSLKAHKQ-SFHVURJKSA-N 2 0 403.517 4.276 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cc(Cl)ccc1OC ZINC000480699367 896060105 /nfs/dbraw/zinc/06/01/05/896060105.db2.gz PKVRJMKEKCGERL-HXUWFJFHSA-N 2 0 402.970 4.126 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)CC1 ZINC000480723453 896084988 /nfs/dbraw/zinc/08/49/88/896084988.db2.gz ZCTIOCUOYMMQGI-KRWDZBQOSA-N 2 0 421.507 4.415 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccccc2OC(F)F)CC1 ZINC000480740320 896100937 /nfs/dbraw/zinc/10/09/37/896100937.db2.gz LALQQIZOTWEITD-GOSISDBHSA-N 2 0 403.517 4.276 20 0 HIADRP Cc1ccccc1OCCCC(=O)Nc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000480741144 896103181 /nfs/dbraw/zinc/10/31/81/896103181.db2.gz RJZSEZABISQPNC-NZQKXSOJSA-N 2 0 409.574 4.365 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](c3ccccc3)c3ccc(F)cc3)cn2)CC1 ZINC000480790762 896159411 /nfs/dbraw/zinc/15/94/11/896159411.db2.gz JEIAAVIVIZVYDB-RUZDIDTESA-N 2 0 404.533 4.242 20 0 HIADRP COc1ccccc1[C@H](C[NH2+][C@@H]1CCN(Cc2ccccn2)C[C@@H]1C)N1CCCCC1 ZINC000481181386 896520078 /nfs/dbraw/zinc/52/00/78/896520078.db2.gz ZJWDSWRHGFXZJO-GPUOULLFSA-N 2 0 422.617 4.117 20 0 HIADRP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000481239703 896590038 /nfs/dbraw/zinc/59/00/38/896590038.db2.gz GJAJYTSKZMOOSL-OAQYLSRUSA-N 2 0 416.569 4.263 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000481246988 896599155 /nfs/dbraw/zinc/59/91/55/896599155.db2.gz PHAMNCIQFXYQKE-DEOSSOPVSA-N 2 0 422.523 4.185 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(I)cc1 ZINC000481329921 896688770 /nfs/dbraw/zinc/68/87/70/896688770.db2.gz AGPGQYDJRVHPHG-HNNXBMFYSA-N 2 0 424.326 4.082 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(-n2cncn2)cc1Cl ZINC000481546151 896906709 /nfs/dbraw/zinc/90/67/09/896906709.db2.gz PGJZFMMIRGEAEW-GOSISDBHSA-N 2 0 409.965 4.484 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(-n2cncn2)cc1Cl ZINC000481546152 896907111 /nfs/dbraw/zinc/90/71/11/896907111.db2.gz PGJZFMMIRGEAEW-SFHVURJKSA-N 2 0 409.965 4.484 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCCOc2ccc(Br)cc21 ZINC000481726219 897119481 /nfs/dbraw/zinc/11/94/81/897119481.db2.gz QXJQWPLNJZIEFD-IBGZPJMESA-N 2 0 419.363 4.393 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCCOc2ccc(Br)cc21 ZINC000481726220 897119932 /nfs/dbraw/zinc/11/99/32/897119932.db2.gz QXJQWPLNJZIEFD-LJQANCHMSA-N 2 0 419.363 4.393 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc(-n4ccnc4)cc3)CC2)cc1 ZINC000481724811 897120132 /nfs/dbraw/zinc/12/01/32/897120132.db2.gz IBWDFWBDFWOUCV-HXUWFJFHSA-N 2 0 404.558 4.444 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000481729910 897123667 /nfs/dbraw/zinc/12/36/67/897123667.db2.gz YPHFRLWSWBBTRM-LJQANCHMSA-N 2 0 415.603 4.285 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C)CC2)cc1 ZINC000481734972 897129530 /nfs/dbraw/zinc/12/95/30/897129530.db2.gz LLEQIOZYJFUORX-AMGIVPHBSA-N 3 0 421.629 4.407 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@H]1CCC(C)(C)c2ccc(Br)cc21 ZINC000482000114 897397402 /nfs/dbraw/zinc/39/74/02/897397402.db2.gz RGHRCIDXNJNGIK-JXFKEZNVSA-N 2 0 408.428 4.177 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1 ZINC000482141097 897599962 /nfs/dbraw/zinc/59/99/62/897599962.db2.gz YAOXZHJPGMCTDK-CPJSRVTESA-N 2 0 414.553 4.334 20 0 HIADRP CC[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc2cc(OC)ccc2c1 ZINC000482242372 897723819 /nfs/dbraw/zinc/72/38/19/897723819.db2.gz MOKDWIFLWGXVBH-VWLOTQADSA-N 2 0 419.569 4.381 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@@H]2CCCOc3c(Cl)cccc32)c1 ZINC000482256425 897738561 /nfs/dbraw/zinc/73/85/61/897738561.db2.gz HDUKTANNIDPYOE-JOCHJYFZSA-N 2 0 418.965 4.301 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cc(F)ccc1F ZINC000482263904 897748730 /nfs/dbraw/zinc/74/87/30/897748730.db2.gz MDFPSSLPSYJSJM-QGZVFWFLSA-N 2 0 404.501 4.305 20 0 HIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CC3CC[NH+](CCN(C)C)CC3)s2)cc1 ZINC000482354779 897868882 /nfs/dbraw/zinc/86/88/82/897868882.db2.gz YXZKVJANMBDPQH-KRWDZBQOSA-N 2 0 416.635 4.051 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc(Cl)sc1Cl ZINC000482451596 898016460 /nfs/dbraw/zinc/01/64/60/898016460.db2.gz JVAHYGRKZIWPCL-AWEZNQCLSA-N 2 0 414.406 4.098 20 0 HIADRP C[C@@H](C[NH2+][C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)CN1CC[NH+](C)CC1 ZINC000482462483 898036691 /nfs/dbraw/zinc/03/66/91/898036691.db2.gz KFVFVUVLOLYZPE-KBPBESRZSA-N 2 0 411.434 4.258 20 0 HIADRP CCc1nc2c(s1)[C@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CCC2 ZINC000482529092 898116503 /nfs/dbraw/zinc/11/65/03/898116503.db2.gz APYLSIFSBQFYSS-CRAIPNDOSA-N 2 0 402.583 4.325 20 0 HIADRP Cc1c([C@H](C)[NH2+]CCc2ccc(OCC[NH+](C)C)cc2)cnn1-c1ccc(F)cc1 ZINC000482539780 898128364 /nfs/dbraw/zinc/12/83/64/898128364.db2.gz SVSBYEZXQNZJCK-SFHVURJKSA-N 2 0 410.537 4.154 20 0 HIADRP C[C@@H](NC1CC[NH+](C2CCCCC2)CC1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482556211 898147230 /nfs/dbraw/zinc/14/72/30/898147230.db2.gz IINSNIUPQKYATJ-LJQANCHMSA-N 2 0 402.602 4.025 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2ccc([S@@](C)=O)cc2)CC1 ZINC000482568989 898163810 /nfs/dbraw/zinc/16/38/10/898163810.db2.gz KVXLVQNDVKRYSN-UOSLOYJQSA-N 2 0 417.594 4.117 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000482639108 898243758 /nfs/dbraw/zinc/24/37/58/898243758.db2.gz RJRALEYBGLEOAP-YJBOKZPZSA-N 2 0 405.011 4.066 20 0 HIADRP CCSc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000482651022 898255045 /nfs/dbraw/zinc/25/50/45/898255045.db2.gz KZGIFJLWFFHEQE-RXVVDRJESA-N 2 0 411.615 4.347 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(-c2ccccc2)o1 ZINC000482816249 898426820 /nfs/dbraw/zinc/42/68/20/898426820.db2.gz BDNBECRSIWGPOY-XXBNENTESA-N 2 0 417.553 4.495 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000482890321 898507557 /nfs/dbraw/zinc/50/75/57/898507557.db2.gz VVLLHXXFJUAUGU-RBUKOAKNSA-N 2 0 403.567 4.153 20 0 HIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000483202131 898855689 /nfs/dbraw/zinc/85/56/89/898855689.db2.gz QTARVAVJGBPWDH-HLAWJBBLSA-N 2 0 415.528 4.367 20 0 HIADRP COc1ccc(C[C@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c2ccc(OC)cc2)cc1 ZINC000483214483 898862971 /nfs/dbraw/zinc/86/29/71/898862971.db2.gz NYCFWQMNECSKCV-RLWLMLJZSA-N 2 0 424.585 4.078 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(C)[C@H]1CC[N@H+](CC)[C@H](C)C1)c1ccccc1Cl ZINC000483521498 899182887 /nfs/dbraw/zinc/18/28/87/899182887.db2.gz YJCMXOYVCIDHTG-LVCYWYKZSA-N 2 0 409.018 4.237 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)C[C@H]1C ZINC000483686712 899345165 /nfs/dbraw/zinc/34/51/65/899345165.db2.gz VEJMDCBXVHQBMM-CTVDGRRTSA-N 2 0 414.638 4.179 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CCCN(C)[C@H]1c1cccs1)c1cccc(OCC[NH+](C)C)c1 ZINC000483728952 899388569 /nfs/dbraw/zinc/38/85/69/899388569.db2.gz PKKSEARZACGBHL-JXHRLWIKSA-N 2 0 401.620 4.422 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)C[C@@H]1C ZINC000483765955 899427696 /nfs/dbraw/zinc/42/76/96/899427696.db2.gz ZUVPOCWXVVEFJO-REWPJTCUSA-N 2 0 400.611 4.077 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)NC2CC[NH+](C3CCCC3)CC2)CCCC1)c1ccccc1 ZINC000483795414 899468489 /nfs/dbraw/zinc/46/84/89/899468489.db2.gz ANNWGSHNVUQBEV-FQEVSTJZSA-N 2 0 412.622 4.356 20 0 HIADRP C[C@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(-c2ccccc2Br)s1 ZINC000484139735 899760705 /nfs/dbraw/zinc/76/07/05/899760705.db2.gz FUPFAQCSCUEXRG-AWEZNQCLSA-N 2 0 409.393 4.285 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cnn1-c1ccc(F)cc1 ZINC000484490515 899983083 /nfs/dbraw/zinc/98/30/83/899983083.db2.gz QUJKHNUAYCVJRI-GOSISDBHSA-N 2 0 422.548 4.127 20 0 HIADRP O[C@H](COc1ccccc1Cl)C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000485463376 900756997 /nfs/dbraw/zinc/75/69/97/900756997.db2.gz GCMWHCBDLHTBGK-NRFANRHFSA-N 2 0 414.977 4.068 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1ccc2ncsc2c1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000485837052 901082828 /nfs/dbraw/zinc/08/28/28/901082828.db2.gz ZMWZFUSCFUMNFG-QZTJIDSGSA-N 2 0 422.598 4.116 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000486273777 901456894 /nfs/dbraw/zinc/45/68/94/901456894.db2.gz YKDGYPGOANVKQY-SQJMNOBHSA-N 2 0 422.617 4.238 20 0 HIADRP C[C@@H](NC(=O)c1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487296035 902140467 /nfs/dbraw/zinc/14/04/67/902140467.db2.gz GSBGCHGFXVNNOA-PXDATVDWSA-N 2 0 405.586 4.313 20 0 HIADRP C[C@H](CCSc1ccccc1)[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000487788190 902365134 /nfs/dbraw/zinc/36/51/34/902365134.db2.gz GVVKEXJMQHHJAR-OAQYLSRUSA-N 2 0 417.663 4.262 20 0 HIADRP O=C([C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000487870169 902416575 /nfs/dbraw/zinc/41/65/75/902416575.db2.gz FKGQLPKVTMDROC-GOTSBHOMSA-N 2 0 415.597 4.152 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)cc1)C1CC1 ZINC000488531353 902871713 /nfs/dbraw/zinc/87/17/13/902871713.db2.gz LZGRQNPTOLUEDD-NLFFAJNJSA-N 2 0 405.586 4.311 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N[C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000489283436 903307270 /nfs/dbraw/zinc/30/72/70/903307270.db2.gz APGWBXSGVSCIEI-QKYMMTCKSA-N 2 0 420.601 4.032 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489312376 903324805 /nfs/dbraw/zinc/32/48/05/903324805.db2.gz GCIOKPGUSRPEBK-OYRHEFFESA-N 2 0 414.638 4.049 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000489529735 903441720 /nfs/dbraw/zinc/44/17/20/903441720.db2.gz VPSJECLQBFDVOK-ZODMCCGTSA-N 2 0 420.601 4.033 20 0 HIADRP CCc1ccc([C@H](CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)[NH+](C)C)cc1 ZINC000489872192 903643556 /nfs/dbraw/zinc/64/35/56/903643556.db2.gz LNMFEYYOUFPUGH-VWLOTQADSA-N 2 0 422.617 4.158 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1 ZINC000489881388 903649493 /nfs/dbraw/zinc/64/94/93/903649493.db2.gz HSVLBXZDLPZZOB-UHFFFAOYSA-N 2 0 422.617 4.334 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1)N1CC[NH+](C)CC1 ZINC000490162618 903804252 /nfs/dbraw/zinc/80/42/52/903804252.db2.gz ALTRMHQTSIRSEH-XZOQPEGZSA-N 2 0 403.973 4.430 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H](c1cccc(F)c1)c1cccc(Cl)c1)N1CC[NH+](C)CC1 ZINC000490164735 903805154 /nfs/dbraw/zinc/80/51/54/903805154.db2.gz PTOQWJUKFHTUHO-DHIUTWEWSA-N 2 0 403.973 4.430 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000490172701 903810148 /nfs/dbraw/zinc/81/01/48/903810148.db2.gz QCMCKQUSZHNBLO-AVRDEDQJSA-N 2 0 416.407 4.154 20 0 HIADRP COc1ccccc1-c1ncc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cn1 ZINC000490764556 904217372 /nfs/dbraw/zinc/21/73/72/904217372.db2.gz YSSSHYPZWNMOIS-UHFFFAOYSA-N 2 0 402.542 4.154 20 0 HIADRP Cc1cc([C@H]([NH2+]CCCN2CCC[N@@H+](C)CC2)c2ccccc2Cl)ccc1F ZINC000491006864 904366017 /nfs/dbraw/zinc/36/60/17/904366017.db2.gz NEEWSMDDRGPSON-QHCPKHFHSA-N 2 0 403.973 4.494 20 0 HIADRP CCC[NH+]1CCC(C[NH2+][C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000491012724 904369820 /nfs/dbraw/zinc/36/98/20/904369820.db2.gz YLLAXUYHSBEIJZ-HSZRJFAPSA-N 2 0 418.578 4.030 20 0 HIADRP COc1ccccc1-c1ncc(CNC2CC[NH+]([C@H](C)c3ccccc3)CC2)cn1 ZINC000491234069 904494413 /nfs/dbraw/zinc/49/44/13/904494413.db2.gz DVETWUHLIIAPSM-LJQANCHMSA-N 2 0 402.542 4.467 20 0 HIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC(C(=O)Nc2ccccc2O)CC1 ZINC000506163755 914829712 /nfs/dbraw/zinc/82/97/12/914829712.db2.gz LWXDMPBITABUFN-UHFFFAOYSA-N 2 0 409.574 4.201 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+][C@@H](c2ccc(Cl)cc2)c2ccc(C(F)(F)F)cc2)CC1 ZINC000493252844 905069338 /nfs/dbraw/zinc/06/93/38/905069338.db2.gz XBWGQYJWMHPGHW-LJQANCHMSA-N 2 0 412.883 4.495 20 0 HIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)CC2 ZINC000493910184 905261480 /nfs/dbraw/zinc/26/14/80/905261480.db2.gz ZKARAOYTCOSNLL-FQEVSTJZSA-N 2 0 403.364 4.475 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cc(Br)cs1 ZINC000494745277 905943995 /nfs/dbraw/zinc/94/39/95/905943995.db2.gz KTICHVOVVZLAFB-KBXCAEBGSA-N 2 0 409.393 4.318 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)[C@H](C)C1 ZINC000495186285 906296111 /nfs/dbraw/zinc/29/61/11/906296111.db2.gz WNQQWNNALSDDCR-LZJOCLMNSA-N 2 0 414.421 4.299 20 0 HIADRP CC[N@H+](CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)[C@H](C)Cc1ccsc1 ZINC000495256791 906344250 /nfs/dbraw/zinc/34/42/50/906344250.db2.gz UJHKQUIHBBQNAO-HXUWFJFHSA-N 2 0 413.631 4.090 20 0 HIADRP CCCC[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)C(=O)Nc1cc(C)on1 ZINC000495766141 906547153 /nfs/dbraw/zinc/54/71/53/906547153.db2.gz OGMCFPJXIDSPID-LJQANCHMSA-N 2 0 404.580 4.044 20 0 HIADRP CCN(CC[NH+]1CCCCCC1)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000496650794 906728680 /nfs/dbraw/zinc/72/86/80/906728680.db2.gz MGNDWQDAHJQVAC-CWAQXLGLSA-N 2 0 412.622 4.090 20 0 HIADRP C[C@@H](NC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H](c1ccccc1)[NH+](C)C ZINC000496652423 906730547 /nfs/dbraw/zinc/73/05/47/906730547.db2.gz RYYSPQBIQCBFAE-HZGGVJSXSA-N 2 0 420.601 4.173 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]CCc4nnc(-c5ccccc5)o4)[C@@H]3C2)cc1 ZINC000512615201 921262214 /nfs/dbraw/zinc/26/22/14/921262214.db2.gz YHXFCRACXOYHMN-ZRBLBEILSA-N 2 0 402.542 4.169 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]CCc4nnc(-c5ccccc5)o4)[C@H]3C2)cc1 ZINC000512615197 921262410 /nfs/dbraw/zinc/26/24/10/921262410.db2.gz YHXFCRACXOYHMN-RJGXRXQPSA-N 2 0 402.542 4.169 20 0 HIADRP c1cn(Cc2ccccc2)c(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000512618659 921263816 /nfs/dbraw/zinc/26/38/16/921263816.db2.gz JMTWMQWDCAKYEF-KKUQBAQOSA-N 2 0 414.597 4.364 20 0 HIADRP c1cn(Cc2ccccc2C[NH2+][C@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000512660424 921278845 /nfs/dbraw/zinc/27/88/45/921278845.db2.gz NFTPFLKPAJSYBI-GSDHBNRESA-N 2 0 400.570 4.322 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c2ccccc21 ZINC000512667860 921281234 /nfs/dbraw/zinc/28/12/34/921281234.db2.gz RJLNNFMQFMHKNS-DFXJHMEVSA-N 2 0 403.570 4.375 20 0 HIADRP CC[NH+](CC)CCN(Cc1cccs1)C(=O)N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512702308 921292547 /nfs/dbraw/zinc/29/25/47/921292547.db2.gz DMQXDUJYRJCXPP-WOJBJXKFSA-N 2 0 420.667 4.255 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@@H](C)[C@@H]2CCC[NH+](C3CCC3)C2)CC1)CC1CC1 ZINC000512711709 921294014 /nfs/dbraw/zinc/29/40/14/921294014.db2.gz KVTNDEQAIXHVMQ-NZQKXSOJSA-N 2 0 418.670 4.183 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]C3c4ccccc4-c4ccccc43)c2)C1 ZINC000497834914 907316436 /nfs/dbraw/zinc/31/64/36/907316436.db2.gz ASRIOKXLNGTFIW-NRFANRHFSA-N 2 0 411.549 4.244 20 0 HIADRP C[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000498124357 907637193 /nfs/dbraw/zinc/63/71/93/907637193.db2.gz HNBUMFPDMCCJMT-PMVMPFDFSA-N 2 0 424.589 4.016 20 0 HIADRP CCCN(C(=O)NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)[C@H](CC)c1ccccc1 ZINC000498712004 908138583 /nfs/dbraw/zinc/13/85/83/908138583.db2.gz WGKLFDFOONMZOM-XMMPIXPASA-N 2 0 423.605 4.167 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@H](C)[C@@H]2CC[NH+](Cc3ccccc3)C2)CC1 ZINC000498724005 908149136 /nfs/dbraw/zinc/14/91/36/908149136.db2.gz ZFAZNFLOBPIHFH-ZJSXRUAMSA-N 2 0 414.638 4.051 20 0 HIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCC(=O)Nc3ccc(Br)cc3)C2)CC1 ZINC000498909153 908318411 /nfs/dbraw/zinc/31/84/11/908318411.db2.gz VVSVSHWFLLHTOA-GOSISDBHSA-N 2 0 422.411 4.222 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@H](c2cc3ccccc3o2)c2cccnc2)(N2CCCCC2)CC1 ZINC000498944788 908349052 /nfs/dbraw/zinc/34/90/52/908349052.db2.gz UIDIJBIGNVVZPK-VWLOTQADSA-N 2 0 418.585 4.457 20 0 HIADRP O=C(CCc1ccccc1)N1CC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000499243300 908610390 /nfs/dbraw/zinc/61/03/90/908610390.db2.gz JYKXNIRXTXWNSX-FXSWLTOZSA-N 2 0 417.597 4.005 20 0 HIADRP COc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@H](C)C[NH+]2CCCC2)cc1 ZINC000513077831 921530110 /nfs/dbraw/zinc/53/01/10/921530110.db2.gz XNKPTHMHEYMORV-FQEVSTJZSA-N 2 0 404.558 4.369 20 0 HIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)cc1 ZINC000513098685 921546938 /nfs/dbraw/zinc/54/69/38/921546938.db2.gz KKMCUHGAMGBBKE-UHFFFAOYSA-N 2 0 417.601 4.073 20 0 HIADRP CC(C)[N@H+](CCCN1CC[NH+](C(C)C)CC1)Cc1nnc(-c2ccccc2Cl)o1 ZINC000501019313 910237541 /nfs/dbraw/zinc/23/75/41/910237541.db2.gz BVVKXNDSWSKJOU-UHFFFAOYSA-N 2 0 420.001 4.017 20 0 HIADRP C[N@@H+](Cc1csc(-c2ccc3c(c2)OCO3)n1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501027098 910244847 /nfs/dbraw/zinc/24/48/47/910244847.db2.gz JVDWHWKIOGSRTP-UHFFFAOYSA-N 2 0 422.554 4.282 20 0 HIADRP C[C@@H](C(=O)Nc1cccc(C(F)(F)F)c1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501039467 910252799 /nfs/dbraw/zinc/25/27/99/910252799.db2.gz LURPYVZPAJXJHK-INIZCTEOSA-N 2 0 420.479 4.276 20 0 HIADRP C[N@@H+](Cc1ccc(OCc2ccccn2)cc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501066393 910272394 /nfs/dbraw/zinc/27/23/94/910272394.db2.gz BZUVZMVFTRIVFI-UHFFFAOYSA-N 2 0 402.542 4.404 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)N(C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000501097491 910293453 /nfs/dbraw/zinc/29/34/53/910293453.db2.gz ZEHBIDYXNVZFPZ-HXUWFJFHSA-N 2 0 423.605 4.069 20 0 HIADRP Cc1nc(-c2cccc(NC(=O)C[NH+]3CCC(CCC[NH+](C)C)CC3)c2)cs1 ZINC000501772055 910826597 /nfs/dbraw/zinc/82/65/97/910826597.db2.gz VAXCIKVVAZKKDU-UHFFFAOYSA-N 2 0 400.592 4.111 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)CC1 ZINC000501772006 910826779 /nfs/dbraw/zinc/82/67/79/910826779.db2.gz HYJVSTWGQGEVPE-FQEVSTJZSA-N 2 0 414.594 4.485 20 0 HIADRP C[NH+](C)CCCC1CC[NH+](CCC(=O)N[C@@H](c2cccs2)c2ccccc2)CC1 ZINC000501773215 910828376 /nfs/dbraw/zinc/82/83/76/910828376.db2.gz HINAOHQQSOUCFL-XMMPIXPASA-N 2 0 413.631 4.398 20 0 HIADRP COc1ccc(-c2nc(C[NH+]3CCC(CCC[NH+](C)C)CC3)cs2)cc1OC ZINC000501780230 910834642 /nfs/dbraw/zinc/83/46/42/910834642.db2.gz YDUYHGQBDLNUBY-UHFFFAOYSA-N 2 0 403.592 4.381 20 0 HIADRP CC(C)(C)[NH+]1CCC([NH2+]C[C@H](c2ccc(Cl)cc2)N2CCOC(C)(C)C2)CC1 ZINC000513216683 921631425 /nfs/dbraw/zinc/63/14/25/921631425.db2.gz GUIRQMAXNGOJHV-OAQYLSRUSA-N 2 0 408.030 4.344 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NCC2CC[NH+](Cc3ccc(OC)cc3)CC2)cc1 ZINC000513249555 921657128 /nfs/dbraw/zinc/65/71/28/921657128.db2.gz BQSVUIXUIRZHHZ-UHFFFAOYSA-N 2 0 423.601 4.179 20 0 HIADRP CCC(CC)(CNC(=O)NC[C@@H]1CCC[N@@H+](C(C)C)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000502762670 911786598 /nfs/dbraw/zinc/78/65/98/911786598.db2.gz JRXKRABQCZXUNE-SFTDATJTSA-N 2 0 402.627 4.316 20 0 HIADRP CC(C)[N@@H+]1CCC[C@H](CNC(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)C1 ZINC000502763268 911786833 /nfs/dbraw/zinc/78/68/33/911786833.db2.gz NUBRKLLKDVMSDS-LEWJYISDSA-N 2 0 400.611 4.070 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)NC[C@H](c3cccs3)[NH+]3CCCC3)CC2)CC1 ZINC000502787724 911810658 /nfs/dbraw/zinc/81/06/58/911810658.db2.gz DHDNVNGGCRVRDO-XVAXZDLZSA-N 2 0 418.651 4.227 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000502961324 911942257 /nfs/dbraw/zinc/94/22/57/911942257.db2.gz QZAXYWNBSNCCBA-UHFFFAOYSA-N 2 0 422.617 4.334 20 0 HIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000503005743 911981077 /nfs/dbraw/zinc/98/10/77/911981077.db2.gz SVCOBPBDUYNHGN-OAQYLSRUSA-N 2 0 414.638 4.193 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)CCCC1)c1ccccc1 ZINC000503107383 912073308 /nfs/dbraw/zinc/07/33/08/912073308.db2.gz MEVBTLGMCXCREX-ICSRJNTNSA-N 2 0 414.619 4.314 20 0 HIADRP CN(C(=O)NCc1ccc(C[NH+]2CCCC2)cc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000503134450 912095988 /nfs/dbraw/zinc/09/59/88/912095988.db2.gz CHZDPSZGWRVYMO-UHFFFAOYSA-N 2 0 420.601 4.088 20 0 HIADRP CC[NH+]1CCN(c2ccccc2C[NH+]2CCC(c3nc4ccccc4[nH]3)CC2)CC1 ZINC000506632961 915301979 /nfs/dbraw/zinc/30/19/79/915301979.db2.gz VTSUCRWUQCUUOO-UHFFFAOYSA-N 2 0 403.574 4.084 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1)c1ccccc1 ZINC000506800751 915540148 /nfs/dbraw/zinc/54/01/48/915540148.db2.gz KKMKSJJJXIXWAA-FSSWDIPSSA-N 2 0 414.638 4.412 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000506904777 915702836 /nfs/dbraw/zinc/70/28/36/915702836.db2.gz XASCEYCCMRILBU-URXFXBBRSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000506920286 915721013 /nfs/dbraw/zinc/72/10/13/915721013.db2.gz ZVJQQMWYEINFCF-VSKRKVRLSA-N 2 0 416.610 4.103 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000506940286 915745844 /nfs/dbraw/zinc/74/58/44/915745844.db2.gz NZBWQECCDOGFRO-YADHBBJMSA-N 2 0 414.638 4.324 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC000506948604 915754435 /nfs/dbraw/zinc/75/44/35/915754435.db2.gz GUNKOSXDFWFSKB-XUZZJYLKSA-N 2 0 414.638 4.324 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000507448181 916217055 /nfs/dbraw/zinc/21/70/55/916217055.db2.gz JMMOPPVBQFDUSO-CYBMUJFWSA-N 2 0 405.892 4.397 20 0 HIADRP c1sc(CC[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)nc1-c1ccccn1 ZINC000507465071 916232597 /nfs/dbraw/zinc/23/25/97/916232597.db2.gz ZJPJNMVRBZAYQA-PWRODBHTSA-N 2 0 404.583 4.248 20 0 HIADRP Cc1ccc(C(=O)N2CCC([NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)CC2)cc1 ZINC000507504123 916271108 /nfs/dbraw/zinc/27/11/08/916271108.db2.gz AVQBVFLTBPOXQZ-AYRHNUGRSA-N 2 0 417.597 4.100 20 0 HIADRP CCOc1cc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)cc(Cl)c1OC ZINC000507724732 916519020 /nfs/dbraw/zinc/51/90/20/916519020.db2.gz ZBOXUBRJJGEEMT-UHFFFAOYSA-N 2 0 410.986 4.072 20 0 HIADRP C[C@H]([NH2+]CC1CCN(C(=O)c2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508712956 917473428 /nfs/dbraw/zinc/47/34/28/917473428.db2.gz DYBUWQCEGUWQOQ-OFVILXPXSA-N 2 0 405.586 4.039 20 0 HIADRP C[C@H](NC(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[C@@H](c1ccccc1)[NH+](C)C ZINC000508855101 917608480 /nfs/dbraw/zinc/60/84/80/917608480.db2.gz UJGOKWDKWZBPMH-WIVXBSKCSA-N 2 0 422.617 4.372 20 0 HIADRP COCc1ccccc1/C=C(\C)C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000508878253 917632400 /nfs/dbraw/zinc/63/24/00/917632400.db2.gz JTYSFXPLYXYNOP-ZBJSNUHESA-N 2 0 413.650 4.364 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccccc2Br)cc1 ZINC000509475072 918121244 /nfs/dbraw/zinc/12/12/44/918121244.db2.gz GEIAQLAFVKSRCH-GOSISDBHSA-N 2 0 416.407 4.232 20 0 HIADRP C[C@@H]1C[C@@H](CCNC(=O)NCCCC[NH+]2CCC(C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000509772515 918386057 /nfs/dbraw/zinc/38/60/57/918386057.db2.gz AXOSESZQIJHHGR-ISKFKSNPSA-N 2 0 414.638 4.098 20 0 HIADRP CC[NH+]1CCN(c2ccccc2C[NH+]2CCC(C(=O)c3ccc(C)cc3)CC2)CC1 ZINC000510146057 918701774 /nfs/dbraw/zinc/70/17/74/918701774.db2.gz VBGWCXZEHWQIST-UHFFFAOYSA-N 2 0 405.586 4.232 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000510407505 918878177 /nfs/dbraw/zinc/87/81/77/918878177.db2.gz RHLUBGSBVDCBKO-UHFFFAOYSA-N 2 0 411.571 4.198 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(=O)N1CCc2sccc2C1 ZINC000511022465 919592647 /nfs/dbraw/zinc/59/26/47/919592647.db2.gz PMGHMFGTFMVAGA-RTBURBONSA-N 2 0 411.615 4.186 20 0 HIADRP CCC(CC)(CNC(=O)N1CCCC12CC[NH+](C)CC2)[NH2+][C@H](C)c1ccccc1 ZINC000511037086 919619716 /nfs/dbraw/zinc/61/97/16/919619716.db2.gz XIFFKWJFIYZKMA-HXUWFJFHSA-N 2 0 400.611 4.166 20 0 HIADRP CC[C@H](CNC(=O)c1ccc(C[N@H+](CC)C2CC2)cc1)[NH+]1CCc2ccccc2C1 ZINC000511265845 919863129 /nfs/dbraw/zinc/86/31/29/919863129.db2.gz KQUDBOHISKAGMH-XMMPIXPASA-N 2 0 405.586 4.238 20 0 HIADRP C[C@@H]([NH2+]C1CCC(C(=O)OC(C)(C)C)CC1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000511381236 919983392 /nfs/dbraw/zinc/98/33/92/919983392.db2.gz IKCOJVNVDHAZQB-PGYGNJIDSA-N 2 0 419.585 4.129 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)c1 ZINC000511568386 920210236 /nfs/dbraw/zinc/21/02/36/920210236.db2.gz ZDMHOCXXAJHREI-XMMPIXPASA-N 2 0 417.553 4.479 20 0 HIADRP C[N@@H+]1CC[C@H](NC(=O)N[C@H]2CC[NH+](Cc3ccccc3)CC2(C)C)[C@@H]1c1ccccc1 ZINC000511742006 920417431 /nfs/dbraw/zinc/41/74/31/920417431.db2.gz JOJGVJAXVFCANC-HJOGWXRNSA-N 2 0 420.601 4.032 20 0 HIADRP Cc1cc([C@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)sc1Br ZINC000512008908 920780155 /nfs/dbraw/zinc/78/01/55/920780155.db2.gz RDKHHSWMMGTNLC-INIZCTEOSA-N 2 0 414.457 4.420 20 0 HIADRP Cc1cc([C@@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)sc1Br ZINC000512008911 920780202 /nfs/dbraw/zinc/78/02/02/920780202.db2.gz RDKHHSWMMGTNLC-MRXNPFEDSA-N 2 0 414.457 4.420 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+]CCC1CC[NH+](C)CC1 ZINC000512069400 920836463 /nfs/dbraw/zinc/83/64/63/920836463.db2.gz XOSRMTLDOJZNAZ-CYBMUJFWSA-N 2 0 405.892 4.397 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2cccc(C[NH+]3CCSCC3)c2)cc1)C1CC1 ZINC000512108389 920864501 /nfs/dbraw/zinc/86/45/01/920864501.db2.gz WZQZTOKQNULUNK-UHFFFAOYSA-N 2 0 409.599 4.472 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000512109482 920865983 /nfs/dbraw/zinc/86/59/83/920865983.db2.gz ZNXZRRQPESSAPW-QHCPKHFHSA-N 2 0 414.638 4.098 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cc(C)c(Br)s3)cn2)CC1 ZINC000512130489 920879284 /nfs/dbraw/zinc/87/92/84/920879284.db2.gz LVACEXKYYLZAFZ-HNNXBMFYSA-N 2 0 423.424 4.207 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000512199806 920945320 /nfs/dbraw/zinc/94/53/20/920945320.db2.gz DOSINKSQXKZCIK-XZOQPEGZSA-N 2 0 412.666 4.303 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+]([C@H](C)c2ccccc2)C2CC2)CC1 ZINC000512245166 921002495 /nfs/dbraw/zinc/00/24/95/921002495.db2.gz PZRMSPZCYLSPHV-OAQYLSRUSA-N 2 0 405.586 4.301 20 0 HIADRP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(-c4cccc(Cl)c4Cl)o3)C2)CC1 ZINC000513507948 921854941 /nfs/dbraw/zinc/85/49/41/921854941.db2.gz JOLIUUJPLHEKCL-INIZCTEOSA-N 2 0 408.373 4.465 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)c1OC ZINC000513683378 922003045 /nfs/dbraw/zinc/00/30/45/922003045.db2.gz JTMCTHRSVJJLCW-NSHGMRRFSA-N 2 0 412.574 4.472 20 0 HIADRP c1ncn(Cc2ccc(C[NH2+][C@H]3CCCC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)cc2)n1 ZINC000513761151 922079358 /nfs/dbraw/zinc/07/93/58/922079358.db2.gz MJGRREQINJRLCO-GSDHBNRESA-N 2 0 415.585 4.107 20 0 HIADRP Cc1ccc([C@@H](OC[C@H](O)C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c2ccccc2)cc1 ZINC000514005691 922330933 /nfs/dbraw/zinc/33/09/33/922330933.db2.gz PIIKEQMCSQSTLR-FTJBHMTQSA-N 2 0 410.602 4.267 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2ccc(CN3CC[NH+](C)CC3)cc2)cc1 ZINC000514217529 922550871 /nfs/dbraw/zinc/55/08/71/922550871.db2.gz FVCZYJGOJBDWKY-NRFANRHFSA-N 2 0 420.601 4.061 20 0 HIADRP CSC1(C[NH2+]Cc2cc(Br)cc(Br)c2)CC[NH+](C)CC1 ZINC000514820967 922815003 /nfs/dbraw/zinc/81/50/03/922815003.db2.gz WFKMRQYAZCDHDE-UHFFFAOYSA-N 2 0 422.230 4.129 20 0 HIADRP C[C@@H](CC(=O)NCCc1ccccc1)[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000515410012 923087529 /nfs/dbraw/zinc/08/75/29/923087529.db2.gz NJHPPTHENSTJEK-WIOPSUGQSA-N 2 0 407.602 4.016 20 0 HIADRP COc1ccc(NC(=O)[C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000515523504 923153091 /nfs/dbraw/zinc/15/30/91/923153091.db2.gz QNQDPUVNNRUFIC-HSALFYBXSA-N 2 0 409.574 4.290 20 0 HIADRP CCOc1ccccc1NC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000515756753 923329573 /nfs/dbraw/zinc/32/95/73/923329573.db2.gz UZHQOJXTSQTWCY-WOJBJXKFSA-N 2 0 409.574 4.434 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000515759716 923332455 /nfs/dbraw/zinc/33/24/55/923332455.db2.gz WCHPCKJQFHWBOS-GUDVDZBRSA-N 2 0 423.557 4.010 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCC(C)CC2)CC1 ZINC000516155001 923579441 /nfs/dbraw/zinc/57/94/41/923579441.db2.gz NTNIPPRMTOBRGH-DEOSSOPVSA-N 2 0 414.638 4.223 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1c(Br)cncc1Br ZINC000517001755 923962329 /nfs/dbraw/zinc/96/23/29/923962329.db2.gz SFNATIBGVWSHJU-ZDUSSCGKSA-N 2 0 419.205 4.351 20 0 HIADRP CC(C)[N@@H+]1CCC[C@H](CNC(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000517140149 924021423 /nfs/dbraw/zinc/02/14/23/924021423.db2.gz DMCZIGUQUCJADN-BHIFYINESA-N 2 0 414.638 4.084 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cccc(OC(F)F)c2)CC1 ZINC000517545320 924257160 /nfs/dbraw/zinc/25/71/60/924257160.db2.gz KAVZKTWVXJOAJM-MRXNPFEDSA-N 2 0 407.480 4.420 20 0 HIADRP Cc1ccc(-c2ccc(C[NH2+]CCCC[NH+]3CCN(c4ncccn4)CC3)s2)cc1 ZINC000517548387 924260100 /nfs/dbraw/zinc/26/01/00/924260100.db2.gz OQPHKUSGWMRZNV-UHFFFAOYSA-N 2 0 421.614 4.206 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1)c1ccsc1 ZINC000518406854 927246944 /nfs/dbraw/zinc/24/69/44/927246944.db2.gz IIPOHVXPLKJFSS-VLCRHTCISA-N 2 0 414.619 4.266 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)[C@H]2CCC[N@H+](Cc3cccc(F)c3)C2)c1 ZINC000519445625 927953186 /nfs/dbraw/zinc/95/31/86/927953186.db2.gz PTFYRDUKIRLCAB-QHCPKHFHSA-N 2 0 411.565 4.196 20 0 HIADRP C[N@H+](Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)C2CC[NH+](C3CC3)CC2)CC1 ZINC000519558989 928015969 /nfs/dbraw/zinc/01/59/69/928015969.db2.gz SXBNTLUGMFAQQS-UHFFFAOYSA-N 2 0 423.523 4.003 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2cccc(Br)c2)CC1 ZINC000520044751 928269006 /nfs/dbraw/zinc/26/90/06/928269006.db2.gz SKQFEXYAABWRCI-MRXNPFEDSA-N 2 0 410.400 4.220 20 0 HIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)cc1 ZINC000520208757 928388933 /nfs/dbraw/zinc/38/89/33/928388933.db2.gz IMCKTZREIGMOOH-UHFFFAOYSA-N 2 0 417.601 4.386 20 0 HIADRP O=C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000520782643 928815414 /nfs/dbraw/zinc/81/54/14/928815414.db2.gz ZHBGTHMWHIREHN-VXKWHMMOSA-N 2 0 419.013 4.137 20 0 HIADRP O=C(NCCCCC[NH+]1CCCCC1)NCc1ccccc1C[NH+]1CCCCC1 ZINC000522062952 929626348 /nfs/dbraw/zinc/62/63/48/929626348.db2.gz NPWKCQLIXMUGRR-UHFFFAOYSA-N 2 0 400.611 4.128 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2cccc3cccnc32)CC1 ZINC000525183726 930079551 /nfs/dbraw/zinc/07/95/51/930079551.db2.gz CXRUTDBEFXHXGM-UHFFFAOYSA-N 2 0 414.475 4.295 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@H]2CCCC[N@@H+]2Cc2ccccc2)CC1 ZINC000525311568 930150555 /nfs/dbraw/zinc/15/05/55/930150555.db2.gz MNHISDMXARNQJB-SQJMNOBHSA-N 2 0 405.586 4.383 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000525398897 930218590 /nfs/dbraw/zinc/21/85/90/930218590.db2.gz RSKMRMMDYGQZMQ-QFIPXVFZSA-N 2 0 422.617 4.334 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccnc(N2CCCCCC2)c1)C1CC[NH+](C)CC1 ZINC000526116105 930537623 /nfs/dbraw/zinc/53/76/23/930537623.db2.gz XFTVVGYNCCRUPI-UHFFFAOYSA-N 2 0 421.633 4.282 20 0 HIADRP C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N(CC[NH+](C)C)CC[NH+](C)C)cc1 ZINC000526156097 930542735 /nfs/dbraw/zinc/54/27/35/930542735.db2.gz IZXGPQKKQTUKID-LJQANCHMSA-N 2 0 414.619 4.497 20 0 HIADRP C[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000527223042 930615498 /nfs/dbraw/zinc/61/54/98/930615498.db2.gz LJDIQXPHQPLGOC-FFGOWVMKSA-N 2 0 404.023 4.472 20 0 HIADRP COC(=O)c1cc2c(o1)c(OC)ccc2C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000530903782 930854444 /nfs/dbraw/zinc/85/44/44/930854444.db2.gz ABQLEJPYFFKFNU-UHFFFAOYSA-N 2 0 410.514 4.358 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NC[C@H](c1ccc(Cl)cc1)[NH+](C)C ZINC000531079047 930911566 /nfs/dbraw/zinc/91/15/66/930911566.db2.gz OIDJGLAVCDCSNL-JOCHJYFZSA-N 2 0 416.997 4.236 20 0 HIADRP CCN(C(=O)C1CCN(c2cc[nH+]cc2C)CC1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000531443067 931058785 /nfs/dbraw/zinc/05/87/85/931058785.db2.gz VVDQHNFDWDLTGC-ZJSXRUAMSA-N 2 0 420.601 4.290 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NC[C@H](CC(C)C)[NH2+][C@H](C)c2ccccc2)CC1 ZINC000531460433 931065652 /nfs/dbraw/zinc/06/56/52/931065652.db2.gz OXXJVHYAULMFOZ-QPPBQGQZSA-N 2 0 422.617 4.488 20 0 HIADRP CCCC(=O)Nc1cccc(C[NH2+]Cc2ccccc2N2CC[NH+](CCC)CC2)c1 ZINC000531532280 931095160 /nfs/dbraw/zinc/09/51/60/931095160.db2.gz VHFHPGAMLRHLHA-UHFFFAOYSA-N 2 0 408.590 4.247 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2cccc(Cl)c2F)c1)C1CCOCC1 ZINC000531594612 931113214 /nfs/dbraw/zinc/11/32/14/931113214.db2.gz ZFDUFBQEHXKMQZ-UHFFFAOYSA-N 2 0 406.929 4.259 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CCN(Cc2ccccn2)CC1 ZINC000531724869 931175098 /nfs/dbraw/zinc/17/50/98/931175098.db2.gz KIQUWPZSWPYIDV-UHFFFAOYSA-N 2 0 404.558 4.061 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(Br)cc1 ZINC000531738804 931179196 /nfs/dbraw/zinc/17/91/96/931179196.db2.gz XAJMOJUIYUKKIC-MRXNPFEDSA-N 2 0 403.364 4.257 20 0 HIADRP Cc1nc2ccccc2n1CCC[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000531851048 931220906 /nfs/dbraw/zinc/22/09/06/931220906.db2.gz PBRQNQSQZXRAGC-UHFFFAOYSA-N 2 0 405.590 4.055 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000531937515 931254214 /nfs/dbraw/zinc/25/42/14/931254214.db2.gz JGDDWDJCWKFTQA-AQNXPRMDSA-N 2 0 414.615 4.419 20 0 HIADRP O=C(c1ccccc1Cl)N1CCC([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000531943879 931256726 /nfs/dbraw/zinc/25/67/26/931256726.db2.gz VIVSPIQFRQSVAW-UHFFFAOYSA-N 2 0 411.977 4.330 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000531945067 931257723 /nfs/dbraw/zinc/25/77/23/931257723.db2.gz KEMUDLKPSBPSQH-OAHLLOKOSA-N 2 0 409.452 4.154 20 0 HIADRP Cc1nccn1-c1ccc([C@@H](C)NCc2nnc3ccc(C(F)(F)F)cn32)cc1 ZINC000531945968 931258064 /nfs/dbraw/zinc/25/80/64/931258064.db2.gz MWMBDZZSRCRCQD-CYBMUJFWSA-N 2 0 400.408 4.093 20 0 HIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)ccc1SC ZINC000531993226 931279565 /nfs/dbraw/zinc/27/95/65/931279565.db2.gz CYUWSLJMLWTJPS-KRWDZBQOSA-N 2 0 400.588 4.225 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@H](c1ccccc1)N1CCCC1)C1CC[NH+](C)CC1 ZINC000532107514 931315593 /nfs/dbraw/zinc/31/55/93/931315593.db2.gz RKIXCWGPXGADMD-AREMUKBSSA-N 2 0 406.618 4.144 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc2c(c1)OCCCO2 ZINC000532454429 931442596 /nfs/dbraw/zinc/44/25/96/931442596.db2.gz SBQIAXUMLUOXNM-VAMGGRTRSA-N 2 0 410.558 4.308 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C[C@@H](c1ccccc1Cl)N1CCCC1 ZINC000532461740 931445613 /nfs/dbraw/zinc/44/56/13/931445613.db2.gz QNXDIZZOTZSHDW-FOVJLYNBSA-N 2 0 413.009 4.372 20 0 HIADRP OC1(C(F)(F)F)CCC([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)CC1 ZINC000532513168 931469285 /nfs/dbraw/zinc/46/92/85/931469285.db2.gz PKDVJCGUCHPMFT-UHFFFAOYSA-N 2 0 404.904 4.378 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCC2(CC)CC[NH+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC000532814236 931637171 /nfs/dbraw/zinc/63/71/71/931637171.db2.gz VIXKAZJEYRTIFN-FYYLOGMGSA-N 2 0 414.638 4.051 20 0 HIADRP C(CN1CCC[C@H](C[NH+]2CCCCCC2)C1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000532950328 931708904 /nfs/dbraw/zinc/70/89/04/931708904.db2.gz IFWTVDRGGDBHPG-CLJLJLNGSA-N 2 0 418.714 4.162 20 0 HIADRP Clc1ccc(Cl)c(-c2csc(C[NH2+]CCCC[NH+]3CCOCC3)n2)c1 ZINC000533125855 931776227 /nfs/dbraw/zinc/77/62/27/931776227.db2.gz XAZIVOZRSZFYOA-UHFFFAOYSA-N 2 0 400.375 4.319 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1CN[C@H](C)c1ncc(Br)s1 ZINC000533783932 932030316 /nfs/dbraw/zinc/03/03/16/932030316.db2.gz QQCBAAOMLLJNAI-CQSZACIVSA-N 2 0 412.397 4.477 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@H](C2CC[NH+](C)CC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000534443289 932456809 /nfs/dbraw/zinc/45/68/09/932456809.db2.gz AFTPYAJTKFYCKQ-OFNKIYASSA-N 2 0 414.638 4.269 20 0 HIADRP CC(C)Oc1cccc(CN(C)[C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000534478873 932512803 /nfs/dbraw/zinc/51/28/03/932512803.db2.gz AGESJYSJMJOJDU-OAQYLSRUSA-N 2 0 423.601 4.075 20 0 HIADRP C[C@@H](C(=O)N(C)Cc1ccccc1)[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534964753 932863946 /nfs/dbraw/zinc/86/39/46/932863946.db2.gz BLZSUSALOKRNHK-QFIPXVFZSA-N 2 0 405.586 4.022 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ncc(Br)s3)CC2)cc1 ZINC000535989031 933548805 /nfs/dbraw/zinc/54/88/05/933548805.db2.gz PZQJOTIRGXETPJ-CQSZACIVSA-N 2 0 424.408 4.477 20 0 HIADRP COc1ccc([C@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)c(Br)c1 ZINC000537289457 933699653 /nfs/dbraw/zinc/69/96/53/933699653.db2.gz WTAQNVINCPHMHL-KRWDZBQOSA-N 2 0 424.427 4.059 20 0 HIADRP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000537305273 933706888 /nfs/dbraw/zinc/70/68/88/933706888.db2.gz KUHSMMAWIGRJTN-SFHVURJKSA-N 2 0 407.558 4.446 20 0 HIADRP Cc1cc([C@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2ccccc2Cl)ccc1F ZINC000537607017 938332262 /nfs/dbraw/zinc/33/22/62/938332262.db2.gz CRALIDSMGBOYBX-QHCPKHFHSA-N 2 0 403.973 4.494 20 0 HIADRP C[C@@H](NC(=O)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1Cl ZINC000537844399 938387984 /nfs/dbraw/zinc/38/79/84/938387984.db2.gz DYWCUKRYUBQZFI-GOSISDBHSA-N 2 0 414.981 4.151 20 0 HIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000537939521 938424673 /nfs/dbraw/zinc/42/46/73/938424673.db2.gz SRGXKDMWPOOVOW-IRFCIJBXSA-N 2 0 415.603 4.009 20 0 HIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1F ZINC000537962438 938436237 /nfs/dbraw/zinc/43/62/37/938436237.db2.gz ZKWXDXKQWCTZHQ-XXTHSBEZSA-N 2 0 404.570 4.218 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc(F)cc1Cl ZINC000537971113 938440449 /nfs/dbraw/zinc/44/04/49/938440449.db2.gz ZDWNVOVQKZKVGT-MRXNPFEDSA-N 2 0 403.929 4.156 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)C(c1ccccc1)c1ccccc1 ZINC000537970458 938440933 /nfs/dbraw/zinc/44/09/33/938440933.db2.gz VWJOZXXNRIDYLC-NRFANRHFSA-N 2 0 415.581 4.288 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](c2ccc3[nH]c(=O)oc3c2)C(C)C)CC1 ZINC000538061760 938491213 /nfs/dbraw/zinc/49/12/13/938491213.db2.gz IHHLRPCXJGFSPH-DEOSSOPVSA-N 2 0 422.573 4.158 20 0 HIADRP Cc1nc(CN2CCC(C[NH2+][C@@H](c3ccc4[nH]c(=O)oc4c3)C(C)C)CC2)oc1C ZINC000538098992 938501811 /nfs/dbraw/zinc/50/18/11/938501811.db2.gz OVAFIXWKUMKCEH-JOCHJYFZSA-N 2 0 412.534 4.337 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)c1 ZINC000538216977 938561009 /nfs/dbraw/zinc/56/10/09/938561009.db2.gz GXUIVDDXJGKEPR-JOCHJYFZSA-N 2 0 418.965 4.301 20 0 HIADRP C[C@H](CCc1ccc2c(c1)OCO2)[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538275579 938581198 /nfs/dbraw/zinc/58/11/98/938581198.db2.gz HKSVJVPWVYNNGR-WIYYLYMNSA-N 2 0 408.542 4.314 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCNc1ncc(Cl)cc1Cl)c1ccccc1O2 ZINC000538293672 938585095 /nfs/dbraw/zinc/58/50/95/938585095.db2.gz MJAVLWCRRPRYJS-SFHVURJKSA-N 2 0 421.372 4.378 20 0 HIADRP Cc1nccn1-c1ccc([C@H](C)Nc2ccc(N3CCC([NH+](C)C)CC3)cn2)cc1 ZINC000538590802 938656653 /nfs/dbraw/zinc/65/66/53/938656653.db2.gz SQKYENAMIOYQME-SFHVURJKSA-N 2 0 404.562 4.279 20 0 HIADRP C[C@H](Nc1cccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000538589588 938656662 /nfs/dbraw/zinc/65/66/62/938656662.db2.gz MPMMNFABMIWQIL-NJYVYQBISA-N 2 0 411.590 4.409 20 0 HIADRP C[C@@H](Nc1cccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000538589589 938656794 /nfs/dbraw/zinc/65/67/94/938656794.db2.gz MPMMNFABMIWQIL-QHAWAJNXSA-N 2 0 411.590 4.409 20 0 HIADRP CC[N@H+](CCC1CC[NH+]([C@@H](C)C(=O)N(C)Cc2cccc(F)c2)CC1)CC1CC1 ZINC000538948567 938745753 /nfs/dbraw/zinc/74/57/53/938745753.db2.gz IMTZCZNMRQAQQH-IBGZPJMESA-N 2 0 403.586 4.007 20 0 HIADRP CC[N@H+](CCC1CC[NH+](CC(=O)N(C)Cc2ccc(Cl)s2)CC1)CC1CC1 ZINC000538949081 938745901 /nfs/dbraw/zinc/74/59/01/938745901.db2.gz PIRJPNZWERHSRH-UHFFFAOYSA-N 2 0 412.043 4.194 20 0 HIADRP COc1ccc(NC(=O)C[C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000539045558 938781123 /nfs/dbraw/zinc/78/11/23/938781123.db2.gz BCPGJMZZRPPLDI-TUNNFDKTSA-N 2 0 409.574 4.303 20 0 HIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C3CCN(C(=O)NC4CCCCC4)CC3)CC2)C1 ZINC000539079047 938797375 /nfs/dbraw/zinc/79/73/75/938797375.db2.gz PASVXMLMGORLAW-XXBNENTESA-N 2 0 404.643 4.126 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)NC[C@H](c2cccs2)[NH+](C)C)CC1)CC(C)C ZINC000539178885 938816415 /nfs/dbraw/zinc/81/64/15/938816415.db2.gz RNBIFGHKCTWTLQ-HXUWFJFHSA-N 2 0 408.656 4.140 20 0 HIADRP C[C@@H]1C[NH+](CCOc2ccc(CC[NH2+]C3CC[NH+](C4CCCC4)CC3)cc2)C[C@H]1C ZINC000539296033 938835675 /nfs/dbraw/zinc/83/56/75/938835675.db2.gz WKCUQMGNXVISJD-FGZHOGPDSA-N 3 0 413.650 4.192 20 0 HIADRP C[C@@H]([NH2+]CCC[NH2+][C@H](C)c1ccc(-n2cccn2)cc1)c1ccc(-n2cccn2)cc1 ZINC000539343466 938845451 /nfs/dbraw/zinc/84/54/51/938845451.db2.gz YXAWHXGASRRLLV-NHCUHLMSSA-N 2 0 414.557 4.450 20 0 HIADRP COc1ccccc1N1CC[C@@H](C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C1 ZINC000539362917 938848685 /nfs/dbraw/zinc/84/86/85/938848685.db2.gz JLBQNCLJULXSTB-RBBKRZOGSA-N 2 0 421.585 4.099 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H](NC[C@@H]1CC[N@H+](CCc3ccccc3)C1)c1ccccc1O2 ZINC000539378183 938851601 /nfs/dbraw/zinc/85/16/01/938851601.db2.gz YMSOTQGYYREXFN-UKILVPOCSA-N 3 0 419.613 4.129 20 0 HIADRP Cc1c([C@@H](C)Nc2ccc(N3CC[C@@H]([NH+](C)C)C3)cn2)cnn1-c1ccc(F)cc1 ZINC000539658519 938895622 /nfs/dbraw/zinc/89/56/22/938895622.db2.gz AVGKFTBYGSYUKU-IIBYNOLFSA-N 2 0 408.525 4.028 20 0 HIADRP CCN(CC)C(=O)[C@H](c1ccccc1)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540045188 939048132 /nfs/dbraw/zinc/04/81/32/939048132.db2.gz IMAQCFOGUBTZIQ-DEOSSOPVSA-N 2 0 408.590 4.230 20 0 HIADRP Cc1ccc2nc(NC(=O)C[N@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)sc2c1 ZINC000540046219 939048444 /nfs/dbraw/zinc/04/84/44/939048444.db2.gz XTBOIWNQHXNNEE-UHFFFAOYSA-N 2 0 423.586 4.177 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc2c(c1)OCCCO2 ZINC000540194423 939120302 /nfs/dbraw/zinc/12/03/02/939120302.db2.gz HYDGDLSLHWDEJS-NRFANRHFSA-N 2 0 409.574 4.101 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000540317875 939191927 /nfs/dbraw/zinc/19/19/27/939191927.db2.gz JKECNABJVRLGCM-HSZRJFAPSA-N 2 0 411.977 4.407 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000540317877 939191953 /nfs/dbraw/zinc/19/19/53/939191953.db2.gz JKECNABJVRLGCM-QHCPKHFHSA-N 2 0 411.977 4.407 20 0 HIADRP CN(CC[N@H+](C)Cc1ccc(Oc2ccccc2F)c(F)c1)C1CC[NH+](C)CC1 ZINC000540336907 939198874 /nfs/dbraw/zinc/19/88/74/939198874.db2.gz XVPBMKKZUICDSG-UHFFFAOYSA-N 2 0 403.517 4.215 20 0 HIADRP C[C@H](C[NH2+][C@@H](c1ccccc1)[C@H]1CCOC1)C[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000540389410 939227921 /nfs/dbraw/zinc/22/79/21/939227921.db2.gz MLPMNIJQGVPLTD-RYQHEYBISA-N 2 0 408.586 4.357 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3c(C4CC4)nc4sccn34)CC2)c1 ZINC000540508545 939281082 /nfs/dbraw/zinc/28/10/82/939281082.db2.gz AHAKMVJQCKOKIR-UHFFFAOYSA-N 2 0 423.630 4.274 20 0 HIADRP c1c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(-c2ccncc2)nn1-c1ccccc1 ZINC000540648875 939330318 /nfs/dbraw/zinc/33/03/18/939330318.db2.gz IFMJGFYYDYRDLB-UHFFFAOYSA-N 2 0 424.552 4.336 20 0 HIADRP C[C@H](Nc1cccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000540790282 939373425 /nfs/dbraw/zinc/37/34/25/939373425.db2.gz YWVJBPSUPHYUAE-HBMCJLEFSA-N 2 0 411.590 4.409 20 0 HIADRP C[C@@]1([NH2+]CC(=O)Nc2cccc(C[NH+]3CCSCC3)c2)CCCc2ccccc21 ZINC000540906955 939415226 /nfs/dbraw/zinc/41/52/26/939415226.db2.gz ISEDTHKTGOTTFE-XMMPIXPASA-N 2 0 409.599 4.015 20 0 HIADRP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)CCCO2 ZINC000540989238 939426309 /nfs/dbraw/zinc/42/63/09/939426309.db2.gz OZLGOGKKDCIARW-DENIHFKCSA-N 2 0 400.950 4.219 20 0 HIADRP COc1cccc(C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccccc2)c1 ZINC000540990389 939426336 /nfs/dbraw/zinc/42/63/36/939426336.db2.gz JWQFXNYTDIMRRE-VPUSJEBWSA-N 2 0 416.565 4.335 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1OC(F)(F)F ZINC000540991042 939426797 /nfs/dbraw/zinc/42/67/97/939426797.db2.gz WZUVRKGDUYPSBL-LPHOPBHVSA-N 2 0 408.464 4.393 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+](CC(=O)Nc2ccc(N3CCCC3)cc2C)CC1 ZINC000541084773 939454380 /nfs/dbraw/zinc/45/43/80/939454380.db2.gz AUHHFFMYKDZHJX-UHFFFAOYSA-N 2 0 414.638 4.368 20 0 HIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCCc3nc(-c4ccc(F)cc4)no3)CC2)C1 ZINC000541553727 939553765 /nfs/dbraw/zinc/55/37/65/939553765.db2.gz MFWSHWHCJJKNQD-UTKZUKDTSA-N 2 0 400.542 4.441 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3ccc(Br)cc32)C1 ZINC000541915104 939652721 /nfs/dbraw/zinc/65/27/21/939652721.db2.gz XYEKEPYSEHHFBS-IRLDBZIGSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(Br)c(F)c1 ZINC000541917407 939653272 /nfs/dbraw/zinc/65/32/72/939653272.db2.gz NAYBGZJTHWSGCX-KBXCAEBGSA-N 2 0 407.327 4.006 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccccc1O2 ZINC000563715886 945263408 /nfs/dbraw/zinc/26/34/08/945263408.db2.gz MGOXIIKRZHDARJ-LJQANCHMSA-N 2 0 405.464 4.221 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000542306985 939793246 /nfs/dbraw/zinc/79/32/46/939793246.db2.gz LQAOGQMVRWHJIV-HTAPYJJXSA-N 2 0 413.928 4.151 20 0 HIADRP CC1(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)CC[NH+](Cc2ccccc2)CC1 ZINC000542487457 939831830 /nfs/dbraw/zinc/83/18/30/939831830.db2.gz YDVKRMMTBGKPOD-DEOSSOPVSA-N 2 0 405.586 4.242 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC000542670425 939853017 /nfs/dbraw/zinc/85/30/17/939853017.db2.gz FVSCLNMZVPNFMR-MDNUFGMLSA-N 2 0 406.636 4.182 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000542670424 939853049 /nfs/dbraw/zinc/85/30/49/939853049.db2.gz FVSCLNMZVPNFMR-AKIFATBCSA-N 2 0 406.636 4.182 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCOc2cc(Cl)ccc21 ZINC000542845671 939862391 /nfs/dbraw/zinc/86/23/91/939862391.db2.gz GUTRSEKEKNIVKZ-UNMCSNQZSA-N 2 0 400.950 4.300 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCOc2cc(Cl)ccc21 ZINC000542845663 939862498 /nfs/dbraw/zinc/86/24/98/939862498.db2.gz GUTRSEKEKNIVKZ-IFMALSPDSA-N 2 0 400.950 4.300 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccccc1Br ZINC000542848315 939862883 /nfs/dbraw/zinc/86/28/83/939862883.db2.gz XOCLSNIFUQHDRB-WIYYLYMNSA-N 2 0 403.364 4.257 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc(Cl)ccc1OC(F)F ZINC000542850169 939862986 /nfs/dbraw/zinc/86/29/86/939862986.db2.gz UPOUJFNLGXDZNP-KSSFIOAISA-N 2 0 410.892 4.359 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000543072986 939924105 /nfs/dbraw/zinc/92/41/05/939924105.db2.gz UMGLQJITMLUOOO-MRXNPFEDSA-N 2 0 422.411 4.410 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]C3CC(c4cccc(Cl)c4)C3)c2)C1 ZINC000543108545 939948336 /nfs/dbraw/zinc/94/83/36/939948336.db2.gz IXGRXBMQXNMSSA-HVIUMASTSA-N 2 0 411.977 4.073 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000543239871 940005415 /nfs/dbraw/zinc/00/54/15/940005415.db2.gz OHIUGNIOGXIPBJ-UHFFFAOYSA-N 2 0 415.472 4.257 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC([C@H]2C(=O)Nc3cc(Cl)ccc32)CC1 ZINC000543393387 940050353 /nfs/dbraw/zinc/05/03/53/940050353.db2.gz CKPHKYXFWPPIJA-JOCHJYFZSA-N 2 0 421.932 4.177 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000543401958 940052252 /nfs/dbraw/zinc/05/22/52/940052252.db2.gz YVFKBKKAHBKOCJ-HXUWFJFHSA-N 2 0 410.558 4.465 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000543401957 940052351 /nfs/dbraw/zinc/05/23/51/940052351.db2.gz YVFKBKKAHBKOCJ-FQEVSTJZSA-N 2 0 410.558 4.465 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000543416962 940058423 /nfs/dbraw/zinc/05/84/23/940058423.db2.gz HJMXVLFEKXLBRY-UHFFFAOYSA-N 2 0 407.602 4.447 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2c[nH]c3ccc(Br)cc23)[C@@H](C)C1 ZINC000543416747 940058547 /nfs/dbraw/zinc/05/85/47/940058547.db2.gz ZZQQNAOFEDFQIN-OXJNMPFZSA-N 2 0 422.411 4.200 20 0 HIADRP CCOc1ccc(C(=O)N2CCC([NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)cc1 ZINC000543759474 940177238 /nfs/dbraw/zinc/17/72/38/940177238.db2.gz AYLZQBRKTUSDMS-UHFFFAOYSA-N 2 0 413.606 4.077 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(F)cc1OC(F)F ZINC000543778052 940184592 /nfs/dbraw/zinc/18/45/92/940184592.db2.gz RUHNORGRXZOMTI-KXBFYZLASA-N 2 0 408.464 4.235 20 0 HIADRP COc1ccc(Oc2ccc(C[NH2+]C3CCN(C4CC[NH+](C)CC4)CC3)cc2)cc1 ZINC000544171300 940343383 /nfs/dbraw/zinc/34/33/83/940343383.db2.gz DXYONAFBDYIYSW-UHFFFAOYSA-N 2 0 409.574 4.136 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H](C)Cc1cc(Br)ccc1F ZINC000544180535 940346211 /nfs/dbraw/zinc/34/62/11/940346211.db2.gz DGAGBNNPIQUSBZ-CYBMUJFWSA-N 2 0 403.299 4.198 20 0 HIADRP C[NH+](C)CCOc1cccc(-c2noc([C@H]3CCC[N@H+](Cc4ccccc4)C3)n2)c1 ZINC000544780431 940513171 /nfs/dbraw/zinc/51/31/71/940513171.db2.gz OUUYNEDWXXKFKS-NRFANRHFSA-N 2 0 406.530 4.057 20 0 HIADRP CC[NH+](CC)C[C@@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000563977636 945333547 /nfs/dbraw/zinc/33/35/47/945333547.db2.gz FFBIYQYNOVTPAF-KUIDOIOASA-N 2 0 421.029 4.283 20 0 HIADRP Cc1ccc2[nH+]ccc(N3CCC(C(=O)NCC[N@@H+](C)Cc4ccccc4)CC3)c2c1 ZINC000546182347 940723693 /nfs/dbraw/zinc/72/36/93/940723693.db2.gz ITQBUXNSQVOYRF-UHFFFAOYSA-N 2 0 416.569 4.008 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000564007402 945345227 /nfs/dbraw/zinc/34/52/27/945345227.db2.gz COULEEAFGMBIRI-KTIWRFAQSA-N 2 0 406.618 4.184 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000564007401 945345698 /nfs/dbraw/zinc/34/56/98/945345698.db2.gz COULEEAFGMBIRI-CWDLOFLHSA-N 2 0 406.618 4.184 20 0 HIADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(N2CCOCC2)c1 ZINC000564007635 945345853 /nfs/dbraw/zinc/34/58/53/945345853.db2.gz KDGOFWWBGFDPBM-ISKFKSNPSA-N 2 0 407.602 4.476 20 0 HIADRP C[N@H+](CCC(=O)Nc1cccc(NC(=O)C[NH+]2CCCCCC2)c1)C1CCCCC1 ZINC000548388319 941099365 /nfs/dbraw/zinc/09/93/65/941099365.db2.gz OYBSHFUKXHAZOZ-UHFFFAOYSA-N 2 0 414.594 4.094 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483448 941108008 /nfs/dbraw/zinc/10/80/08/941108008.db2.gz MEIFUGFPOAAPHP-RDPSFJRHSA-N 2 0 414.553 4.334 20 0 HIADRP Cc1cc(C[NH+]2CCSCC2)ccc1NC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000548741511 941122461 /nfs/dbraw/zinc/12/24/61/941122461.db2.gz TXJIITWDAIEMFZ-UHFFFAOYSA-N 2 0 409.599 4.392 20 0 HIADRP C[C@H](c1ccc(F)cc1)N1CC[C@@H](N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)C1=O ZINC000549446483 941190755 /nfs/dbraw/zinc/19/07/55/941190755.db2.gz SUUJZZNNECMEFL-ISHFTEKXSA-N 2 0 401.570 4.074 20 0 HIADRP CCOc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1OC ZINC000549884114 941226415 /nfs/dbraw/zinc/22/64/15/941226415.db2.gz WBUMVWIRFZTKTM-QHCPKHFHSA-N 2 0 424.585 4.112 20 0 HIADRP COc1ccccc1/C=C/C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550263812 941305551 /nfs/dbraw/zinc/30/55/51/941305551.db2.gz XEHBADBXBJIASX-IWXKUNQBSA-N 2 0 406.570 4.227 20 0 HIADRP c1cc(-c2n[nH]cc2C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cs1 ZINC000550263026 941305886 /nfs/dbraw/zinc/30/58/86/941305886.db2.gz SPTFYGLKNDTGPV-QFIPXVFZSA-N 2 0 422.598 4.157 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+]Cc3ccc(OCC4CC4)cc3)C3(C2)CCOCC3)cc1 ZINC000550270863 941306888 /nfs/dbraw/zinc/30/68/88/941306888.db2.gz DXPUOJFBYTZJSF-VWLOTQADSA-N 2 0 420.597 4.494 20 0 HIADRP COc1cc(C)c(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1OC ZINC000550270346 941306977 /nfs/dbraw/zinc/30/69/77/941306977.db2.gz VQIFFBZKCFAANU-QHCPKHFHSA-N 2 0 424.585 4.031 20 0 HIADRP CCS(=O)(=O)c1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC000550421496 941324820 /nfs/dbraw/zinc/32/48/20/941324820.db2.gz DCTZZQSZIHNVDS-IBGZPJMESA-N 2 0 400.588 4.317 20 0 HIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)cc1Cl ZINC000551534620 941497059 /nfs/dbraw/zinc/49/70/59/941497059.db2.gz XRIIZIIVIZYOSO-QGZVFWFLSA-N 2 0 424.029 4.405 20 0 HIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)cc1Cl ZINC000551534385 941497250 /nfs/dbraw/zinc/49/72/50/941497250.db2.gz NODCGWPIHJOTGQ-QGZVFWFLSA-N 2 0 402.970 4.125 20 0 HIADRP CC[C@@H](C(=O)N(C)C[C@@H]1CC[NH+](Cc2ccc(C)s2)C1)[N@H+](C)Cc1ccccc1 ZINC000552133760 941591267 /nfs/dbraw/zinc/59/12/67/941591267.db2.gz ROVZJDOPVNHAJW-GMAHTHKFSA-N 2 0 413.631 4.247 20 0 HIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000552263975 941617237 /nfs/dbraw/zinc/61/72/37/941617237.db2.gz UNDWNBHYFLDCLB-ZEQKJWHPSA-N 2 0 401.554 4.486 20 0 HIADRP Cc1c(C)c(NC(=O)c2ccc3c[nH+]cn3c2)ccc1NC(=O)c1ccc2c[nH+]cn2c1 ZINC000552955095 941807374 /nfs/dbraw/zinc/80/73/74/941807374.db2.gz MWCCVTSWYXZAQZ-UHFFFAOYSA-N 2 0 424.464 4.103 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1cccc2ccccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554448657 942147638 /nfs/dbraw/zinc/14/76/38/942147638.db2.gz ZWUKMKDWEKYUFF-OYDLWJJNSA-N 2 0 404.554 4.080 20 0 HIADRP C[NH+](C)CCOc1ccccc1-c1noc(-c2ccc(C[NH+]3CCCCC3)cc2)n1 ZINC000554804500 942248568 /nfs/dbraw/zinc/24/85/68/942248568.db2.gz MYTZYEPNUZIQHU-UHFFFAOYSA-N 2 0 406.530 4.330 20 0 HIADRP Cc1cc2ncn(C[C@H](O)C[NH2+]Cc3ccc(C[N@H+]4CCCC[C@@H]4C)cc3)c2cc1C ZINC000554863411 942297619 /nfs/dbraw/zinc/29/76/19/942297619.db2.gz RQDHSDNBVGDFDD-XUZZJYLKSA-N 2 0 420.601 4.178 20 0 HIADRP COc1cc(CC[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)ccc1Cl ZINC000555637259 942684406 /nfs/dbraw/zinc/68/44/06/942684406.db2.gz CZJXKDLUYSLSLN-UHFFFAOYSA-N 2 0 401.982 4.211 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000556169811 942814019 /nfs/dbraw/zinc/81/40/19/942814019.db2.gz FVQIRPVQUNYBMU-WMZOPIPTSA-N 2 0 421.404 4.244 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1 ZINC000556240625 942825074 /nfs/dbraw/zinc/82/50/74/942825074.db2.gz PAFDIIKPHYTOSZ-WZDPVOGJSA-N 2 0 421.629 4.310 20 0 HIADRP CCOc1ccccc1NC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000556244657 942825833 /nfs/dbraw/zinc/82/58/33/942825833.db2.gz GQDOXARLDGTTMS-HXUWFJFHSA-N 2 0 409.574 4.434 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+]CCCc3ccc4c(c3)CCO4)C3(C2)CCOCC3)cc1 ZINC000556936420 942972265 /nfs/dbraw/zinc/97/22/65/942972265.db2.gz OONAQGPEPWRGAO-VWLOTQADSA-N 2 0 420.597 4.073 20 0 HIADRP Cc1ccc(C[N@H+]2CC[C@@H](CN(C)C(=O)[C@@H]3CCC[NH+]3Cc3ccccc3)C2)s1 ZINC000557387383 943097306 /nfs/dbraw/zinc/09/73/06/943097306.db2.gz MYDJFJIIEPNGCY-GMAHTHKFSA-N 2 0 411.615 4.001 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+]([C@@H](C)c2ccc(Br)cc2)CC1 ZINC000558416239 943553658 /nfs/dbraw/zinc/55/36/58/943553658.db2.gz ODBVCDCPBZKLMO-KRWDZBQOSA-N 2 0 424.427 4.070 20 0 HIADRP CC[C@@H](C)[N@H+](C)CCNC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000558770413 943653984 /nfs/dbraw/zinc/65/39/84/943653984.db2.gz AVJNVFPNNUTWER-KUIDOIOASA-N 2 0 421.029 4.283 20 0 HIADRP Cc1ccc(C[NH+]2CCC(CC[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c(-c2ccnn2C)c1 ZINC000559068593 943822839 /nfs/dbraw/zinc/82/28/39/943822839.db2.gz YFDOIQPZJYHARS-NHCUHLMSSA-N 2 0 410.606 4.107 20 0 HIADRP c1ccc([C@H](C[C@@H]2CCOC2)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc1 ZINC000559147369 943853940 /nfs/dbraw/zinc/85/39/40/943853940.db2.gz VRNUCBDUAMSZMU-OZXSUGGESA-N 2 0 407.602 4.346 20 0 HIADRP CCc1cc(OC)ccc1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000559331901 943897728 /nfs/dbraw/zinc/89/77/28/943897728.db2.gz FBPULMBAWSQCMR-DEOSSOPVSA-N 2 0 408.586 4.276 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]CCc1ccc(Br)cc1Cl ZINC000559358178 943908702 /nfs/dbraw/zinc/90/87/02/943908702.db2.gz ISENZGARTLTXMX-UHFFFAOYSA-N 2 0 405.727 4.324 20 0 HIADRP Oc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CCC2 ZINC000559892591 944077643 /nfs/dbraw/zinc/07/76/43/944077643.db2.gz YFOODILEYSPRQK-RCZVLFRGSA-N 2 0 406.570 4.288 20 0 HIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)ccn1 ZINC000559894940 944079156 /nfs/dbraw/zinc/07/91/56/944079156.db2.gz OMGFERBENCYTEF-NRFANRHFSA-N 2 0 416.569 4.263 20 0 HIADRP CCS(=O)(=O)c1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000560266430 944212282 /nfs/dbraw/zinc/21/22/82/944212282.db2.gz XYXAFYHUSXQLCU-JQVVWYNYSA-N 2 0 400.588 4.041 20 0 HIADRP CCC1(C[NH2+][C@@H](C)c2ccc3c(c2)OCC(=O)N3)CC[NH+](Cc2ccccc2)CC1 ZINC000560546759 944250439 /nfs/dbraw/zinc/25/04/39/944250439.db2.gz WNHTYKYLYVYZAE-IBGZPJMESA-N 2 0 407.558 4.361 20 0 HIADRP C[S@](=O)Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000560558426 944254855 /nfs/dbraw/zinc/25/48/55/944254855.db2.gz QNVLAYIGXPPGLC-IKOOFXLXSA-N 2 0 410.627 4.346 20 0 HIADRP COc1ccccc1-c1ccc(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)cc1 ZINC000564250358 945467418 /nfs/dbraw/zinc/46/74/18/945467418.db2.gz DJRHECPEIIUXRO-VSGJHWFKSA-N 2 0 405.586 4.105 20 0 HIADRP CN1CC[NH+](CC2CC[NH+](Cc3ccc(-c4cccc(C(F)(F)F)c4)o3)CC2)CC1 ZINC000564319327 945513847 /nfs/dbraw/zinc/51/38/47/945513847.db2.gz HYXXDJKRGVDNNU-UHFFFAOYSA-N 2 0 421.507 4.425 20 0 HIADRP CSC1(C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC[NH+](C)CC1 ZINC000564418084 945569252 /nfs/dbraw/zinc/56/92/52/945569252.db2.gz BRZGSOBMONSZMX-UHFFFAOYSA-N 2 0 406.599 4.456 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)C2CC[NH+](C3CC3)CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000565150723 945789612 /nfs/dbraw/zinc/78/96/12/945789612.db2.gz LBBDJZNHUPKIHS-RXVVDRJESA-N 2 0 423.523 4.079 20 0 HIADRP O[C@H](C[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)COCc1ccc(Cl)cc1 ZINC000567188077 946263965 /nfs/dbraw/zinc/26/39/65/946263965.db2.gz ZKWFLVZBUKNPCA-ISKFKSNPSA-N 2 0 416.993 4.109 20 0 HIADRP CCOc1c(Br)cc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1OC ZINC000567280633 946290209 /nfs/dbraw/zinc/29/02/09/946290209.db2.gz MGVPKFJAWKFWPY-QGZVFWFLSA-N 2 0 411.384 4.020 20 0 HIADRP O=C(C[NH2+][C@@H](c1ccccc1)[C@@H]1CCCc2ccccc21)NC1CC[NH+](C2CC2)CC1 ZINC000569272626 946847216 /nfs/dbraw/zinc/84/72/16/946847216.db2.gz DCAZHRIPGYEQMO-VPUSJEBWSA-N 2 0 417.597 4.180 20 0 HIADRP C[NH+](C)C[C@@H](NC(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccc(Cl)cc1 ZINC000572902961 948034386 /nfs/dbraw/zinc/03/43/86/948034386.db2.gz YUNZJTPBELPMRB-OAQYLSRUSA-N 2 0 407.002 4.039 20 0 HIADRP CC[C@@H](C(=O)N[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000572969984 948048915 /nfs/dbraw/zinc/04/89/15/948048915.db2.gz WQRXTSKHTQFSNE-GOTSBHOMSA-N 2 0 421.585 4.001 20 0 HIADRP CC[NH+]1CCC(C[NH2+][C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000574110159 948367044 /nfs/dbraw/zinc/36/70/44/948367044.db2.gz KRGAJKQECHAGJP-JOCHJYFZSA-N 2 0 421.006 4.154 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3CCC[C@]4(C[C@H](c5ccccc5)CO4)C3)c2)CC1 ZINC001164774581 721061563 /nfs/dbraw/zinc/06/15/63/721061563.db2.gz WSTZWXGNOSHWLE-OFVILXPXSA-N 2 0 407.558 4.098 20 0 HIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[NH+](CCOc3ccccc3)CC2)nc1 ZINC001165043962 721961633 /nfs/dbraw/zinc/96/16/33/721961633.db2.gz AWQGBCQCZCMNCO-XMMPIXPASA-N 2 0 408.590 4.220 20 0 HIADRP COc1ccc([C@H](CNC(=O)Nc2cccc(C[NH+](C)C)c2)[NH+]2CCCCC2)cc1 ZINC000044293534 848540376 /nfs/dbraw/zinc/54/03/76/848540376.db2.gz LXSGLLYAWRLVQU-QHCPKHFHSA-N 2 0 410.562 4.106 20 0 HIADRP COc1ccccc1[C@@H](CNC(=O)Nc1cccc(C[NH+](C)C)c1)[NH+]1CCCCC1 ZINC000048076538 849160513 /nfs/dbraw/zinc/16/05/13/849160513.db2.gz OEZABWGZTIOCLB-JOCHJYFZSA-N 2 0 410.562 4.106 20 0 HIADRP Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C[NH2+]CCCC[NH+]2CCOCC2)c1 ZINC000060979334 851265470 /nfs/dbraw/zinc/26/54/70/851265470.db2.gz FTRYYCBJKRLRCJ-UHFFFAOYSA-N 2 0 422.548 4.189 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCC2)c1)NCc1ccccc1C[NH+]1CCCCC1 ZINC000061553432 851403826 /nfs/dbraw/zinc/40/38/26/851403826.db2.gz GGKWJMBCDQNDSV-UHFFFAOYSA-N 2 0 420.601 4.268 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)c1ccc(N2CC[NH+](C(C)C)CC2)cc1)c1ccccc1 ZINC000065749814 852244449 /nfs/dbraw/zinc/24/44/49/852244449.db2.gz VSVZJTMFTFUIGX-RUZDIDTESA-N 2 0 422.617 4.030 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1)c1ccsc1 ZINC000065866876 852291487 /nfs/dbraw/zinc/29/14/87/852291487.db2.gz HGJIKVXGAPRCHL-SIKLNZKXSA-N 2 0 417.594 4.299 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H](NC(=O)c1cccc(C[NH+]3CCCC3)c1)c1ccccc1O2 ZINC000195651820 853738538 /nfs/dbraw/zinc/73/85/38/853738538.db2.gz MCODRZVHPJFZHJ-QHCPKHFHSA-N 2 0 419.569 4.000 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]CCc2nc(-c3ccccn3)cs2)CC1 ZINC000236813557 853925515 /nfs/dbraw/zinc/92/55/15/853925515.db2.gz PZXKYEMAFXLBHD-UHFFFAOYSA-N 2 0 421.614 4.069 20 0 HIADRP COc1cc(C[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)ccc1OCc1ccncc1 ZINC000237315570 854004566 /nfs/dbraw/zinc/00/45/66/854004566.db2.gz SASNPPOQVJNGHK-UHFFFAOYSA-N 2 0 409.505 4.160 20 0 HIADRP COc1cccc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1OC(F)F ZINC000237388483 854020125 /nfs/dbraw/zinc/02/01/25/854020125.db2.gz QDQZEQSWMCUKPM-CALCHBBNSA-N 2 0 420.500 4.196 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2cc(Br)ccc2F)C[C@H](C)O1 ZINC000237620355 854063936 /nfs/dbraw/zinc/06/39/36/854063936.db2.gz DJGAHCLLEYGUJV-IYBDPMFKSA-N 2 0 421.354 4.487 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2CNc2ccnc3cc(Br)ccc32)C1 ZINC000302043529 854520779 /nfs/dbraw/zinc/52/07/79/854520779.db2.gz JFVLZAWXCXIYHB-SFHVURJKSA-N 2 0 412.331 4.176 20 0 HIADRP CC[NH+]1CCN([C@@H]2CCN(c3cc[nH+]c4ccc(Oc5ccccc5)cc43)C2)CC1 ZINC000302914438 854676901 /nfs/dbraw/zinc/67/69/01/854676901.db2.gz VDWAXQTTXQVFCD-HXUWFJFHSA-N 2 0 402.542 4.243 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NCC(C)(C)[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC000303647570 855103239 /nfs/dbraw/zinc/10/32/39/855103239.db2.gz JNLNIBQGPPTCNC-WOJBJXKFSA-N 2 0 400.611 4.022 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NCC(C)(C)[NH+]2C[C@H](C)C[C@@H](C)C2)CC1 ZINC000303688209 855133758 /nfs/dbraw/zinc/13/37/58/855133758.db2.gz UMIQLHLKBHXCAZ-NJYVYQBISA-N 2 0 414.638 4.268 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)c1 ZINC000303704590 855143029 /nfs/dbraw/zinc/14/30/29/855143029.db2.gz XXIKMHAMNWBRDC-FQEVSTJZSA-N 2 0 408.590 4.163 20 0 HIADRP CC(C)(C)OC(=O)N1CCC(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000390785132 855457364 /nfs/dbraw/zinc/45/73/64/855457364.db2.gz VYGPNSBSUXJBFW-UHFFFAOYSA-N 2 0 401.595 4.135 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc(I)c1 ZINC000398013738 855474171 /nfs/dbraw/zinc/47/41/71/855474171.db2.gz FBZSDXYUCAAEJF-JXFKEZNVSA-N 2 0 420.338 4.291 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NCCCC[NH+]2C[C@@H](C)C[C@H](C)C2)CC1 ZINC000410330806 855933113 /nfs/dbraw/zinc/93/31/13/855933113.db2.gz QCIREKNDIVPKPP-SFTDATJTSA-N 2 0 414.638 4.017 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@H](c2cccs2)[NH+](C)C)cc1 ZINC000410336872 855935243 /nfs/dbraw/zinc/93/52/43/855935243.db2.gz KAKPRMCCHMIDTJ-GHTZIAJQSA-N 2 0 414.619 4.225 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NC[C@H](c3ccco3)[NH+]3CCCC3)cc2)CC1 ZINC000410340653 855938304 /nfs/dbraw/zinc/93/83/04/855938304.db2.gz ZLXCFURFSBZLGU-HSZRJFAPSA-N 2 0 424.589 4.148 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC000410358579 855948657 /nfs/dbraw/zinc/94/86/57/855948657.db2.gz GSGZIEQQWVOSHV-JOCHJYFZSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NCCCC[NH+]2CCCC[C@@H]2C)C1 ZINC000410360662 855949718 /nfs/dbraw/zinc/94/97/18/855949718.db2.gz SCYKTYXNNBNJLQ-VXKWHMMOSA-N 2 0 414.638 4.372 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C[C@@H](C)O1 ZINC000425960564 856018513 /nfs/dbraw/zinc/01/85/13/856018513.db2.gz XVCPTKCGMICMCD-DNVFCKCGSA-N 2 0 401.982 4.498 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)ccn1 ZINC000426025862 856055280 /nfs/dbraw/zinc/05/52/80/856055280.db2.gz WVWOFYUMBYJCLH-QFIPXVFZSA-N 2 0 410.949 4.144 20 0 HIADRP COc1ccc(CC[C@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1O ZINC000426357816 856258262 /nfs/dbraw/zinc/25/82/62/856258262.db2.gz FICZIQZTNRDWHC-SLFFLAALSA-N 2 0 412.574 4.121 20 0 HIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 ZINC000427704455 856916221 /nfs/dbraw/zinc/91/62/21/856916221.db2.gz DGASBOPAXSAEKN-FQEVSTJZSA-N 2 0 407.480 4.251 20 0 HIADRP C[C@H]1C[C@H](NC(=O)NC2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000428121451 857079766 /nfs/dbraw/zinc/07/97/66/857079766.db2.gz XJCNQNRNICPSFF-SQJMNOBHSA-N 2 0 420.601 4.003 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)NC2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000428121448 857079870 /nfs/dbraw/zinc/07/98/70/857079870.db2.gz XJCNQNRNICPSFF-BWKNWUBXSA-N 2 0 420.601 4.003 20 0 HIADRP CN(C)C(=O)c1cccc(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000428229582 857119988 /nfs/dbraw/zinc/11/99/88/857119988.db2.gz OZGIDQPMDQTTNR-TWJOJJKGSA-N 2 0 419.613 4.211 20 0 HIADRP CC(=O)Nc1ccc(CC[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000428229368 857120289 /nfs/dbraw/zinc/12/02/89/857120289.db2.gz OPEJBCOQARVWNK-LGPLSSKUSA-N 2 0 405.586 4.468 20 0 HIADRP Cn1cc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c(C(F)(F)F)n1 ZINC000428457424 857210138 /nfs/dbraw/zinc/21/01/38/857210138.db2.gz WZDCZGVOQWLERX-MISYRCLQSA-N 2 0 406.496 4.219 20 0 HIADRP Fc1ccc2nc(C[NH2+]CCCC[NH+]3CCN(Cc4ccccc4)CC3)sc2c1 ZINC000428879681 857384138 /nfs/dbraw/zinc/38/41/38/857384138.db2.gz CXTZQWBOGHWZTK-UHFFFAOYSA-N 2 0 412.578 4.123 20 0 HIADRP c1cc(C[NH+]2CCOC[C@@H](C3CCC3)C2)cc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)c1 ZINC000428998716 857450174 /nfs/dbraw/zinc/45/01/74/857450174.db2.gz DGNLJEUBCHXZPW-UIOOFZCWSA-N 2 0 412.618 4.184 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H]2c3cccc(Br)c3CC2(C)C)CC1 ZINC000429402765 857645942 /nfs/dbraw/zinc/64/59/42/857645942.db2.gz HQZUSYNJDVNZLN-HXUWFJFHSA-N 2 0 408.428 4.078 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cc(Cl)ccc1OCC1CC1 ZINC000430011210 857996195 /nfs/dbraw/zinc/99/61/95/857996195.db2.gz GLHPSCJZZSAOFR-HSZRJFAPSA-N 2 0 414.977 4.375 20 0 HIADRP COc1ccccc1-n1nccc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000430017412 857999191 /nfs/dbraw/zinc/99/91/91/857999191.db2.gz ACWCDNOSHUZZLO-FQEVSTJZSA-N 2 0 404.558 4.403 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000430669723 858260734 /nfs/dbraw/zinc/26/07/34/858260734.db2.gz ULBZCNLQSYJRER-IEZKXTBUSA-N 2 0 405.586 4.068 20 0 HIADRP Cc1cc(C)cc(OCCC[N@@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c1 ZINC000430913836 858368173 /nfs/dbraw/zinc/36/81/73/858368173.db2.gz YNCMAXVNODUKKI-UHFFFAOYSA-N 2 0 401.639 4.200 20 0 HIADRP COCCC[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(Br)cc1 ZINC000432439422 859165411 /nfs/dbraw/zinc/16/54/11/859165411.db2.gz GMWAGWPSGZQEKW-PXNSSMCTSA-N 2 0 413.400 4.007 20 0 HIADRP C[C@H](C(=O)N(C)Cc1ccccc1)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433052839 859501752 /nfs/dbraw/zinc/50/17/52/859501752.db2.gz MUPYNNNGGLGVGS-JOCHJYFZSA-N 2 0 405.586 4.022 20 0 HIADRP CC(=O)c1ccc(NC(=O)CC[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000433171832 859552622 /nfs/dbraw/zinc/55/26/22/859552622.db2.gz BKQVQHPBPQBCRS-UHFFFAOYSA-N 2 0 419.569 4.206 20 0 HIADRP CN(C(=O)C1CC[NH+](Cc2ccccc2)CC1)c1ccc(OCC[NH+]2CCCC2)cc1 ZINC000434174464 860167934 /nfs/dbraw/zinc/16/79/34/860167934.db2.gz SWMHQHZVGYMEIP-UHFFFAOYSA-N 2 0 421.585 4.036 20 0 HIADRP O=C(NC[C@H]1CCC[N@@H+]1C1CCCCC1)Nc1nc(CN2CCCCC2)cs1 ZINC000435768595 861045030 /nfs/dbraw/zinc/04/50/30/861045030.db2.gz FCKMBPNUYVKPMI-LJQANCHMSA-N 2 0 405.612 4.048 20 0 HIADRP Cc1ccc(NC(=O)N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)c(OCC[NH+](C)C)c1 ZINC000438296365 863775659 /nfs/dbraw/zinc/77/56/59/863775659.db2.gz DANRRYQTSQZWNA-NHCUHLMSSA-N 2 0 416.610 4.054 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cccc(CN3CCOCC3)c2)CC1 ZINC000438828291 864322695 /nfs/dbraw/zinc/32/26/95/864322695.db2.gz GDICICTTXPOSJR-UHFFFAOYSA-N 2 0 407.602 4.052 20 0 HIADRP COc1cc(NC(C)=O)ccc1[C@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000439082624 864531195 /nfs/dbraw/zinc/53/11/95/864531195.db2.gz DRARNMGDRBCWCA-INIZCTEOSA-N 2 0 401.576 4.278 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H](c2ccc(Br)s2)C2CC2)C[C@@H](C)O1 ZINC000439139676 864572443 /nfs/dbraw/zinc/57/24/43/864572443.db2.gz YOEWFJPVUNXZLC-LBTNJELSSA-N 2 0 401.414 4.441 20 0 HIADRP Cc1ccc(N[C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1NC(=O)CC[NH+](C)C ZINC000468033853 881865590 /nfs/dbraw/zinc/86/55/90/881865590.db2.gz OYGITCMXHIYTLW-OEMFJLHTSA-N 2 0 420.601 4.208 20 0 HIADRP O=C(NCC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000468045608 881873258 /nfs/dbraw/zinc/87/32/58/881873258.db2.gz WFJVHWDPLKTGKU-VWLOTQADSA-N 2 0 405.586 4.070 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[NH+]1Cc1ccccc1 ZINC000440528057 865804928 /nfs/dbraw/zinc/80/49/28/865804928.db2.gz ATZBWVVLYCNPQD-DQEYMECFSA-N 2 0 405.586 4.022 20 0 HIADRP c1cc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)ccc1C[NH+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441274696 866349816 /nfs/dbraw/zinc/34/98/16/866349816.db2.gz HBHMWEYOVAACHI-XDZVQPMWSA-N 2 0 412.618 4.184 20 0 HIADRP Cc1ccccc1[C@H](OC[C@H](O)C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1)c1ccccc1 ZINC000441455371 866531792 /nfs/dbraw/zinc/53/17/92/866531792.db2.gz YPBGUXFOZDBQLG-VXQMPNGUSA-N 2 0 422.613 4.270 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CCN1CC[N@H+](C)C(C)(C)C1 ZINC000442865747 867705271 /nfs/dbraw/zinc/70/52/71/867705271.db2.gz GIOQZKUMZLOBPM-HNNXBMFYSA-N 2 0 407.027 4.449 20 0 HIADRP CC[N@H+](Cc1c[nH]c2ccccc12)[C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000442895428 867725817 /nfs/dbraw/zinc/72/58/17/867725817.db2.gz UWQVNJNQCYWKSP-FQEVSTJZSA-N 2 0 418.585 4.159 20 0 HIADRP Cc1ccc(C[NH2+]Cc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)cc1Cl ZINC000443962564 868496216 /nfs/dbraw/zinc/49/62/16/868496216.db2.gz GIEFHEMGMJDUIZ-UHFFFAOYSA-N 2 0 402.966 4.428 20 0 HIADRP O=C(CC[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1)N[C@@H](c1cccs1)c1ccccc1 ZINC000444214560 868670600 /nfs/dbraw/zinc/67/06/00/868670600.db2.gz RRQHTFDCQNIQCQ-HYBUGGRVSA-N 2 0 411.615 4.152 20 0 HIADRP CN(CC1([NH+](C)C)CCC1)C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000446125251 870070282 /nfs/dbraw/zinc/07/02/82/870070282.db2.gz GCYSTACXIUORMQ-UHFFFAOYSA-N 2 0 408.590 4.041 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000446572018 870483172 /nfs/dbraw/zinc/48/31/72/870483172.db2.gz MCZCMAGNWCPQBA-UHFFFAOYSA-N 2 0 408.590 4.488 20 0 HIADRP COc1ccc([C@H](CNC(=O)Nc2ccccc2CC[NH+](C)C)[NH+]2CCCCC2)cc1 ZINC000446577069 870488254 /nfs/dbraw/zinc/48/82/54/870488254.db2.gz JTNJTYIMZWJSFD-DEOSSOPVSA-N 2 0 424.589 4.148 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1 ZINC000446580544 870489204 /nfs/dbraw/zinc/48/92/04/870489204.db2.gz MYLBNKDKOPJSCZ-UHFFFAOYSA-N 2 0 402.970 4.040 20 0 HIADRP CCN(C(=O)Nc1ccccc1CC[NH+](C)C)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000446588195 870495913 /nfs/dbraw/zinc/49/59/13/870495913.db2.gz YGZUJPLAGAPEFX-NFBKMPQASA-N 2 0 408.590 4.480 20 0 HIADRP Cc1ccc([C@@H](CCn2cncn2)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000446757617 870670596 /nfs/dbraw/zinc/67/05/96/870670596.db2.gz VEVVIGQEENEBOA-RUZDIDTESA-N 2 0 403.574 4.220 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccc(Br)cc1Cl)C1CC1 ZINC000446820311 870734829 /nfs/dbraw/zinc/73/48/29/870734829.db2.gz BGLCYVLGKDTURV-LPHOPBHVSA-N 2 0 415.803 4.380 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000446827419 870742923 /nfs/dbraw/zinc/74/29/23/870742923.db2.gz OCVMPGAZKHQULX-UHFFFAOYSA-N 2 0 416.447 4.390 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)CCCS2 ZINC000446915282 870831429 /nfs/dbraw/zinc/83/14/29/870831429.db2.gz UMHGHWBIIAXMGG-NZQKXSOJSA-N 2 0 412.599 4.369 20 0 HIADRP COC(=O)[C@@](C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(F)cc1 ZINC000447089643 870982587 /nfs/dbraw/zinc/98/25/87/870982587.db2.gz JHLVQQSVUFBBFX-UNPSAXADSA-N 2 0 410.533 4.042 20 0 HIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c2ccccc21 ZINC000447531213 871394828 /nfs/dbraw/zinc/39/48/28/871394828.db2.gz QGMSLAAXSOBIMJ-ZODMCCGTSA-N 2 0 405.586 4.358 20 0 HIADRP COc1ccccc1N1CCC([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000447543767 871412780 /nfs/dbraw/zinc/41/27/80/871412780.db2.gz SDZAALXHVDNNIV-JOZNFPNDSA-N 2 0 405.586 4.449 20 0 HIADRP Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)[NH2+]CCOCC[NH+](C)C ZINC000447592750 871497743 /nfs/dbraw/zinc/49/77/43/871497743.db2.gz NNIRWJHMQWSFDK-CYBMUJFWSA-N 2 0 412.397 4.110 20 0 HIADRP OC[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1cc(F)c(F)c(F)c1 ZINC000447608102 871516144 /nfs/dbraw/zinc/51/61/44/871516144.db2.gz UKUIIKQNDBZTKL-BURNTYAHSA-N 2 0 418.503 4.040 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)[C@H](C)C1 ZINC000448524016 872516453 /nfs/dbraw/zinc/51/64/53/872516453.db2.gz CYFBAVYLVKSKMZ-SJBKTWHCSA-N 2 0 400.611 4.022 20 0 HIADRP CC(C)[C@H](CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C1CC[NH+](C)CC1)[NH+](C)C ZINC000468654165 882789742 /nfs/dbraw/zinc/78/97/42/882789742.db2.gz UJRSPMFCBBVFIO-FQEVSTJZSA-N 2 0 414.421 4.250 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCCC2)cc1)N1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000461432443 874475538 /nfs/dbraw/zinc/47/55/38/874475538.db2.gz UPKLJKXGOHNTHQ-FTJBHMTQSA-N 2 0 417.597 4.267 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)N1C[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000461435172 874485942 /nfs/dbraw/zinc/48/59/42/874485942.db2.gz VXRQFFVTEMANDU-LEWJYISDSA-N 2 0 417.553 4.089 20 0 HIADRP Cc1ccc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)c(-n2cc(Cl)cn2)n1 ZINC000468808927 882870335 /nfs/dbraw/zinc/87/03/35/882870335.db2.gz DJVPXFOKTMFNTL-QGZVFWFLSA-N 2 0 413.953 4.020 20 0 HIADRP C[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)N(C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000461723814 874871430 /nfs/dbraw/zinc/87/14/30/874871430.db2.gz JEWNCVUGFFRPFJ-RQTOMXEWSA-N 2 0 422.617 4.201 20 0 HIADRP CC[NH+]1CCC(CC[NH2+]Cc2c(C)nn(-c3ccc(Br)cc3)c2C)CC1 ZINC000462756271 875821478 /nfs/dbraw/zinc/82/14/78/875821478.db2.gz RWFOXAHVSKKONM-UHFFFAOYSA-N 2 0 419.411 4.463 20 0 HIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000462800305 875848667 /nfs/dbraw/zinc/84/86/67/875848667.db2.gz DMVYRTOFKWPYBF-IBGZPJMESA-N 2 0 420.601 4.305 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@@H]2CCO[C@@]3(CCOC3)C2)c2ccc(F)cc2)CC1 ZINC000462802430 875850351 /nfs/dbraw/zinc/85/03/51/875850351.db2.gz NDAIDAYYLNXFSM-SGNDLWITSA-N 2 0 404.570 4.307 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+]C2CCN(Cc3ccccc3Cl)CC2)cc1 ZINC000463129875 876175640 /nfs/dbraw/zinc/17/56/40/876175640.db2.gz DCJRVFDBHOKYAU-UHFFFAOYSA-N 2 0 401.982 4.035 20 0 HIADRP COc1cccc([C@H](CNC2CC[NH+](CCc3ccccc3)CC2)[NH+]2CCCC2)c1 ZINC000463140579 876192077 /nfs/dbraw/zinc/19/20/77/876192077.db2.gz LOXCOOHPMXZQJE-SANMLTNESA-N 2 0 407.602 4.129 20 0 HIADRP COc1ccc([C@H](CN[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[NH+]2CCCC2)cc1 ZINC000463141811 876193541 /nfs/dbraw/zinc/19/35/41/876193541.db2.gz ZZYKNXURAATERF-DSBYRVASSA-N 2 0 407.602 4.475 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC1CC[NH+](CCc2ccccc2)CC1 ZINC000463203657 876263706 /nfs/dbraw/zinc/26/37/06/876263706.db2.gz GSAWFHRPAKSCIQ-OOWSSMPZSA-N 2 0 405.630 4.440 20 0 HIADRP CC(=O)NC1CCC([NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000463294923 876356090 /nfs/dbraw/zinc/35/60/90/876356090.db2.gz HLFWZTCOJZKZIU-UHFFFAOYSA-N 2 0 405.586 4.486 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000463298375 876359829 /nfs/dbraw/zinc/35/98/29/876359829.db2.gz CKCQOJCMDJPKSM-RUXWMSNDSA-N 2 0 404.602 4.077 20 0 HIADRP C[C@H]1CN(Cc2cccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2)CCO1 ZINC000463304248 876364714 /nfs/dbraw/zinc/36/47/14/876364714.db2.gz VHMHWWXCJUXDFL-JUNVXYPSSA-N 2 0 419.613 4.193 20 0 HIADRP C[N@H+](C[C@H](O)COc1c(Cl)cccc1Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464853495 878133520 /nfs/dbraw/zinc/13/35/20/878133520.db2.gz RZGHZVQBJMNUTP-OALUTQOASA-N 2 0 423.384 4.187 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NC[C@H](c1cccs1)[NH+]1CCC(C)CC1)CC2 ZINC000465419068 878849518 /nfs/dbraw/zinc/84/95/18/878849518.db2.gz AICLKVOEBLPJCT-QHAWAJNXSA-N 2 0 418.651 4.178 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCc1ccccc1C[NH+]1CCCC[C@@H]1C)CC2 ZINC000465563986 879036151 /nfs/dbraw/zinc/03/61/51/879036151.db2.gz HQBIYFISZIOABI-ZTCOLXNVSA-N 2 0 412.622 4.218 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)CC[N@@H+]1C ZINC000465573519 879048038 /nfs/dbraw/zinc/04/80/38/879048038.db2.gz PGTYBGRWFGLMNC-XXBNENTESA-N 2 0 408.590 4.039 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)CC(C)C ZINC000465581206 879061582 /nfs/dbraw/zinc/06/15/82/879061582.db2.gz ZEFVTHHDMNQUAO-IRFCIJBXSA-N 2 0 408.656 4.187 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCC[NH+]1CCC(C)CC1 ZINC000465601122 879090708 /nfs/dbraw/zinc/09/07/08/879090708.db2.gz NMOWOXZYOTXDLU-XMMPIXPASA-N 2 0 414.638 4.052 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)C1 ZINC000465715106 879286017 /nfs/dbraw/zinc/28/60/17/879286017.db2.gz DZIWYOLJXXTLQA-OAQYLSRUSA-N 2 0 414.638 4.324 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)NC[C@H]2CCC[NH+](C)[C@@H]2c2cccs2)C1 ZINC000465750031 879337281 /nfs/dbraw/zinc/33/72/81/879337281.db2.gz HLGREOGHLICGCZ-HDAAZOAOSA-N 2 0 420.667 4.187 20 0 HIADRP CC[NH+]1CCC(CCNC(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)CC1 ZINC000465924472 879588504 /nfs/dbraw/zinc/58/85/04/879588504.db2.gz NRABSXOZZYGOIL-HXUWFJFHSA-N 2 0 400.611 4.071 20 0 HIADRP CC[NH+](CC)CCN(CC(C)C)C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000466071327 879774844 /nfs/dbraw/zinc/77/48/44/879774844.db2.gz ADIBDMHAKVBUDG-TZIWHRDSSA-N 2 0 408.656 4.140 20 0 HIADRP Brc1ccc(/C=C/CC[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000466917905 880685848 /nfs/dbraw/zinc/68/58/48/880685848.db2.gz HAWQNBKKIYBONX-ORCRQEGFSA-N 2 0 407.396 4.429 20 0 HIADRP FC(F)(F)c1cccc(OCCC[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c1 ZINC000466917452 880685870 /nfs/dbraw/zinc/68/58/70/880685870.db2.gz QGLUZZYNAWCRPG-UHFFFAOYSA-N 2 0 400.485 4.051 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NCc1ccc(CC[NH+](C)C)cc1 ZINC000466972704 880775962 /nfs/dbraw/zinc/77/59/62/880775962.db2.gz IQZBYOAHSOBQAQ-OAQYLSRUSA-N 2 0 422.617 4.165 20 0 HIADRP CCN(C(=O)NCc1ccc(CC[NH+](C)C)cc1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000467096579 880860009 /nfs/dbraw/zinc/86/00/09/880860009.db2.gz ZJPHCVPTIHEGER-SQJMNOBHSA-N 2 0 422.617 4.158 20 0 HIADRP CCN(C(=O)NCc1ccc(CC[NH+](C)C)cc1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000467096576 880860145 /nfs/dbraw/zinc/86/01/45/880860145.db2.gz ZJPHCVPTIHEGER-BWKNWUBXSA-N 2 0 422.617 4.158 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](CCC(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000467178657 880906395 /nfs/dbraw/zinc/90/63/95/880906395.db2.gz BPXWDRWEOAUDHZ-UHFFFAOYSA-N 2 0 416.393 4.145 20 0 HIADRP CCS[C@@H]1CCCC[C@@H]1[NH2+]CC1(C[NH2+][C@H]2CCCC[C@H]2SCC)COC1 ZINC000469775994 883951726 /nfs/dbraw/zinc/95/17/26/883951726.db2.gz PCVJNZYUPCOGEF-VNTMZGSJSA-N 2 0 400.698 4.311 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)N2CCC(C[NH+]3CCCC3)CC2)CCCC1)c1ccccc1 ZINC000503742798 912813414 /nfs/dbraw/zinc/81/34/14/912813414.db2.gz VSYYORFJJSTNNE-NRFANRHFSA-N 2 0 412.622 4.167 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2cc(Br)cc3cccnc32)CC1 ZINC000470192643 884494508 /nfs/dbraw/zinc/49/45/08/884494508.db2.gz HAVUCZKTNQQPOB-UHFFFAOYSA-N 2 0 420.395 4.320 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)c1cccc(C(F)(F)F)c1 ZINC000470600045 885026278 /nfs/dbraw/zinc/02/62/78/885026278.db2.gz QMCQUAWLKRZXOU-NRFANRHFSA-N 2 0 419.491 4.334 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N1CC[C@H](C[N@H+](C)CC2CC2)C1)c1ccccc1Cl ZINC000470735966 885191629 /nfs/dbraw/zinc/19/16/29/885191629.db2.gz HTWPMAIWDSPIPZ-KNQAVFIVSA-N 2 0 421.029 4.096 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)N2CC[C@H](C[N@H+](C)CC3CC3)C2)CCCC1)c1ccccc1 ZINC000470894784 885393425 /nfs/dbraw/zinc/39/34/25/885393425.db2.gz NCHMBTJTSDVJCM-IFMALSPDSA-N 2 0 412.622 4.023 20 0 HIADRP C[C@H](c1cccc(Cl)c1)[NH+]1CCC(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1 ZINC000471214375 885788399 /nfs/dbraw/zinc/78/83/99/885788399.db2.gz ATJAHNAMKKBNOJ-LJQANCHMSA-N 2 0 413.993 4.361 20 0 HIADRP CCN(C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000471375603 886017379 /nfs/dbraw/zinc/01/73/79/886017379.db2.gz ZGEFWEADBBNUKB-AKIFATBCSA-N 2 0 424.589 4.284 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2ccc(Br)cc2)s1 ZINC000472166564 886964664 /nfs/dbraw/zinc/96/46/64/886964664.db2.gz YQGUZFXYHNZGEN-INIZCTEOSA-N 2 0 422.436 4.293 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000473734900 888513328 /nfs/dbraw/zinc/51/33/28/888513328.db2.gz PEJPEVOASAUKPB-XMMPIXPASA-N 2 0 414.638 4.469 20 0 HIADRP CCN(C(=O)Nc1cccc(OCC[NH+](C)C)c1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473748825 888534445 /nfs/dbraw/zinc/53/44/45/888534445.db2.gz UGIXIZHBZNFWNY-NFBKMPQASA-N 2 0 424.589 4.316 20 0 HIADRP CCN(C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473886810 888756024 /nfs/dbraw/zinc/75/60/24/888756024.db2.gz NVKVBDQTFNMYSV-WIYYLYMNSA-N 2 0 400.611 4.163 20 0 HIADRP O=C(NC[C@@H]1CCCC[N@H+]1Cc1cccc(Cl)c1)NC1CC([NH+]2CCCCC2)C1 ZINC000474347975 889224751 /nfs/dbraw/zinc/22/47/51/889224751.db2.gz MHPCBFPJJBZLNT-ORFBVSJDSA-N 2 0 419.013 4.011 20 0 HIADRP CC(C)C[C@@H](CNC(=O)NC1CC([NH+]2CCCCC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000474522940 889393283 /nfs/dbraw/zinc/39/32/83/889393283.db2.gz NFVCEEQWDUBKQZ-XXDDBKGRSA-N 2 0 400.611 4.068 20 0 HIADRP C[C@@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474625550 889487659 /nfs/dbraw/zinc/48/76/59/889487659.db2.gz AXQDLQUDBMIGLU-NZSAHSFTSA-N 2 0 405.011 4.090 20 0 HIADRP Cc1cccc(CC2(O)CC[NH+](Cc3ccccc3N(C)C3CC[NH+](C)CC3)CC2)c1 ZINC000475506873 890422367 /nfs/dbraw/zinc/42/23/67/890422367.db2.gz ZPEZHJSQLSMLIJ-UHFFFAOYSA-N 2 0 421.629 4.095 20 0 HIADRP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CCC[N@H+](CC2CCCCC2)CC1 ZINC000475994599 890917302 /nfs/dbraw/zinc/91/73/02/890917302.db2.gz DZGABIDJDDDFOW-UHFFFAOYSA-N 2 0 404.643 4.081 20 0 HIADRP Cc1ccc(CN(C(=O)C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)C2CC2)o1 ZINC000476987793 891914311 /nfs/dbraw/zinc/91/43/11/891914311.db2.gz RLJXHBCCHOQNRZ-IBGZPJMESA-N 2 0 401.595 4.056 20 0 HIADRP COc1cccc(NC(=O)CC[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)c1 ZINC000477048385 891976100 /nfs/dbraw/zinc/97/61/00/891976100.db2.gz HHYBRZWRZSSVRY-RUZDIDTESA-N 2 0 407.558 4.012 20 0 HIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCN(Cc3ccccn3)C[C@@H]2C)CC1 ZINC000477937778 893028580 /nfs/dbraw/zinc/02/85/80/893028580.db2.gz NDWCOTACWCIQOB-NVQXNPDNSA-N 2 0 406.618 4.314 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](C)c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000479267949 894540874 /nfs/dbraw/zinc/54/08/74/894540874.db2.gz YAEBJRMCJUPWBW-CQSZACIVSA-N 2 0 422.333 4.146 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccccc1)c1ccc(Br)cc1 ZINC000479298926 894583300 /nfs/dbraw/zinc/58/33/00/894583300.db2.gz WYELCMBPHRLNAR-FCHUYYIVSA-N 2 0 417.391 4.365 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1cc(F)ccc1F ZINC000479394001 894697720 /nfs/dbraw/zinc/69/77/20/894697720.db2.gz NGGWHWJSGSLHOM-HSZRJFAPSA-N 2 0 415.528 4.277 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3cc(Br)ccc32)C1 ZINC000479434581 894748391 /nfs/dbraw/zinc/74/83/91/894748391.db2.gz DYWRKTMMZUFOST-IFMALSPDSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000479535761 894841016 /nfs/dbraw/zinc/84/10/16/894841016.db2.gz APBFXUFPGPMKFK-OAQYLSRUSA-N 2 0 418.670 4.470 20 0 HIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000479767586 895067765 /nfs/dbraw/zinc/06/77/65/895067765.db2.gz JTKNZZUOHGDMNT-JKSUJKDBSA-N 2 0 422.415 4.499 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc2c(c1)OCCO2 ZINC000480244161 895654654 /nfs/dbraw/zinc/65/46/54/895654654.db2.gz XEZWAXSSHBMMHQ-YYDVJCTNSA-N 2 0 410.558 4.308 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000480265304 895673986 /nfs/dbraw/zinc/67/39/86/895673986.db2.gz MJVWJDISEYGACC-LJQANCHMSA-N 2 0 415.603 4.141 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(N(C)C(C)C)nc2)CC1 ZINC000480387650 895794170 /nfs/dbraw/zinc/79/41/70/895794170.db2.gz WXXTURABQGZJNT-LJQANCHMSA-N 2 0 413.585 4.058 20 0 HIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C[C@@H](C(C)C)N3CC[NH+](C)CC3)s2)cc1 ZINC000480542882 895904266 /nfs/dbraw/zinc/90/42/66/895904266.db2.gz UUODFVGGKAYGKF-UTKZUKDTSA-N 2 0 416.635 4.050 20 0 HIADRP CC(C)(C)C(=O)N1CCC(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000480566073 895927192 /nfs/dbraw/zinc/92/71/92/895927192.db2.gz XCOMZJNUULTACG-BJKOFHAPSA-N 2 0 411.634 4.258 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000480599714 895962628 /nfs/dbraw/zinc/96/26/28/895962628.db2.gz CNTPGOHCNMOLJB-RBUKOAKNSA-N 2 0 415.603 4.283 20 0 HIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480630935 896001210 /nfs/dbraw/zinc/00/12/10/896001210.db2.gz LVPVLPSVFRWCIA-SFTDATJTSA-N 2 0 421.651 4.024 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3cccc(OC(F)F)c3)cc2)CC1 ZINC000480687095 896049816 /nfs/dbraw/zinc/04/98/16/896049816.db2.gz DMGNAFZCQZMBOM-GOSISDBHSA-N 2 0 403.517 4.276 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480693322 896056892 /nfs/dbraw/zinc/05/68/92/896056892.db2.gz BJBOUHQZZDKCEC-ROUUACIJSA-N 2 0 410.562 4.323 20 0 HIADRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000480722208 896083519 /nfs/dbraw/zinc/08/35/19/896083519.db2.gz JZDHUUJTSGZXQT-DEOSSOPVSA-N 2 0 411.565 4.131 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cc(OC)c(OC)cc2C)CC1 ZINC000480740499 896103641 /nfs/dbraw/zinc/10/36/41/896103641.db2.gz WQAXHUSLDYGFDZ-FQEVSTJZSA-N 2 0 411.590 4.001 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4c3ccc(Cl)c4Cl)cn2)CC1 ZINC000480742839 896105193 /nfs/dbraw/zinc/10/51/93/896105193.db2.gz YASNHWVYBBPEDS-IBGZPJMESA-N 2 0 405.373 4.307 20 0 HIADRP CC[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)[C@@H]1CCOC1 ZINC000480748649 896111306 /nfs/dbraw/zinc/11/13/06/896111306.db2.gz YEIVTZIBRBUDAU-WIYYLYMNSA-N 2 0 413.528 4.012 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1 ZINC000480779407 896145158 /nfs/dbraw/zinc/14/51/58/896145158.db2.gz KIKJQWFNZYNKSS-SFHVURJKSA-N 2 0 403.592 4.139 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1ccc(-n2cnnn2)cc1 ZINC000480892499 896248464 /nfs/dbraw/zinc/24/84/64/896248464.db2.gz ATBFRLOWQWBMSN-LJQANCHMSA-N 2 0 404.562 4.278 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CCSc4ccc(Cl)cc43)cc2)CC1 ZINC000480914210 896272175 /nfs/dbraw/zinc/27/21/75/896272175.db2.gz UTGFBFZWHKHDLC-OAQYLSRUSA-N 2 0 402.007 4.414 20 0 HIADRP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000481247663 896599108 /nfs/dbraw/zinc/59/91/08/896599108.db2.gz UHNJHNHLLKVSFO-MRXNPFEDSA-N 2 0 424.536 4.339 20 0 HIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000481667135 897051391 /nfs/dbraw/zinc/05/13/91/897051391.db2.gz GOICGVQVYKGSOW-QGZVFWFLSA-N 2 0 406.492 4.383 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1 ZINC000481718921 897111974 /nfs/dbraw/zinc/11/19/74/897111974.db2.gz BGJCWIKBOBEDBS-QGZVFWFLSA-N 2 0 421.632 4.073 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H]2CCCc3c4ccccc4sc32)c1 ZINC000482245714 897728289 /nfs/dbraw/zinc/72/82/89/897728289.db2.gz PDWYYEIMQWVISW-NRFANRHFSA-N 2 0 407.583 4.360 20 0 HIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C3CCOCC3)c1)CCCO2 ZINC000482263106 897747164 /nfs/dbraw/zinc/74/71/64/897747164.db2.gz LDZQJJULQJFUAS-VWLOTQADSA-N 2 0 424.585 4.488 20 0 HIADRP CC[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482455737 898024438 /nfs/dbraw/zinc/02/44/38/898024438.db2.gz QTCZJLFNUAWILH-HXUWFJFHSA-N 2 0 422.404 4.427 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2ccc(OCc3ccc(F)cc3)cc2)CC1 ZINC000482495907 898076214 /nfs/dbraw/zinc/07/62/14/898076214.db2.gz LHMCHKIPBWNLJM-LEWJYISDSA-N 2 0 413.581 4.329 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000482534841 898122232 /nfs/dbraw/zinc/12/22/32/898122232.db2.gz OJRHFCBBUJYRND-IBGZPJMESA-N 2 0 419.038 4.458 20 0 HIADRP CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(OC)c(OC)c1 ZINC000482536916 898123769 /nfs/dbraw/zinc/12/37/69/898123769.db2.gz QNPXJAWBUYHZPY-UTKZUKDTSA-N 2 0 415.553 4.397 20 0 HIADRP C[C@H](C[NH2+][C@@H](CCSc1ccccc1)c1ccc(F)cc1)N1CC[NH+](C)CC1 ZINC000482554220 898145278 /nfs/dbraw/zinc/14/52/78/898145278.db2.gz GVLGXZJWOYMWSB-XXBNENTESA-N 2 0 401.595 4.275 20 0 HIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@@H]3CCN(Cc4ccccn4)C[C@@H]3C)c2)CC1 ZINC000482553632 898145315 /nfs/dbraw/zinc/14/53/15/898145315.db2.gz JQMPSOBYAVQVOH-BKMJKUGQSA-N 2 0 406.618 4.314 20 0 HIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@@H]3CCN(Cc4ccccn4)C[C@H]3C)c2)CC1 ZINC000482553630 898145881 /nfs/dbraw/zinc/14/58/81/898145881.db2.gz JQMPSOBYAVQVOH-ATIYNZHBSA-N 2 0 406.618 4.314 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2cccc(NC(C)=O)c2)CC1 ZINC000482555596 898147481 /nfs/dbraw/zinc/14/74/81/898147481.db2.gz RYRKBZKBJLZISG-MSOLQXFVSA-N 2 0 412.553 4.338 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCCO3)CC1 ZINC000482558136 898149243 /nfs/dbraw/zinc/14/92/43/898149243.db2.gz MSCAHIYKILRZCT-ZWKOTPCHSA-N 2 0 413.537 4.151 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482564071 898156090 /nfs/dbraw/zinc/15/60/90/898156090.db2.gz HEGKYDCGCZZZIR-DLBZAZTESA-N 2 0 424.564 4.219 20 0 HIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c1)CCCO2 ZINC000482620273 898223350 /nfs/dbraw/zinc/22/33/50/898223350.db2.gz ONQNPFSNZAYGIQ-VWNXMTODSA-N 2 0 421.585 4.004 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cc2c(s1)CCCC2 ZINC000482648949 898253111 /nfs/dbraw/zinc/25/31/11/898253111.db2.gz GOJQZFMSWBNHAR-UTKZUKDTSA-N 2 0 411.615 4.175 20 0 HIADRP Cc1cc(C)c2c(c1)[C@@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c1)CCCO2 ZINC000482809033 898419769 /nfs/dbraw/zinc/41/97/69/898419769.db2.gz CADWMCOYUULFEP-UPVQGACJSA-N 2 0 421.585 4.004 20 0 HIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482886830 898502888 /nfs/dbraw/zinc/50/28/88/898502888.db2.gz JMYZKVULEUWKBU-HTIDIIIKSA-N 3 0 407.602 4.473 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000482890322 898507732 /nfs/dbraw/zinc/50/77/32/898507732.db2.gz VVLLHXXFJUAUGU-RTBURBONSA-N 2 0 403.567 4.153 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3cccc(Br)c3)CC2)[C@@H](C)C1 ZINC000483121792 898808804 /nfs/dbraw/zinc/80/88/04/898808804.db2.gz RAGGAVYVXGVTFR-FXAWDEMLSA-N 2 0 409.412 4.207 20 0 HIADRP C[C@H]([NH2+][C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000483198820 898854685 /nfs/dbraw/zinc/85/46/85/898854685.db2.gz MBMMEDKDZVYCJW-HKUYNNGSSA-N 2 0 419.516 4.158 20 0 HIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000483218596 898865385 /nfs/dbraw/zinc/86/53/85/898865385.db2.gz PXDZZDLKDOCJPL-CJFMBICVSA-N 2 0 412.549 4.209 20 0 HIADRP CCOc1ccc(-c2nc(CN3CC[C@H]4[C@H](CCC[N@@H+]4C)C3)cs2)cc1OC ZINC000483481709 899127368 /nfs/dbraw/zinc/12/73/68/899127368.db2.gz IQHOXHKUCSBPGP-MJGOQNOKSA-N 2 0 401.576 4.134 20 0 HIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000483518954 899180119 /nfs/dbraw/zinc/18/01/19/899180119.db2.gz NIMXPQJANSJZTL-SFHVURJKSA-N 2 0 413.528 4.229 20 0 HIADRP CC(C)c1nc2ccc(NC(=O)NC3CC[NH+](C4CCN(C)CC4)CC3)cc2s1 ZINC000483891180 899565468 /nfs/dbraw/zinc/56/54/68/899565468.db2.gz ANFDZFFHWMPJFF-UHFFFAOYSA-N 2 0 415.607 4.100 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)NC2CC[NH+](C3CCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000483994639 899633641 /nfs/dbraw/zinc/63/36/41/899633641.db2.gz QRBLKZLWCVNKQX-YKSBVNFPSA-N 2 0 412.622 4.088 20 0 HIADRP C[C@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(-c2ccc(Br)cc2)s1 ZINC000484145730 899766983 /nfs/dbraw/zinc/76/69/83/899766983.db2.gz MSBFRTPIHFSXLH-AWEZNQCLSA-N 2 0 409.393 4.285 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000484484781 899975796 /nfs/dbraw/zinc/97/57/96/899975796.db2.gz OLQMNMZTXHMUDU-JOCHJYFZSA-N 2 0 400.950 4.300 20 0 HIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)ccc1OC(F)F ZINC000484486414 899978288 /nfs/dbraw/zinc/97/82/88/899978288.db2.gz KRUREGXKDYBNOS-MRXNPFEDSA-N 2 0 420.500 4.104 20 0 HIADRP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(N2CCOCC2)c1 ZINC000484500673 899991135 /nfs/dbraw/zinc/99/11/35/899991135.db2.gz NIKVVWCYZAEDON-SRCYTUNASA-N 2 0 407.602 4.330 20 0 HIADRP COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C)C2)c1 ZINC000484509817 900002234 /nfs/dbraw/zinc/00/22/34/900002234.db2.gz UOHLPSDWOCFCCZ-UNIVCBNLSA-N 2 0 423.601 4.030 20 0 HIADRP CCC[NH+]1CCC([N@H+](C)C[C@@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)CC1 ZINC000484914196 900290684 /nfs/dbraw/zinc/29/06/84/900290684.db2.gz VKCHGLLQLQRQRS-FTJBHMTQSA-N 2 0 410.602 4.268 20 0 HIADRP CCC[NH+]1CCC([N@H+](C)C[C@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)CC1 ZINC000484914199 900291457 /nfs/dbraw/zinc/29/14/57/900291457.db2.gz VKCHGLLQLQRQRS-IZZNHLLZSA-N 2 0 410.602 4.268 20 0 HIADRP CCOc1ccccc1NC(=O)CC[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000485260670 900544873 /nfs/dbraw/zinc/54/48/73/900544873.db2.gz LXSOXHXESNIDSJ-HXUWFJFHSA-N 2 0 401.595 4.390 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C)C1)C1CCCCC1 ZINC000485614846 900872271 /nfs/dbraw/zinc/87/22/71/900872271.db2.gz OSCMXJNVCBVYEP-ISKFKSNPSA-N 2 0 412.622 4.077 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCC(=O)Nc2ccc(OCc3ccccc3)cc2)C[C@H]1C ZINC000485676638 900928015 /nfs/dbraw/zinc/92/80/15/900928015.db2.gz VRGTWPKIUFHAHW-OFNKIYASSA-N 2 0 409.574 4.399 20 0 HIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCC(=O)Nc2ccc(OCc3ccccc3)cc2)C[C@@H]1C ZINC000485676636 900928331 /nfs/dbraw/zinc/92/83/31/900928331.db2.gz VRGTWPKIUFHAHW-NZQKXSOJSA-N 2 0 409.574 4.399 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000486192543 901377601 /nfs/dbraw/zinc/37/76/01/901377601.db2.gz OWHIUYWZLHXNCE-PXDATVDWSA-N 2 0 405.586 4.455 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000486273773 901457018 /nfs/dbraw/zinc/45/70/18/901457018.db2.gz YKDGYPGOANVKQY-OFVILXPXSA-N 2 0 422.617 4.238 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1 ZINC000505931074 914582508 /nfs/dbraw/zinc/58/25/08/914582508.db2.gz WERUGXSTAQEVCS-FCHUYYIVSA-N 2 0 415.622 4.134 20 0 HIADRP C[C@H](NC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488607845 902897662 /nfs/dbraw/zinc/89/76/62/902897662.db2.gz GNLVNYWXDSTSQB-TUSQITKMSA-N 2 0 420.601 4.033 20 0 HIADRP C[C@H](NC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488607837 902898089 /nfs/dbraw/zinc/89/80/89/902898089.db2.gz GNLVNYWXDSTSQB-FTBPSBKWSA-N 2 0 420.601 4.033 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N[C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000489283441 903307334 /nfs/dbraw/zinc/30/73/34/903307334.db2.gz APGWBXSGVSCIEI-ZLSIYFNSSA-N 2 0 420.601 4.032 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489294469 903314846 /nfs/dbraw/zinc/31/48/46/903314846.db2.gz PFGMRKBTKSBESP-QPPBQGQZSA-N 2 0 420.601 4.128 20 0 HIADRP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)CCCO2 ZINC000489483349 903413322 /nfs/dbraw/zinc/41/33/22/903413322.db2.gz PCLCXGHXPTZCLA-HXUWFJFHSA-N 2 0 422.013 4.078 20 0 HIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489559893 903464470 /nfs/dbraw/zinc/46/44/70/903464470.db2.gz HSOXLLHIOUCQKA-OAQYLSRUSA-N 2 0 414.638 4.193 20 0 HIADRP Cc1cc(C(C)(C)C)cc2c1OCCC[C@@H]2[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000489558045 903464879 /nfs/dbraw/zinc/46/48/79/903464879.db2.gz NKMPRXVPPAVVDO-QHCPKHFHSA-N 2 0 422.617 4.443 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@@H](c2ccccc2)c2ccccn2)[C@@H](c2ccccc2)C1 ZINC000490119834 903777477 /nfs/dbraw/zinc/77/74/77/903777477.db2.gz QKGJLBIFQRSKHP-FTJBHMTQSA-N 2 0 400.570 4.139 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 ZINC000490168753 903806368 /nfs/dbraw/zinc/80/63/68/903806368.db2.gz ZHVZBVXXJZLICY-SBUREZEXSA-N 2 0 419.585 4.392 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]Cc3cnnn3Cc3ccccc3)cc2)C1 ZINC000490572956 904110191 /nfs/dbraw/zinc/11/01/91/904110191.db2.gz TVTHDLFIJWPIER-OYRHEFFESA-N 2 0 403.574 4.094 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@@H](C)[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1)C1CC1 ZINC000490792886 904239120 /nfs/dbraw/zinc/23/91/20/904239120.db2.gz IBGZMXWAXVJRBV-GBXCKJPGSA-N 2 0 405.586 4.311 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000491015709 904369642 /nfs/dbraw/zinc/36/96/42/904369642.db2.gz ALZDWVCRNIOPHD-WZONZLPQSA-N 2 0 403.973 4.432 20 0 HIADRP CCOc1ccc([C@H]([NH2+]C[C@@H](C)N2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000491026862 904378058 /nfs/dbraw/zinc/37/80/58/904378058.db2.gz ZGIUYTLSCAZSDZ-JPYJTQIMSA-N 2 0 401.982 4.054 20 0 HIADRP C[C@@H](C[NH2+][C@@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1)N1CC[NH+](C)CC1 ZINC000491034762 904387016 /nfs/dbraw/zinc/38/70/16/904387016.db2.gz TZKOIWDJQGRMAA-KKSFZXQISA-N 2 0 423.935 4.256 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+][C@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CC1 ZINC000493276650 905074279 /nfs/dbraw/zinc/07/42/79/905074279.db2.gz LLUXKJFRXWTQNL-LJQANCHMSA-N 2 0 410.892 4.077 20 0 HIADRP COc1cc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1OCC(F)(F)F ZINC000512390323 921125762 /nfs/dbraw/zinc/12/57/62/921125762.db2.gz CHYAJZHAFOOKLN-DOTOQJQBSA-N 2 0 400.485 4.379 20 0 HIADRP C[C@H](CCSc1ccccc1)[NH+]1CCN([C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000512438540 921163431 /nfs/dbraw/zinc/16/34/31/921163431.db2.gz GQAMERHVTDIWAN-VWNXMTODSA-N 2 0 409.643 4.449 20 0 HIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)cc1F ZINC000494565890 905839793 /nfs/dbraw/zinc/83/97/93/905839793.db2.gz ZNCMPKJRQNPVAQ-UHFFFAOYSA-N 2 0 420.454 4.441 20 0 HIADRP c1ccc([C@H]([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)c2ccccn2)cc1 ZINC000494745362 905944771 /nfs/dbraw/zinc/94/47/71/905944771.db2.gz IOWFTMRTYQGJIO-SANMLTNESA-N 2 0 401.554 4.478 20 0 HIADRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)C1 ZINC000494945592 906117848 /nfs/dbraw/zinc/11/78/48/906117848.db2.gz GOHJOHPGTZNLFU-LJQANCHMSA-N 2 0 410.484 4.028 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@@H](C[C@H]3CCOC3)c3ccc(F)cc3)cc2)CC1 ZINC000495090529 906231128 /nfs/dbraw/zinc/23/11/28/906231128.db2.gz IKMYSOJQONLVRT-BWKNWUBXSA-N 2 0 412.549 4.040 20 0 HIADRP COc1cccc([C@@H]2[C@@H]([NH2+][C@@H](C)c3ccc(OCC[NH+](C)C)cc3)CCN2C2CC2)c1 ZINC000495419474 906439813 /nfs/dbraw/zinc/43/98/13/906439813.db2.gz BOSKTOMYAAADFQ-RRWZXMNXSA-N 2 0 423.601 4.264 20 0 HIADRP CC(C)n1nccc1NC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000495549264 906502319 /nfs/dbraw/zinc/50/23/19/906502319.db2.gz VCLCOPZPWOXMLP-HSALFYBXSA-N 2 0 411.594 4.059 20 0 HIADRP C[C@@H](C[NH2+][C@@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1)CN1CC[NH+](C)CC1 ZINC000512643540 921271461 /nfs/dbraw/zinc/27/14/61/921271461.db2.gz XLYNNAHCILLIET-HTAPYJJXSA-N 2 0 423.498 4.407 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N[C@@H]2C[NH+](C)C[C@@H]2c2ccccc2)c1 ZINC000497398370 906879491 /nfs/dbraw/zinc/87/94/91/906879491.db2.gz BVPYRONQJNDXPG-CLJLJLNGSA-N 2 0 413.565 4.146 20 0 HIADRP c1cn(Cc2ccccc2C[NH2+][C@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000512660441 921279096 /nfs/dbraw/zinc/27/90/96/921279096.db2.gz NFTPFLKPAJSYBI-NXCFDTQHSA-N 2 0 400.570 4.322 20 0 HIADRP C[C@H](C[NH2+][C@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1)N1CC[NH+](C)CC1 ZINC000512668579 921281264 /nfs/dbraw/zinc/28/12/64/921281264.db2.gz VUMIKXOAXNWHID-IERDGZPVSA-N 2 0 409.471 4.159 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000497720210 907218589 /nfs/dbraw/zinc/21/85/89/907218589.db2.gz MQTFDDPEOLANCN-XMMPIXPASA-N 2 0 412.622 4.223 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H]3CC=C(c4ccc(F)cc4)CC3)c2)C1 ZINC000497834973 907315901 /nfs/dbraw/zinc/31/59/01/907315901.db2.gz BHRKFCYOLRMQIJ-ILBGXUMGSA-N 2 0 421.560 4.249 20 0 HIADRP Cc1cc(C)cc(-c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)N4CC(=O)N(C)C)cc2)c1 ZINC000512904041 921395840 /nfs/dbraw/zinc/39/58/40/921395840.db2.gz LOXRDQCEBIIXBF-QILAJZQNSA-N 2 0 405.586 4.144 20 0 HIADRP CCN(CC)C(=O)c1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499186105 908539573 /nfs/dbraw/zinc/53/95/73/908539573.db2.gz AMMOMJPIXHAZLL-QEIWAGNOSA-N 2 0 405.586 4.454 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)c1ccc(-c2ccccc2Cl)o1 ZINC000499505820 908821260 /nfs/dbraw/zinc/82/12/60/908821260.db2.gz DDAXBYZZGOGXAI-QGZVFWFLSA-N 2 0 403.954 4.088 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)N3CCC(CCC[NH+](C)C)CC3)c2)CC1 ZINC000500785973 910078502 /nfs/dbraw/zinc/07/85/02/910078502.db2.gz KJLCSSDQSYFYFT-UHFFFAOYSA-N 2 0 414.638 4.182 20 0 HIADRP Brc1ccccc1C[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000513098081 921547476 /nfs/dbraw/zinc/54/74/76/921547476.db2.gz AVQAJHGPMFZHDF-UHFFFAOYSA-N 2 0 402.380 4.141 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC(CCC[NH+](C)C)CC1 ZINC000500818903 910101362 /nfs/dbraw/zinc/10/13/62/910101362.db2.gz RRUPYXZBELHBLX-NRFANRHFSA-N 2 0 414.638 4.324 20 0 HIADRP Brc1cc(C[NH2+]CCCCC[NH+]2CCCCC2)cc2c1OCCCO2 ZINC000500894566 910165262 /nfs/dbraw/zinc/16/52/62/910165262.db2.gz SVCQAFUUXPCIRQ-UHFFFAOYSA-N 2 0 411.384 4.356 20 0 HIADRP C[C@H](C(=O)N[C@@H](C)c1cc2ccccc2o1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501024851 910242156 /nfs/dbraw/zinc/24/21/56/910242156.db2.gz OBXIDQJJSAGRHR-RBUKOAKNSA-N 2 0 420.557 4.242 20 0 HIADRP C[C@H](C(=O)Nc1cccc(C(F)(F)F)c1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501039470 910253336 /nfs/dbraw/zinc/25/33/36/910253336.db2.gz LURPYVZPAJXJHK-MRXNPFEDSA-N 2 0 420.479 4.276 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CCC[N@H+](Cc2ccccc2)CC1)c1ccsc1 ZINC000501175019 910342954 /nfs/dbraw/zinc/34/29/54/910342954.db2.gz OLFUIFHYBDABDU-JOCHJYFZSA-N 2 0 414.619 4.049 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)c2cccs2)CC1 ZINC000501520899 910629900 /nfs/dbraw/zinc/62/99/00/910629900.db2.gz XPSNYYUGRQNFKW-RTBURBONSA-N 2 0 420.648 4.185 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH+]2CCC(c3ccccc3Br)CC2)CC1 ZINC000501870848 910896134 /nfs/dbraw/zinc/89/61/34/910896134.db2.gz DEDWZBBQBLXBER-UHFFFAOYSA-N 2 0 408.428 4.045 20 0 HIADRP CC(C)[C@H]([NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000502562520 911567005 /nfs/dbraw/zinc/56/70/05/911567005.db2.gz HDDXAOHPUXMQLR-CYFREDJKSA-N 2 0 411.565 4.282 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000502846914 911857681 /nfs/dbraw/zinc/85/76/81/911857681.db2.gz UOFWQDXOXCOULH-LJQANCHMSA-N 2 0 421.029 4.116 20 0 HIADRP CC(C)[C@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCC(C)CC1 ZINC000502919034 911906985 /nfs/dbraw/zinc/90/69/85/911906985.db2.gz OAHQSEAHAGKDLF-DEOSSOPVSA-N 2 0 414.638 4.049 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)CC1 ZINC000502926591 911912461 /nfs/dbraw/zinc/91/24/61/911912461.db2.gz SFZNKXRQIKKLIE-NRFANRHFSA-N 2 0 422.617 4.388 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NCC(C)(C)[NH2+][C@H](C)c2ccccc2)CC1 ZINC000502926592 911912657 /nfs/dbraw/zinc/91/26/57/911912657.db2.gz SFZNKXRQIKKLIE-OAQYLSRUSA-N 2 0 422.617 4.388 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1ccccc1 ZINC000503140917 912103426 /nfs/dbraw/zinc/10/34/26/912103426.db2.gz NFYHCPYIBRWOHP-REWPJTCUSA-N 2 0 408.590 4.252 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)[NH+]2CCCC2)o1 ZINC000506467993 915064087 /nfs/dbraw/zinc/06/40/87/915064087.db2.gz KMGVARKRKPBELQ-QFIPXVFZSA-N 2 0 416.610 4.023 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)[NH+]2CCCC2)o1 ZINC000506632036 915300118 /nfs/dbraw/zinc/30/01/18/915300118.db2.gz GDEWELALUXMHPS-NNWRFLSQSA-N 2 0 416.610 4.021 20 0 HIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC(C(=O)NCc2ccccc2)CC1 ZINC000506705190 915381710 /nfs/dbraw/zinc/38/17/10/915381710.db2.gz AMFWUQRKMXGHKU-UHFFFAOYSA-N 2 0 407.602 4.173 20 0 HIADRP c1c(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c(-c2cccnc2)nn1Cc1ccccc1 ZINC000506881437 915674864 /nfs/dbraw/zinc/67/48/64/915674864.db2.gz OBNUTCOXUPCPGN-UHFFFAOYSA-N 2 0 415.585 4.301 20 0 HIADRP FC(F)n1c2ccccc2nc1CC[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000507469386 916238782 /nfs/dbraw/zinc/23/87/82/916238782.db2.gz KAIRUQKKFFUBEF-HSALFYBXSA-N 2 0 410.512 4.474 20 0 HIADRP Clc1cccc(-c2noc(CC[NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)n2)c1 ZINC000507471365 916240653 /nfs/dbraw/zinc/24/06/53/916240653.db2.gz PAOPTEIEVVJKMF-ILWGZMRPSA-N 2 0 422.960 4.433 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)ccc2NC1=O ZINC000507487943 916255605 /nfs/dbraw/zinc/25/56/05/916255605.db2.gz SODZGNFRFWSADA-PKOBTZCRSA-N 2 0 419.569 4.357 20 0 HIADRP Cc1ccc(C(=O)N2CCC([NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@H]34)CC2)cc1 ZINC000507504124 916271297 /nfs/dbraw/zinc/27/12/97/916271297.db2.gz AVQBVFLTBPOXQZ-DMTNHVFBSA-N 2 0 417.597 4.100 20 0 HIADRP Cc1nccn1CCC[N@@H+](C)CC(=O)N(Cc1ccc(F)cc1)C1CCCCC1 ZINC000507921475 916800638 /nfs/dbraw/zinc/80/06/38/916800638.db2.gz ISZQSWPTYSFQGF-UHFFFAOYSA-N 2 0 400.542 4.014 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)ccc2NC1=O ZINC000508709397 917469378 /nfs/dbraw/zinc/46/93/78/917469378.db2.gz HLDOLMOYFCENEO-CFFRYYMNSA-N 2 0 407.558 4.357 20 0 HIADRP C[C@@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508714571 917475667 /nfs/dbraw/zinc/47/56/67/917475667.db2.gz HLSFVWCSAVWUPW-BWKNWUBXSA-N 2 0 407.602 4.213 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)N[C@@H](C)[C@H](c1ccccc1)[NH+](C)C ZINC000508852811 917605860 /nfs/dbraw/zinc/60/58/60/917605860.db2.gz NVBLJSHWEAQMCY-QQKQFIJSSA-N 2 0 422.617 4.231 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@@H](C)[C@@H](c2ccccc2C)[NH+](C)C)CC1 ZINC000508856861 917609844 /nfs/dbraw/zinc/60/98/44/917609844.db2.gz WPMSKCJZKHLNQS-REWPJTCUSA-N 2 0 402.627 4.140 20 0 HIADRP Cc1ccccc1[C@@H]([C@H](C)NC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[NH+](C)C ZINC000508861972 917614845 /nfs/dbraw/zinc/61/48/45/917614845.db2.gz IUVPYISPBTVKBZ-SQJMNOBHSA-N 2 0 422.617 4.292 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N[C@@H](C)[C@H](c1ccccc1C)[NH+](C)C)c1ccco1 ZINC000508877141 917630375 /nfs/dbraw/zinc/63/03/75/917630375.db2.gz DXLKUVZTCGUDNO-GWOFKNCZSA-N 2 0 400.567 4.008 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N(C)[C@H]1CC[NH+](CC)C[C@H]1C)c1ccc(Cl)cc1 ZINC000509031404 917786764 /nfs/dbraw/zinc/78/67/64/917786764.db2.gz KSSONCKHNJGCKK-JRGCBEDISA-N 2 0 409.018 4.095 20 0 HIADRP CC[C@@H](C)[NH2+][C@@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)c1ccco1 ZINC000509568468 918218110 /nfs/dbraw/zinc/21/81/10/918218110.db2.gz LNGUYBIFSIHLLE-KNQAVFIVSA-N 2 0 412.578 4.015 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccco1 ZINC000509595720 918246175 /nfs/dbraw/zinc/24/61/75/918246175.db2.gz JGDUGESAVKIKEZ-ACRUOGEOSA-N 2 0 404.599 4.006 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N(C)[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000509613192 918259873 /nfs/dbraw/zinc/25/98/73/918259873.db2.gz JNCWOLCIUSKGME-ILWGZMRPSA-N 2 0 412.578 4.015 20 0 HIADRP C[C@H]1C[C@H](CCNC(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000509793852 918400448 /nfs/dbraw/zinc/40/04/48/918400448.db2.gz YCXKABLFZDFVKF-GPXNEJASSA-N 2 0 414.638 4.098 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NCC(C)(C)[N@@H+]1CCc2ccccc2C1 ZINC000510308653 918821171 /nfs/dbraw/zinc/82/11/71/918821171.db2.gz QQTIDBBQQUTWDM-UHFFFAOYSA-N 2 0 405.542 4.061 20 0 HIADRP CCC[NH+]1CCC(CNC(=O)[C@@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)CC1 ZINC000510389215 918868079 /nfs/dbraw/zinc/86/80/79/918868079.db2.gz OIDWSOVQRDFTAC-HXUWFJFHSA-N 2 0 413.528 4.327 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC[NH+](CCc3ccccc3)CC2)cc1)C1CC1 ZINC000511283288 919878647 /nfs/dbraw/zinc/87/86/47/919878647.db2.gz VTANFYYGHLTUTM-UHFFFAOYSA-N 2 0 405.586 4.108 20 0 HIADRP C[C@H](NC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000511399473 920011314 /nfs/dbraw/zinc/01/13/14/920011314.db2.gz JJZCRIWXSMXYNG-NKDIVSIHSA-N 2 0 424.633 4.134 20 0 HIADRP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000511502477 920116702 /nfs/dbraw/zinc/11/67/02/920116702.db2.gz BQDXDUZWVKNIFC-UHFFFAOYSA-N 2 0 419.411 4.415 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@@H](c2ccc(OC)cc2)[NH+]2CCCC2)cc1)C1CC1 ZINC000511524389 920142170 /nfs/dbraw/zinc/14/21/70/920142170.db2.gz XJSDJMSSRBXCCG-VWLOTQADSA-N 2 0 421.585 4.246 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H](c2ccccc2OC)[NH+]2CCCC2)cc1)C1CC1 ZINC000511529428 920149571 /nfs/dbraw/zinc/14/95/71/920149571.db2.gz QMCQBHGYPDYWMR-XMMPIXPASA-N 2 0 421.585 4.246 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000511624940 920285197 /nfs/dbraw/zinc/28/51/97/920285197.db2.gz IVGZZPSNDHTZHK-UHFFFAOYSA-N 2 0 415.553 4.002 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000512148768 920891123 /nfs/dbraw/zinc/89/11/23/920891123.db2.gz YNLKEGMOHDJCOE-OLZOCXBDSA-N 2 0 403.876 4.150 20 0 HIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H](C(=O)NC2CC2)c2ccc(F)cc2)C[N@@H+]1Cc1ccccc1 ZINC000512323589 921074258 /nfs/dbraw/zinc/07/42/58/921074258.db2.gz CYVHJMJDBUIPSF-LJFZDNNRSA-N 2 0 409.549 4.036 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@H](Cc3ccccn3)c3cccnc3)cc2)C[C@H](C)O1 ZINC000513500356 921850137 /nfs/dbraw/zinc/85/01/37/921850137.db2.gz MCNMPNBCFVRFCV-YZIHRLCOSA-N 2 0 416.569 4.159 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2cc(Cl)ccc2F)c1)C1CCOCC1 ZINC000513506882 921855062 /nfs/dbraw/zinc/85/50/62/921855062.db2.gz SGCPVEJZUWYVOF-UHFFFAOYSA-N 2 0 406.929 4.259 20 0 HIADRP Cc1ccc([C@@H](OC[C@@H](O)C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c2ccccc2)cc1 ZINC000514005693 922329724 /nfs/dbraw/zinc/32/97/24/922329724.db2.gz PIIKEQMCSQSTLR-UIOOFZCWSA-N 2 0 410.602 4.267 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000514023327 922345943 /nfs/dbraw/zinc/34/59/43/922345943.db2.gz WMLNOOSSHQKKDU-RDPSFJRHSA-N 2 0 408.590 4.163 20 0 HIADRP O=C(c1ccccc1)N1CC[C@H](C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000514082096 922405898 /nfs/dbraw/zinc/40/58/98/922405898.db2.gz FPWWWKSLONUVEW-ARMFNRFLSA-N 2 0 417.597 4.135 20 0 HIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(NC(=O)CCCOc3ccccc3)cc2)[C@H]2CCC[C@H]21 ZINC000514094649 922419945 /nfs/dbraw/zinc/41/99/45/922419945.db2.gz NSEUPSXHXVSNHZ-DSNGMDLFSA-N 2 0 421.585 4.447 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccc(OC(F)(F)F)cc1 ZINC000514100655 922427125 /nfs/dbraw/zinc/42/71/25/922427125.db2.gz XAOIQXRUQBEZPH-HXUWFJFHSA-N 2 0 422.495 4.363 20 0 HIADRP C[C@@H]1CCCC[NH+]1C[C@@H]1CCCN(CCN2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)C1 ZINC000514111680 922443053 /nfs/dbraw/zinc/44/30/53/922443053.db2.gz AQIDVMZHNHUORA-XDZVQPMWSA-N 2 0 418.714 4.159 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)NC[C@H](c2cccs2)[NH+]2CCC(C)CC2)CC1 ZINC000514197092 922535465 /nfs/dbraw/zinc/53/54/65/922535465.db2.gz ITWKCOGLSZADHL-HXUWFJFHSA-N 2 0 406.640 4.085 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000517547777 924258598 /nfs/dbraw/zinc/25/85/98/924258598.db2.gz OGWWOPGHGCLIBK-QGZVFWFLSA-N 2 0 420.395 4.072 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2nc(-c3ccccc3)cs2)[C@H](c2ccccc2)C1 ZINC000518766356 927483394 /nfs/dbraw/zinc/48/33/94/927483394.db2.gz ZTCOHZPSSHHAOR-QHCPKHFHSA-N 2 0 406.599 4.279 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(=O)N(C)Cc1cccc(F)c1 ZINC000518842291 927542907 /nfs/dbraw/zinc/54/29/07/927542907.db2.gz QJOWXLSWFCEGSU-UXHICEINSA-N 2 0 411.565 4.337 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NCc1cccc(C[NH+]2CCCCCC2)c1)c1cccs1 ZINC000520296831 928458161 /nfs/dbraw/zinc/45/81/61/928458161.db2.gz WHXYBCNETAINIK-OAQYLSRUSA-N 2 0 414.619 4.226 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000520960149 928890623 /nfs/dbraw/zinc/89/06/23/928890623.db2.gz LZFDIVTXNRLROD-GOSISDBHSA-N 2 0 403.517 4.120 20 0 HIADRP C[C@H](CC[NH+](C)C)NC(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000521015833 928932878 /nfs/dbraw/zinc/93/28/78/928932878.db2.gz KBXQDNYBNHDADE-HXUWFJFHSA-N 2 0 408.590 4.089 20 0 HIADRP C[NH+](C)CCOc1cccc(NC(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)c1 ZINC000521836282 929487713 /nfs/dbraw/zinc/48/77/13/929487713.db2.gz IWHABACDXUIOGZ-UHFFFAOYSA-N 2 0 424.589 4.325 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1)c1ccsc1 ZINC000521906037 929550012 /nfs/dbraw/zinc/55/00/12/929550012.db2.gz SDJLPLVITAMSOR-JOCHJYFZSA-N 2 0 414.619 4.226 20 0 HIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)cc1Cl ZINC000522009016 929617407 /nfs/dbraw/zinc/61/74/07/929617407.db2.gz VZYWKUBBMPAEDP-QGZVFWFLSA-N 2 0 417.981 4.269 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000524737451 929814513 /nfs/dbraw/zinc/81/45/13/929814513.db2.gz XIUPJAHOWZCLMI-HRAATJIYSA-N 2 0 411.571 4.369 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+]Cc2c(Cl)cccc2OCc2ccccc2Cl)CC1 ZINC000524884372 929871883 /nfs/dbraw/zinc/87/18/83/929871883.db2.gz DHWCKCNFBYNOPL-UHFFFAOYSA-N 2 0 409.357 4.119 20 0 HIADRP C[C@@H]1C[N@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC[C@@H]1c1ccccc1 ZINC000525122898 930049088 /nfs/dbraw/zinc/04/90/88/930049088.db2.gz PYGUGZDEVDALCA-BWKNWUBXSA-N 2 0 405.586 4.024 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CCC[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000525402566 930220452 /nfs/dbraw/zinc/22/04/52/930220452.db2.gz PKYBYSZHTJPOOH-XPWALMASSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)c2oc3ccccc3c2C[NH+](C)C)CC1 ZINC000525754733 930431234 /nfs/dbraw/zinc/43/12/34/930431234.db2.gz YMNUIRJYWRBVIQ-SFHVURJKSA-N 2 0 405.542 4.450 20 0 HIADRP C[N@@H+]1CC[C@@H](NC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)[C@H]1c1ccccc1 ZINC000530356645 930692373 /nfs/dbraw/zinc/69/23/73/930692373.db2.gz MXDCBWYBJHZCTC-DNQXCXABSA-N 2 0 406.574 4.282 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)N1CC[C@H](C[NH+]2CCCC2)C1)c1cccc(C(F)(F)F)c1 ZINC000530582515 930758535 /nfs/dbraw/zinc/75/85/35/930758535.db2.gz JKZAUZIHVBOAAB-XLIONFOSSA-N 2 0 411.512 4.033 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)[C@@H]2CCCC[NH+]2Cc2ccccc2)[C@H]1c1cccs1 ZINC000530820764 930831467 /nfs/dbraw/zinc/83/14/67/930831467.db2.gz UNLUDJNQOWQQJG-GIWBLDEGSA-N 2 0 411.615 4.302 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000530969218 930871693 /nfs/dbraw/zinc/87/16/93/930871693.db2.gz NGYHUPWOFGKWFE-URXFXBBRSA-N 2 0 420.601 4.118 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)CC1 ZINC000531205419 930964293 /nfs/dbraw/zinc/96/42/93/930964293.db2.gz PLNKKTQOXREUPI-NRFANRHFSA-N 2 0 420.601 4.297 20 0 HIADRP Fc1ccc(-c2n[nH]cc2C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000531381046 931038359 /nfs/dbraw/zinc/03/83/59/931038359.db2.gz RTEJGAZDABQQAZ-UHFFFAOYSA-N 2 0 422.548 4.377 20 0 HIADRP COc1cc(C[NH+]2CCC(CC[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)ccc1OC(F)F ZINC000531416802 931047969 /nfs/dbraw/zinc/04/79/69/931047969.db2.gz GVPOOXUFCUPZOS-IAGOWNOFSA-N 2 0 412.521 4.008 20 0 HIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3ccc(OCc4ccncc4)cc3)CC2)C[C@@H](C)O1 ZINC000531416849 931048115 /nfs/dbraw/zinc/04/81/15/931048115.db2.gz PPZIESRRYCRUDJ-FGZHOGPDSA-N 2 0 423.601 4.372 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000531532220 931094588 /nfs/dbraw/zinc/09/45/88/931094588.db2.gz OTWOSHXSDBYUPK-UHFFFAOYSA-N 3 0 406.618 4.104 20 0 HIADRP C[C@H](CC[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)[N@H+](C)Cc1ccccc1 ZINC000531595483 931114850 /nfs/dbraw/zinc/11/48/50/931114850.db2.gz LRYZJCPITDWVEL-JOCHJYFZSA-N 3 0 408.634 4.217 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531682249 931150648 /nfs/dbraw/zinc/15/06/48/931150648.db2.gz XVFJVRWSPOIUKD-OALUTQOASA-N 2 0 400.588 4.173 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531682251 931151010 /nfs/dbraw/zinc/15/10/10/931151010.db2.gz XVFJVRWSPOIUKD-RTBURBONSA-N 2 0 400.588 4.173 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NC[C@H]1CC[N@H+](CC(C)C)C1)c1cccc(C(F)(F)F)c1 ZINC000531800672 931202924 /nfs/dbraw/zinc/20/29/24/931202924.db2.gz VJAFJTOGWNAJGU-YLJYHZDGSA-N 2 0 413.528 4.182 20 0 HIADRP CC1CCN(c2ccc(C[NH2+]Cc3ccccc3N(C)C3CC[NH+](C)CC3)cn2)CC1 ZINC000531850729 931221109 /nfs/dbraw/zinc/22/11/09/931221109.db2.gz QMBMLEDIPRXUSH-UHFFFAOYSA-N 2 0 421.633 4.138 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000531936223 931252751 /nfs/dbraw/zinc/25/27/51/931252751.db2.gz YBRZRRDEQUQSKS-IAGOWNOFSA-N 2 0 410.400 4.268 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CCC1CC[NH+](C)CC1 ZINC000531958311 931264344 /nfs/dbraw/zinc/26/43/44/931264344.db2.gz HTSGTBYMFDDQHW-ZDUSSCGKSA-N 2 0 405.892 4.397 20 0 HIADRP C[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000531958750 931264733 /nfs/dbraw/zinc/26/47/33/931264733.db2.gz WWQBFNWPRUFLDK-PGRDOPGGSA-N 2 0 421.507 4.267 20 0 HIADRP O[C@H]1CCC[C@H]1[NH+]1CCC([NH2+]Cc2cccc(OCCCc3ccccc3)c2)CC1 ZINC000532016275 931285727 /nfs/dbraw/zinc/28/57/27/931285727.db2.gz YBRMHKQDWYRPAR-FTJBHMTQSA-N 2 0 408.586 4.166 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cc(OC)ccc2OC(F)F)CC1 ZINC000532046552 931296299 /nfs/dbraw/zinc/29/62/99/931296299.db2.gz CJCHBYHBAYLQFZ-UHFFFAOYSA-N 2 0 419.516 4.118 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000532106823 931314423 /nfs/dbraw/zinc/31/44/23/931314423.db2.gz HWAXJFYOBLTSRC-VXKWHMMOSA-N 3 0 400.655 4.065 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc2cc(OC)ccc2c1 ZINC000532197399 931345545 /nfs/dbraw/zinc/34/55/45/931345545.db2.gz SSWKAULQARJMHB-DEOSSOPVSA-N 2 0 404.558 4.236 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000532205252 931349525 /nfs/dbraw/zinc/34/95/25/931349525.db2.gz AOCBEKQJWHXGGK-LJQANCHMSA-N 2 0 400.588 4.317 20 0 HIADRP CC[C@@H]([NH2+][C@@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Cl)ccc1OC ZINC000532221228 931359367 /nfs/dbraw/zinc/35/93/67/931359367.db2.gz DOKGDEJRDQIBTN-YADHBBJMSA-N 2 0 401.982 4.378 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cc1 ZINC000532248750 931371052 /nfs/dbraw/zinc/37/10/52/931371052.db2.gz IVYLFSAAZYIEKD-LJQANCHMSA-N 2 0 424.589 4.024 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)CC1 ZINC000532295904 931389395 /nfs/dbraw/zinc/38/93/95/931389395.db2.gz OLVGGDKLMQVPMJ-UHFFFAOYSA-N 3 0 408.634 4.349 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(OCc2ccccc2)cc1 ZINC000532451536 931439750 /nfs/dbraw/zinc/43/97/50/931439750.db2.gz DYDSHLBZTYLYBT-OAQYLSRUSA-N 2 0 416.569 4.263 20 0 HIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000532453764 931441247 /nfs/dbraw/zinc/44/12/47/931441247.db2.gz MWDDHROYTSGHAE-GOSISDBHSA-N 2 0 421.614 4.040 20 0 HIADRP CCc1ccc([C@@H](NC(=O)C[NH+]2CCC(CC[NH+](C)C)CC2)c2cccs2)cc1 ZINC000532486232 931457521 /nfs/dbraw/zinc/45/75/21/931457521.db2.gz LIBGRLDNOCEISM-XMMPIXPASA-N 2 0 413.631 4.180 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000532500690 931464098 /nfs/dbraw/zinc/46/40/98/931464098.db2.gz KXQMTJPJOMBINJ-AWEZNQCLSA-N 2 0 407.917 4.056 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2(CC)CC[NH+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC000532814239 931636867 /nfs/dbraw/zinc/63/68/67/931636867.db2.gz VIXKAZJEYRTIFN-GMAHTHKFSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000532977951 931724270 /nfs/dbraw/zinc/72/42/70/931724270.db2.gz XXSDKFSZELPPDC-KNQAVFIVSA-N 2 0 409.599 4.052 20 0 HIADRP Cc1ccc(C[N@H+](CC(=O)NC2CC[NH+](C3CC3)CC2)[C@H]2CCc3ccccc32)cc1 ZINC000533350382 931845373 /nfs/dbraw/zinc/84/53/73/931845373.db2.gz HAFODGHYWUORFP-SANMLTNESA-N 2 0 417.597 4.228 20 0 HIADRP C[C@@H]([NH2+][C@@H](c1ccc(F)cc1)C1CCC1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000533377046 931853036 /nfs/dbraw/zinc/85/30/36/931853036.db2.gz XGVLAYWILWLBHL-KBMIEXCESA-N 2 0 423.576 4.426 20 0 HIADRP O=C(CC[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1)NC(c1ccccc1)c1ccccc1 ZINC000533426402 931864969 /nfs/dbraw/zinc/86/49/69/931864969.db2.gz CJZXERYEEQIPPD-DEOSSOPVSA-N 2 0 405.586 4.233 20 0 HIADRP c1cc(C[NH+]2CC[C@@H](C3CCOCC3)C2)cc(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)c1 ZINC000533669624 931960844 /nfs/dbraw/zinc/96/08/44/931960844.db2.gz HTOWSUMJKFKRIV-CLJLJLNGSA-N 2 0 412.618 4.184 20 0 HIADRP c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+][C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)CC2)cc1 ZINC000534064220 932243657 /nfs/dbraw/zinc/24/36/57/932243657.db2.gz RNQNYZGKESRAQG-NXCFDTQHSA-N 2 0 417.597 4.056 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)NCC(C)(C)[NH+]2CCCCC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000534234222 932353901 /nfs/dbraw/zinc/35/39/01/932353901.db2.gz BRIWIJDDLPVZTP-YLJYHZDGSA-N 2 0 424.992 4.036 20 0 HIADRP COc1ccc(C(=O)Nc2cccc(C[NH2+]Cc3ccc(C[NH+](C)C)c(F)c3)c2)cc1 ZINC000534239808 932358731 /nfs/dbraw/zinc/35/87/31/932358731.db2.gz BTCOTXJNEYHWRU-UHFFFAOYSA-N 2 0 421.516 4.438 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cnn(-c3ccc(Br)cc3)c2)CC1 ZINC000535083334 932901427 /nfs/dbraw/zinc/90/14/27/932901427.db2.gz YPFZBAIUQNOSFE-UHFFFAOYSA-N 2 0 405.384 4.187 20 0 HIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+]CCCC[NH+]1CCN(c2cccc(C)c2)CC1 ZINC000535186517 933002117 /nfs/dbraw/zinc/00/21/17/933002117.db2.gz PRTIMDXOZXOIOZ-UHFFFAOYSA-N 2 0 411.638 4.255 20 0 HIADRP Clc1cc2c(c(Br)c1)CC[C@H]2NC1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000535509181 933202983 /nfs/dbraw/zinc/20/29/83/933202983.db2.gz VRSAXCFMVZZLHK-BFUOFWGJSA-N 2 0 413.787 4.180 20 0 HIADRP CN(c1ccccc1C[NH2+][C@H]1CCCN(c2ccccc2F)C1)C1CC[NH+](C)CC1 ZINC000535691232 933346979 /nfs/dbraw/zinc/34/69/79/933346979.db2.gz WKYUROWMJNBKDU-NRFANRHFSA-N 2 0 410.581 4.115 20 0 HIADRP CC(C)c1nn(-c2ccc(Br)cc2)cc1CNC[C@H]1CCC[N@H+](C)C1 ZINC000535714301 933366292 /nfs/dbraw/zinc/36/62/92/933366292.db2.gz RCTUAIBORQRZHW-MRXNPFEDSA-N 2 0 405.384 4.190 20 0 HIADRP CC[C@H]([NH2+]CCCC[NH+]1CCN(CC)CC1)c1cc(F)cc(Br)c1 ZINC000537296155 933701940 /nfs/dbraw/zinc/70/19/40/933701940.db2.gz UNUKZGOFSKIOAO-IBGZPJMESA-N 2 0 400.380 4.047 20 0 HIADRP c1cn2c(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)c(C3CC3)nc2s1 ZINC000537313109 933712535 /nfs/dbraw/zinc/71/25/35/933712535.db2.gz XPZIVKCOIXYIAA-UHFFFAOYSA-N 2 0 424.614 4.434 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)CC1 ZINC000562450014 945078839 /nfs/dbraw/zinc/07/88/39/945078839.db2.gz REUDXQXLNCFOAN-RCSZBHJWSA-N 3 0 420.645 4.008 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)CC1 ZINC000562871958 945133794 /nfs/dbraw/zinc/13/37/94/945133794.db2.gz VJGNJEMFQGMKMA-AREMUKBSSA-N 2 0 417.597 4.228 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+]C1CC(c2ccc(C(F)(F)F)cc2)C1 ZINC000562894401 945142067 /nfs/dbraw/zinc/14/20/67/945142067.db2.gz PZQQRUAQTDDVEH-UHFFFAOYSA-N 2 0 407.480 4.467 20 0 HIADRP CC(C)N1CC[C@@H](NC(=O)c2cccc(C[NH+](C)C)c2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000537521197 938315298 /nfs/dbraw/zinc/31/52/98/938315298.db2.gz MSKKWWKDDAWXJF-YADHBBJMSA-N 2 0 417.956 4.495 20 0 HIADRP CC(C)N1CC[C@@H](NC(=O)c2cccc(C[NH+](C)C)c2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000537521195 938315395 /nfs/dbraw/zinc/31/53/95/938315395.db2.gz MSKKWWKDDAWXJF-FGZHOGPDSA-N 2 0 417.956 4.495 20 0 HIADRP CC[N@@H+](Cc1c[nH]nc1-c1ccc(OC)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000537660481 938348809 /nfs/dbraw/zinc/34/88/09/938348809.db2.gz GAHOHBRHVUHRTD-OAQYLSRUSA-N 2 0 404.558 4.429 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2c(C)nn(-c3ccc(F)cc3F)c2C)CC1 ZINC000537661065 938349219 /nfs/dbraw/zinc/34/92/19/938349219.db2.gz MOCFHWXVTDRXRG-UHFFFAOYSA-N 2 0 420.548 4.090 20 0 HIADRP C[C@H]1C[C@@H](CC[NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)C[N@@H+]1Cc1ccccc1 ZINC000537940330 938425082 /nfs/dbraw/zinc/42/50/82/938425082.db2.gz FMLUBHJBJKFMRS-APAYAGTCSA-N 2 0 406.618 4.182 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCc3c2cc(Br)cc3Cl)CC1 ZINC000537957737 938433403 /nfs/dbraw/zinc/43/34/03/938433403.db2.gz SGHOVQPSCODTGZ-GUDVDZBRSA-N 2 0 413.787 4.057 20 0 HIADRP OC[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1 ZINC000537958500 938433406 /nfs/dbraw/zinc/43/34/06/938433406.db2.gz WFCCSUPJXVSJSB-NRFANRHFSA-N 2 0 420.519 4.153 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@H]1CCN(c3c(F)cccc3F)C1)c1ccccc1O2 ZINC000538293729 938585103 /nfs/dbraw/zinc/58/51/03/938585103.db2.gz IVXKQZPLYZWXEV-UWJYYQICSA-N 2 0 413.512 4.121 20 0 HIADRP CCOc1cccc2cc([C@@H](C)[NH2+]CCCN3CCN(c4cc[nH+]cc4)CC3)oc21 ZINC000538393935 938610043 /nfs/dbraw/zinc/61/00/43/938610043.db2.gz WUNMVBWTYUKLFE-LJQANCHMSA-N 2 0 408.546 4.089 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H](CC3CCC3)c3ccccc3)c2)C1 ZINC000538396284 938610794 /nfs/dbraw/zinc/61/07/94/938610794.db2.gz YKCSVOUOSNJIMV-DQEYMECFSA-N 2 0 405.586 4.405 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@H](C)Nc2ccc(N3CCC([NH+](C)C)CC3)cn2)cc1 ZINC000538591051 938657106 /nfs/dbraw/zinc/65/71/06/938657106.db2.gz WSVMVFLMZMZRIT-SFHVURJKSA-N 2 0 424.593 4.315 20 0 HIADRP CC(C)N1CC[C@H](NC(=O)c2ccc(C[NH+](C)C)cc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000538624217 938664578 /nfs/dbraw/zinc/66/45/78/938664578.db2.gz NMMNZQZFRRHGDI-VXKWHMMOSA-N 2 0 417.956 4.495 20 0 HIADRP CCCn1c2ccccc2nc1C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000538724123 938691813 /nfs/dbraw/zinc/69/18/13/938691813.db2.gz UBJIORMRYSNORE-UHFFFAOYSA-N 2 0 411.638 4.074 20 0 HIADRP Brc1ccc2c(c1)[C@@H]([NH+]1CCC(OCC[NH+]3CCCC3)CC1)CCC2 ZINC000538781936 938709106 /nfs/dbraw/zinc/70/91/06/938709106.db2.gz GUGVUPOONHYGFX-NRFANRHFSA-N 2 0 407.396 4.403 20 0 HIADRP CC(C)[NH+]1CCN(c2ccc(C(=O)Nc3cccc(CC[NH+]4CCCC4)c3)cc2)CC1 ZINC000538805099 938717269 /nfs/dbraw/zinc/71/72/69/938717269.db2.gz ZXWLDXBHHFAMGL-UHFFFAOYSA-N 2 0 420.601 4.108 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)ccn1 ZINC000539047370 938781767 /nfs/dbraw/zinc/78/17/67/938781767.db2.gz QMWTWNRFRYHTTJ-QHCPKHFHSA-N 2 0 411.496 4.374 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H]2CCc3c2cc(Br)cc3Cl)ccn1 ZINC000539046938 938781892 /nfs/dbraw/zinc/78/18/92/938781892.db2.gz KSDSWFQGZMNOGN-SFHVURJKSA-N 2 0 424.770 4.215 20 0 HIADRP C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000539071288 938793028 /nfs/dbraw/zinc/79/30/28/938793028.db2.gz IMVSBUDFCQSGAC-HNNXBMFYSA-N 2 0 408.373 4.006 20 0 HIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CCN(C(=O)NC3CCCCC3)CC2)CC1 ZINC000539078796 938796705 /nfs/dbraw/zinc/79/67/05/938796705.db2.gz CAJWTGASNMNVIY-WMZHIEFXSA-N 2 0 404.643 4.126 20 0 HIADRP Cc1ccc(Br)cc1NC(=O)CC[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000539082626 938798930 /nfs/dbraw/zinc/79/89/30/938798930.db2.gz SBAXVGHZZVXSDN-UHFFFAOYSA-N 2 0 408.384 4.083 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1cccc(N2CCCC2=O)c1 ZINC000539091631 938801285 /nfs/dbraw/zinc/80/12/85/938801285.db2.gz YVGKGYJSKCDAKP-QFIPXVFZSA-N 2 0 420.601 4.066 20 0 HIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]C[C@H](C)C[NH2+][C@@H](C)c2cccc(NC(C)=O)c2)c1 ZINC000539231586 938822608 /nfs/dbraw/zinc/82/26/08/938822608.db2.gz ZDQSRUFBVAXFMF-BCDXTJNWSA-N 2 0 410.562 4.241 20 0 HIADRP Cc1ccc(NC(=O)COc2ccc(CC[NH2+]C3CC[NH+](CC4CC4)CC3)cc2)cc1 ZINC000539315394 938839763 /nfs/dbraw/zinc/83/97/63/938839763.db2.gz VAWLHOHVVXIAGZ-UHFFFAOYSA-N 2 0 421.585 4.019 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccccc2C[NH+]2CCC(O)CC2)cc1 ZINC000539322313 938841078 /nfs/dbraw/zinc/84/10/78/938841078.db2.gz MWJQBEDJLWICHF-UHFFFAOYSA-N 2 0 409.574 4.128 20 0 HIADRP COc1ccc(CCC[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1OC ZINC000539378170 938851643 /nfs/dbraw/zinc/85/16/43/938851643.db2.gz YKKFWFRVBIRDLR-NRFANRHFSA-N 2 0 410.558 4.214 20 0 HIADRP CC[C@H]([NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1ccc2c(c1)OCCO2 ZINC000539393251 938853781 /nfs/dbraw/zinc/85/37/81/938853781.db2.gz LJWNVOAIIKVVJW-LEWJYISDSA-N 2 0 408.542 4.487 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c2ccccc21 ZINC000539408056 938856119 /nfs/dbraw/zinc/85/61/19/938856119.db2.gz VEKPWVWMRAHOMZ-VXKWHMMOSA-N 2 0 405.542 4.062 20 0 HIADRP COCCOCc1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000563564204 945216357 /nfs/dbraw/zinc/21/63/57/945216357.db2.gz HYMZEPATNBSPIU-UODIDJSMSA-N 2 0 408.586 4.240 20 0 HIADRP C[NH+](C)CCOC1CC[NH+](Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000539832291 938951913 /nfs/dbraw/zinc/95/19/13/938951913.db2.gz OARLSOALTWUTAY-UHFFFAOYSA-N 2 0 402.966 4.462 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H](c3cccs3)C3CCCC3)c2)C1 ZINC000540087366 939065519 /nfs/dbraw/zinc/06/55/19/939065519.db2.gz ZSDKIJMNFKLQCW-FYYLOGMGSA-N 2 0 411.615 4.467 20 0 HIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CCN(C(=O)CCc3ccccc3)CC2)CC1 ZINC000540119230 939079635 /nfs/dbraw/zinc/07/96/35/939079635.db2.gz LZGOYNUPSLWUJR-SQJMNOBHSA-N 2 0 411.634 4.243 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)ccn1 ZINC000540144323 939089983 /nfs/dbraw/zinc/08/99/83/939089983.db2.gz NGSTWGAMPVIVBE-IBGZPJMESA-N 2 0 408.571 4.313 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@H](C)c3nc4ccccc4n3C)CC2)c1 ZINC000540259114 939175567 /nfs/dbraw/zinc/17/55/67/939175567.db2.gz QMLJVSLFSIWGHF-OAQYLSRUSA-N 2 0 405.590 4.135 20 0 HIADRP CC(C)[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1 ZINC000540302608 939187613 /nfs/dbraw/zinc/18/76/13/939187613.db2.gz PTWSLEWXVQXTBN-OAQYLSRUSA-N 2 0 401.986 4.019 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CC(C)(C)c1ccc3c(c1)OCCO3)c1ccccc1O2 ZINC000540475869 939267376 /nfs/dbraw/zinc/26/73/76/939267376.db2.gz SNXKJWJGTMJJJL-NRFANRHFSA-N 2 0 422.569 4.313 20 0 HIADRP Cc1ccc(Br)cc1NC(=O)CC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000540984133 939424883 /nfs/dbraw/zinc/42/48/83/939424883.db2.gz YMAOWOGRLOMFIJ-UHFFFAOYSA-N 2 0 422.411 4.473 20 0 HIADRP CSC[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000540986271 939425198 /nfs/dbraw/zinc/42/51/98/939425198.db2.gz CYUMSMGWIGFMPL-LJQANCHMSA-N 2 0 424.536 4.046 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)CC1 ZINC000541245436 939487379 /nfs/dbraw/zinc/48/73/79/939487379.db2.gz AIIQPVDVOCEVQI-UHFFFAOYSA-N 2 0 412.578 4.182 20 0 HIADRP Cc1cc([C@@H]([NH2+]CCc2ccc(OCC[NH+](C)C)cc2)c2cccnc2)ccc1F ZINC000541544613 939549188 /nfs/dbraw/zinc/54/91/88/939549188.db2.gz XULOPYLPXQIOGX-RUZDIDTESA-N 2 0 407.533 4.391 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000541545502 939550406 /nfs/dbraw/zinc/55/04/06/939550406.db2.gz IHQOJGZRSBUMHZ-PBQROFAYSA-N 2 0 410.558 4.046 20 0 HIADRP Cc1ccc(Cl)c(OC[C@H](O)C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000541581945 939559838 /nfs/dbraw/zinc/55/98/38/939559838.db2.gz IJIJVFJOCZEYAZ-OAQYLSRUSA-N 2 0 417.981 4.022 20 0 HIADRP OC[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1ccc(OC(F)(F)F)cc1 ZINC000541910814 939651747 /nfs/dbraw/zinc/65/17/47/939651747.db2.gz XSRBMTIPXOCCKV-GOSISDBHSA-N 2 0 414.512 4.123 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CC[C@@H](C3CC[NH+](C)CC3)C2)c1 ZINC000542224630 939764133 /nfs/dbraw/zinc/76/41/33/939764133.db2.gz IQQNOWIEXMFGQN-RUZDIDTESA-N 2 0 405.586 4.123 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](c3ccc(F)cc3)c3cnccn3)CC2)cc1 ZINC000542479443 939830188 /nfs/dbraw/zinc/83/01/88/939830188.db2.gz VEFVLGRKNVATKS-VWLOTQADSA-N 2 0 420.532 4.216 20 0 HIADRP Cc1ccccc1[C@@H](CN1CCOCC1)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000542478557 939830199 /nfs/dbraw/zinc/83/01/99/939830199.db2.gz PLCNWTYJTPBFEY-AREMUKBSSA-N 2 0 407.602 4.144 20 0 HIADRP C[NH+](C)CCn1ccc2ccc(NC(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)cc21 ZINC000542505204 939834042 /nfs/dbraw/zinc/83/40/42/939834042.db2.gz XHGDICCZCODOGU-UHFFFAOYSA-N 2 0 418.585 4.444 20 0 HIADRP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000542846348 939862668 /nfs/dbraw/zinc/86/26/68/939862668.db2.gz JMAIZSKNODMRKK-RBBKRZOGSA-N 2 0 400.950 4.219 20 0 HIADRP Fc1ccc([C@@H]([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)c2cnccn2)cc1 ZINC000543422615 940060284 /nfs/dbraw/zinc/06/02/84/940060284.db2.gz FHGOZXCPVCZAGD-RUZDIDTESA-N 2 0 420.532 4.012 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)[NH+]2CCCC2)o1 ZINC000543431468 940062274 /nfs/dbraw/zinc/06/22/74/940062274.db2.gz JDRFXFOQALSOML-JOCHJYFZSA-N 2 0 409.574 4.143 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1ccc(Oc2ccccc2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000543458811 940068699 /nfs/dbraw/zinc/06/86/99/940068699.db2.gz KSIKYFBGJFKNGV-XJUOHMSHSA-N 2 0 424.585 4.461 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1ccc(Oc2ccccc2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000543458808 940068786 /nfs/dbraw/zinc/06/87/86/940068786.db2.gz KSIKYFBGJFKNGV-FUDKSRODSA-N 2 0 424.585 4.461 20 0 HIADRP C[C@H]1[N@H+](Cc2ccccc2C[NH+]2CCC3(CCOCC3)[C@@H]2C)CCC12CCOCC2 ZINC000543575681 940116171 /nfs/dbraw/zinc/11/61/71/940116171.db2.gz ZMSMYYIDCIHFLX-SZPZYZBQSA-N 2 0 412.618 4.469 20 0 HIADRP CSC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(C(F)(F)F)cc1 ZINC000543777277 940183342 /nfs/dbraw/zinc/18/33/42/940183342.db2.gz SUMUXYKUMDZXMQ-NHCUHLMSSA-N 2 0 424.532 4.466 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1OC(F)F ZINC000543778051 940184402 /nfs/dbraw/zinc/18/44/02/940184402.db2.gz RUHNORGRXZOMTI-HNAYVOBHSA-N 2 0 408.464 4.235 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COC(c1ccccc1)c1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544425722 940424370 /nfs/dbraw/zinc/42/43/70/940424370.db2.gz XVKVXLFXCYQJPJ-NZJKTDFXSA-N 2 0 422.613 4.396 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3cccc(OCc4ccccc4)c3)CC2)CC1 ZINC000544595301 940486583 /nfs/dbraw/zinc/48/65/83/940486583.db2.gz TZKCPWNXPJRWCE-UHFFFAOYSA-N 2 0 407.602 4.115 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)ccn1 ZINC000544827616 940517786 /nfs/dbraw/zinc/51/77/86/940517786.db2.gz KZKNKSKYLZVHHU-QFIPXVFZSA-N 2 0 410.949 4.144 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000564007403 945345955 /nfs/dbraw/zinc/34/59/55/945345955.db2.gz COULEEAFGMBIRI-NOOIUNMQSA-N 2 0 406.618 4.184 20 0 HIADRP COc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)CC3 ZINC000546606678 940860708 /nfs/dbraw/zinc/86/07/08/940860708.db2.gz JOQGVMWSQPXTFZ-RTWAWAEBSA-N 2 0 403.570 4.188 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@H](Cc2ccc(Cl)cc2)C(N)=O)cc1 ZINC000546886480 940901692 /nfs/dbraw/zinc/90/16/92/940901692.db2.gz VPRITHOXPJVIHY-XMMPIXPASA-N 2 0 421.972 4.255 20 0 HIADRP C[C@@H]([NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547504800 941065957 /nfs/dbraw/zinc/06/59/57/941065957.db2.gz JUUROCZHWKTYEX-KNQAVFIVSA-N 2 0 413.556 4.429 20 0 HIADRP C[C@H]([NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547504802 941066139 /nfs/dbraw/zinc/06/61/39/941066139.db2.gz JUUROCZHWKTYEX-UGKGYDQZSA-N 2 0 413.556 4.429 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)C1CC[NH+](C2CC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000549236629 941172950 /nfs/dbraw/zinc/17/29/50/941172950.db2.gz LTOOAFLBIIHHCC-HXUWFJFHSA-N 2 0 411.512 4.079 20 0 HIADRP COC(=O)c1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[nH]1 ZINC000549447192 941191029 /nfs/dbraw/zinc/19/10/29/941191029.db2.gz YTUYHQWFJZMKHT-PCNOZBDPSA-N 2 0 401.938 4.158 20 0 HIADRP COc1cc(C[NH+]2CCCO[C@H](C(C)C)C2)cc(C[N@@H+]2CCCO[C@H](C(C)C)C2)c1 ZINC000550186417 941295660 /nfs/dbraw/zinc/29/56/60/941295660.db2.gz RNQXMIJOVRZSJP-DQEYMECFSA-N 2 0 418.622 4.189 20 0 HIADRP CC(=O)N1CCC[C@@H](C[NH2+][C@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)C1 ZINC000550901428 941381084 /nfs/dbraw/zinc/38/10/84/941381084.db2.gz HRSDRYLPGYZIHT-XUZZJYLKSA-N 2 0 403.586 4.227 20 0 HIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551264481 941438748 /nfs/dbraw/zinc/43/87/48/941438748.db2.gz ZVFYMHYDLCRNKA-GPUOULLFSA-N 2 0 408.586 4.281 20 0 HIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000551263862 941438820 /nfs/dbraw/zinc/43/88/20/941438820.db2.gz VDEJSEYYTAQTHG-YKSBVNFPSA-N 2 0 421.585 4.224 20 0 HIADRP O=C(C[NH2+][C@@H]1CCCCC[C@H]1c1ccc(Cl)cc1)NC1CC[NH+](C2CC2)CC1 ZINC000551425225 941476373 /nfs/dbraw/zinc/47/63/73/941476373.db2.gz WUIFCBVYAWTFNV-FCHUYYIVSA-N 2 0 403.998 4.089 20 0 HIADRP COc1ncc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1Cl ZINC000551530206 941495831 /nfs/dbraw/zinc/49/58/31/941495831.db2.gz OZEOGWWUDOGIOW-GJZGRUSLSA-N 2 0 406.933 4.046 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N2CCN(c3cc[nH+]c4ccccc43)CC2)cc1 ZINC000552149575 941593683 /nfs/dbraw/zinc/59/36/83/941593683.db2.gz WSQGFEYEZSYUIZ-UHFFFAOYSA-N 2 0 402.542 4.039 20 0 HIADRP COc1cc([C@H](C)[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)ccc1OCCO ZINC000552252311 941613986 /nfs/dbraw/zinc/61/39/86/941613986.db2.gz IEODQQUZODPVNH-BVVFMGSASA-N 2 0 412.574 4.160 20 0 HIADRP C[NH+](C)C1CCC([NH2+][C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000552252628 941614641 /nfs/dbraw/zinc/61/46/41/941614641.db2.gz RWWAXCCSVNSHBL-QETWGEEDSA-N 2 0 421.006 4.295 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCCC2)cc1)N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000552336303 941635944 /nfs/dbraw/zinc/63/59/44/941635944.db2.gz YFPHIBSIZVUINP-MHZLTWQESA-N 2 0 417.597 4.411 20 0 HIADRP O=C([C@@H]1CCC[N@@H+]1Cc1ccccc1)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000552518292 941693154 /nfs/dbraw/zinc/69/31/54/941693154.db2.gz ZFNLPPWGSQKYOL-VWLOTQADSA-N 2 0 417.597 4.166 20 0 HIADRP O=C([C@@H]1CCCC[N@@H+]1C1CCCC1)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000554151507 942050562 /nfs/dbraw/zinc/05/05/62/942050562.db2.gz FVNWATPHRAFCRJ-DEOSSOPVSA-N 2 0 409.618 4.298 20 0 HIADRP O=C(NCCC[NH+]1CCCC1)C1CC[NH+](Cc2cccc(Oc3ccccc3)c2)CC1 ZINC000554875535 942304083 /nfs/dbraw/zinc/30/40/83/942304083.db2.gz GGGIKSBKDUEHKZ-UHFFFAOYSA-N 2 0 421.585 4.293 20 0 HIADRP CN(C(=O)c1ccc(C[NH+]2CCCC2)cc1)c1ccc(OCC[NH+]2CCCC2)cc1 ZINC000555011956 942356115 /nfs/dbraw/zinc/35/61/15/942356115.db2.gz VDGACKSECPKZFL-UHFFFAOYSA-N 2 0 407.558 4.034 20 0 HIADRP C[NH+](C)C[C@@H](NC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Cl)cc1 ZINC000555113591 942388712 /nfs/dbraw/zinc/38/87/12/942388712.db2.gz VHLRZESVZDWNQV-JOCHJYFZSA-N 2 0 414.981 4.038 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555236438 942440385 /nfs/dbraw/zinc/44/03/85/942440385.db2.gz XQGCQLIEASGYGZ-XZZVZQAVSA-N 2 0 408.586 4.458 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3cccc(Br)c3C2)[C@H](C)C1 ZINC000555545765 942636538 /nfs/dbraw/zinc/63/65/38/942636538.db2.gz CQKXDSHOIOMWAZ-BLIXFSHQSA-N 2 0 409.412 4.033 20 0 HIADRP CN1CC[C@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000556057911 942798170 /nfs/dbraw/zinc/79/81/70/942798170.db2.gz YMWNGEZPXVDLCB-AHWVRZQESA-N 3 0 406.618 4.014 20 0 HIADRP COc1ccc(CC[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(Cl)c1OC ZINC000556218462 942820039 /nfs/dbraw/zinc/82/00/39/942820039.db2.gz UREWEOFLERCIAJ-XLIONFOSSA-N 2 0 402.966 4.400 20 0 HIADRP Cc1cccc([C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C(=O)N(C)[C@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000556317118 942839954 /nfs/dbraw/zinc/83/99/54/942839954.db2.gz MVUUTXNATKSWNZ-DMKHAHDWSA-N 2 0 419.613 4.152 20 0 HIADRP Cc1nn(-c2ccc(F)cc2)c(C)c1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556409694 942859155 /nfs/dbraw/zinc/85/91/55/942859155.db2.gz ZWKCSWVHQBTQQB-UHFFFAOYSA-N 2 0 422.548 4.391 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000556412209 942859652 /nfs/dbraw/zinc/85/96/52/942859652.db2.gz MZXULOWUILHQEM-HXUWFJFHSA-N 2 0 413.974 4.320 20 0 HIADRP Cc1cc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)ccc1-n1cncn1 ZINC000556883160 942950240 /nfs/dbraw/zinc/95/02/40/942950240.db2.gz FDADWGXLRATPSG-UHFFFAOYSA-N 2 0 401.558 4.064 20 0 HIADRP c1csc(N2CCC([NH2+][C@H]3CCCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)CC2)n1 ZINC000556887632 942952408 /nfs/dbraw/zinc/95/24/08/942952408.db2.gz ZOKCXPPSPRLIIW-PMVMPFDFSA-N 2 0 410.631 4.392 20 0 HIADRP C/C(=C\c1ccccc1OC(F)F)C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000557550351 943203970 /nfs/dbraw/zinc/20/39/70/943203970.db2.gz BSJIEZVBBCIRBJ-KNTRCKAVSA-N 2 0 407.549 4.041 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+]CC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000558121552 943386232 /nfs/dbraw/zinc/38/62/32/943386232.db2.gz FJKLASHKSFBILO-UHFFFAOYSA-N 2 0 411.496 4.222 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)c1 ZINC000558292165 943487487 /nfs/dbraw/zinc/48/74/87/943487487.db2.gz DTPSKACBDVXOIC-NQHRYMMQSA-N 2 0 420.601 4.289 20 0 HIADRP CSC1(C[NH2+]Cc2c(C)nn(Cc3ccccc3Cl)c2C)CC[NH+](C)CC1 ZINC000558492585 943574801 /nfs/dbraw/zinc/57/48/01/943574801.db2.gz ALRJNKGWHALTMP-UHFFFAOYSA-N 2 0 407.027 4.119 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000558918872 943746797 /nfs/dbraw/zinc/74/67/97/943746797.db2.gz IEQXYSQAQZSGHB-NRFANRHFSA-N 2 0 408.428 4.224 20 0 HIADRP C[C@H](c1ccc(F)cc1)N1CC[C@H]([NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)C1=O ZINC000559071608 943824611 /nfs/dbraw/zinc/82/46/11/943824611.db2.gz UOZGGDXJRDSUNM-NLFFAJNJSA-N 2 0 423.576 4.332 20 0 HIADRP Cc1c2cccc(Cl)c2sc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000559244411 943884764 /nfs/dbraw/zinc/88/47/64/943884764.db2.gz OVJJZFUVWIOATE-UHFFFAOYSA-N 2 0 400.979 4.300 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCCNc4ccccc43)C3(C2)CCOCC3)cc1 ZINC000559890722 944076734 /nfs/dbraw/zinc/07/67/34/944076734.db2.gz IKJKPMNLUTUITN-WIOPSUGQSA-N 2 0 405.586 4.452 20 0 HIADRP Cc1cccc(NC(=O)C[C@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c1C ZINC000560269325 944214454 /nfs/dbraw/zinc/21/44/54/944214454.db2.gz VIPNWJUZBFQJGV-IBGZPJMESA-N 2 0 409.574 4.283 20 0 HIADRP CC(C)Cc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c1 ZINC000560530489 944244740 /nfs/dbraw/zinc/24/47/40/944244740.db2.gz PKRZKJQMCADKHY-NBGIEHNGSA-N 2 0 407.602 4.433 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+](Cc2ccc(F)cc2)C(C)C)CC1 ZINC000561809773 944805799 /nfs/dbraw/zinc/80/57/99/944805799.db2.gz BJPBIXRXSMTKEM-UHFFFAOYSA-N 2 0 411.565 4.125 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1cccc(NC(=O)CC[NH+]2CCCC[C@@H]2C)c1 ZINC000562025715 944899883 /nfs/dbraw/zinc/89/98/83/944899883.db2.gz YPTFZRLRYMHIIG-BGYRXZFFSA-N 2 0 414.594 4.093 20 0 HIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCCN(C(=O)CCC(F)(F)F)C1 ZINC000564129365 945392517 /nfs/dbraw/zinc/39/25/17/945392517.db2.gz VNCQCMNUQBGHEK-LJQANCHMSA-N 2 0 413.528 4.068 20 0 HIADRP O=C(NCCC[NH+]1CCCC1)C1CC[NH+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000564312557 945510298 /nfs/dbraw/zinc/51/02/98/945510298.db2.gz FBEIVJJVXXHBMF-UHFFFAOYSA-N 2 0 411.615 4.229 20 0 HIADRP Cc1cccc(C)c1NC(=O)CCC[N@@H+]1C[C@@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000564402566 945556461 /nfs/dbraw/zinc/55/64/61/945556461.db2.gz CPGFOBBHUAVUCR-ZEQRLZLVSA-N 2 0 405.586 4.476 20 0 HIADRP Fc1cc(Cl)cc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000565612155 945854861 /nfs/dbraw/zinc/85/48/61/945854861.db2.gz GOMPGLVMPFWVNG-HXUWFJFHSA-N 2 0 402.941 4.498 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)c2ccc(C[NH+]3CCSCC3)cc2)[C@H]1c1ccccc1 ZINC000565885153 945905409 /nfs/dbraw/zinc/90/54/09/945905409.db2.gz TXOJPGWONQGHAP-DNQXCXABSA-N 2 0 423.626 4.048 20 0 HIADRP CSc1ccc([C@@H](CNC(=O)c2oc3ccccc3c2C[NH+](C)C)[NH+](C)C)cc1 ZINC000565914601 945918821 /nfs/dbraw/zinc/91/88/21/945918821.db2.gz MLQPNUXSWDHOCT-HXUWFJFHSA-N 2 0 411.571 4.249 20 0 HIADRP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](CCCc4nc(-c5ccccc5)no4)C[C@H]3C2)cc1 ZINC000566884556 946153517 /nfs/dbraw/zinc/15/35/17/946153517.db2.gz PBODDNKIIBEISL-PKTZIBPZSA-N 2 0 402.542 4.123 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000568092530 946459668 /nfs/dbraw/zinc/45/96/68/946459668.db2.gz CKZVSAANIVGKIT-UHFFFAOYSA-N 2 0 415.585 4.372 20 0 HIADRP O=C(C[NH2+][C@H](c1ccccc1)[C@@H]1CCCc2ccccc21)NC1CC[NH+](C2CC2)CC1 ZINC000569272628 946847212 /nfs/dbraw/zinc/84/72/12/946847212.db2.gz DCAZHRIPGYEQMO-XNMGPUDCSA-N 2 0 417.597 4.180 20 0 HIADRP C[C@@H]([NH2+]CCCc1nc(-c2ccc(F)cc2)no1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000569341950 946859670 /nfs/dbraw/zinc/85/96/70/946859670.db2.gz ZJZXCUSWDMHFJY-NQIIRXRSSA-N 2 0 408.521 4.309 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(Br)cn1 ZINC000569659694 946929703 /nfs/dbraw/zinc/92/97/03/946929703.db2.gz RDLFGTKJHMAMIT-INIZCTEOSA-N 2 0 404.352 4.170 20 0 HIADRP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CCCc3nc(-c4ccccc4)no3)C2)s1 ZINC000571688446 947748670 /nfs/dbraw/zinc/74/86/70/947748670.db2.gz UMRMJERFAZHPEX-LJQANCHMSA-N 2 0 410.587 4.493 20 0 HIADRP C[NH+]1CCN(C[C@@H]([NH2+][C@H]2CCc3ccc(Br)cc32)c2ccccc2)CC1 ZINC000571890339 947807153 /nfs/dbraw/zinc/80/71/53/947807153.db2.gz POHRAEZEEJQDGX-FCHUYYIVSA-N 2 0 414.391 4.015 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CCc2c1cc(Br)cc2F ZINC000572278734 947875287 /nfs/dbraw/zinc/87/52/87/947875287.db2.gz ABEAMFXYZAPFHK-IBGZPJMESA-N 2 0 422.342 4.091 20 0 HIADRP COc1ccc2c(c1F)CC[C@H]2[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000572439754 947905628 /nfs/dbraw/zinc/90/56/28/947905628.db2.gz FPNCDTAMDALSAH-MGPUTAFESA-N 2 0 401.501 4.063 20 0 HIADRP Cc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)c(-c2cnn(C)c2)c1 ZINC000572609404 947956270 /nfs/dbraw/zinc/95/62/70/947956270.db2.gz OJCOWNMXDDEOGJ-OYRHEFFESA-N 2 0 418.585 4.295 20 0 HIADRP COc1cc(C[NH2+]CC2(SC)CC[NH+](C)CC2)ccc1OCc1ccc(F)cc1 ZINC000572656234 947969378 /nfs/dbraw/zinc/96/93/78/947969378.db2.gz WGRRREKJUMJGNB-UHFFFAOYSA-N 2 0 418.578 4.330 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000573942886 948329395 /nfs/dbraw/zinc/32/93/95/948329395.db2.gz HBSPTLKDDHDONB-IRLDBZIGSA-N 2 0 420.475 4.393 20 0 HIADRP Brc1ccn2cc(C[NH2+]CC3CC[NH+](Cc4cccs4)CC3)nc2c1 ZINC000575167401 948616228 /nfs/dbraw/zinc/61/62/28/948616228.db2.gz CODLBHTXYKXHRU-UHFFFAOYSA-N 2 0 419.392 4.160 20 0 HIADRP CC[N@@H+]1CCCC[C@@H]1c1ccc(N([C@@H]2COC3(C2)CC[NH2+]CC3)C(C)(C)C)nc1 ZINC001164736041 720547846 /nfs/dbraw/zinc/54/78/46/720547846.db2.gz URNXJFRCMHJGKM-LEWJYISDSA-N 2 0 400.611 4.145 20 0 HIADRP CC[N@@H+]1CCCC[C@H]1c1ccc(N2CCn3c(C[NH+](C)C(C)C)cnc3[C@H]2C)nc1 ZINC001164862345 721017038 /nfs/dbraw/zinc/01/70/38/721017038.db2.gz PYPZLRHDGZCSAG-KNQAVFIVSA-N 2 0 410.610 4.246 20 0 HIADRP COCC[N@@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1[nH+]c(C)cc3ccccc31)CC2 ZINC001164784080 721463169 /nfs/dbraw/zinc/46/31/69/721463169.db2.gz GTRKJNBETDFIAC-HSZRJFAPSA-N 2 0 423.601 4.277 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCC(=O)Nc2cc(F)cc(F)c2)CC1 ZINC000436042030 861332657 /nfs/dbraw/zinc/33/26/57/861332657.db2.gz NMGFBEJPSQEGOV-UHFFFAOYSA-N 2 0 401.501 4.137 20 0 HIADRP C[NH+]1CCN(C(C)(C)C[NH2+]Cc2ccc(-c3ccc(Br)cc3)s2)CC1 ZINC000030664125 847755040 /nfs/dbraw/zinc/75/50/40/847755040.db2.gz YUZLYCYZVGJBLL-UHFFFAOYSA-N 2 0 422.436 4.293 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)Nc2cccc(C[NH+](C)C)c2)c2cccs2)CC1 ZINC000044292091 848540532 /nfs/dbraw/zinc/54/05/32/848540532.db2.gz AFDHTEMIKWHOEQ-HXUWFJFHSA-N 2 0 400.592 4.404 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCC([NH+]3CCCCC3)CC2)cc1 ZINC000045778274 848726315 /nfs/dbraw/zinc/72/63/15/848726315.db2.gz HFWCBWWXABFAPW-NRFANRHFSA-N 2 0 412.622 4.221 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000045778469 848726781 /nfs/dbraw/zinc/72/67/81/848726781.db2.gz CJMUTIAIDIWHSX-OAQYLSRUSA-N 2 0 412.622 4.078 20 0 HIADRP C[NH+]1CCN(C(C)(C)C[NH2+]Cc2sc(Sc3ccccc3)nc2Cl)CC1 ZINC000054462627 849871504 /nfs/dbraw/zinc/87/15/04/849871504.db2.gz SBUPFMWANYJXDK-UHFFFAOYSA-N 2 0 411.040 4.063 20 0 HIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCCC[NH+]2CCOCC2)cc1 ZINC000060526568 851133621 /nfs/dbraw/zinc/13/36/21/851133621.db2.gz WMORWKHAYXNERG-UHFFFAOYSA-N 2 0 404.558 4.050 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NCc1cccc(C[NH+]2CCCCCC2)c1)c1cccs1 ZINC000060798177 851216463 /nfs/dbraw/zinc/21/64/63/851216463.db2.gz WHXYBCNETAINIK-NRFANRHFSA-N 2 0 414.619 4.226 20 0 HIADRP Brc1cc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc2c1OCO2 ZINC000060952684 851256097 /nfs/dbraw/zinc/25/60/97/851256097.db2.gz IOONSBXVLXTTSX-UHFFFAOYSA-N 2 0 423.376 4.241 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3c(OC)ccc4ccccc43)cc2)CC1 ZINC000061070148 851287415 /nfs/dbraw/zinc/28/74/15/851287415.db2.gz LQZIKDMRERPQBZ-UHFFFAOYSA-N 2 0 403.570 4.276 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1)c1ccsc1 ZINC000061070475 851288815 /nfs/dbraw/zinc/28/88/15/851288815.db2.gz ZPTKBAWYNHPTIT-WOJBJXKFSA-N 2 0 418.607 4.250 20 0 HIADRP CC(C)[NH+]1CCN(c2ccc(C(=O)Nc3ccc(CC[NH+]4CCCC4)cc3)cc2)CC1 ZINC000061192822 851315313 /nfs/dbraw/zinc/31/53/13/851315313.db2.gz AOASESKKDJBMES-UHFFFAOYSA-N 2 0 420.601 4.108 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NCc2ccc(C[NH+](C)C)cc2)cc1 ZINC000061469199 851385252 /nfs/dbraw/zinc/38/52/52/851385252.db2.gz XTOQISIUWKTBPN-HXUWFJFHSA-N 2 0 408.590 4.122 20 0 HIADRP Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000061596598 851411753 /nfs/dbraw/zinc/41/17/53/851411753.db2.gz RUFDYFDPFHMFSS-UHFFFAOYSA-N 2 0 423.626 4.395 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000061792238 851454428 /nfs/dbraw/zinc/45/44/28/851454428.db2.gz RNJYREHXIGLGNT-FQEVSTJZSA-N 2 0 418.651 4.054 20 0 HIADRP Cc1ccc(C(=O)C(C(=S)NC2CC[NH+](C)CC2)[n+]2ccc(C(C)(C)C)cc2)cc1 ZINC000063441432 851691106 /nfs/dbraw/zinc/69/11/06/851691106.db2.gz YHXWVFMMNLKQTP-UHFFFAOYSA-O 2 0 424.634 4.203 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@H]1CC[NH+]([C@H](C)c2ccccc2)C1 ZINC000065523558 852168302 /nfs/dbraw/zinc/16/83/02/852168302.db2.gz TUGJSJGMGSRAOC-YKSBVNFPSA-N 2 0 408.590 4.162 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000065890895 852306365 /nfs/dbraw/zinc/30/63/65/852306365.db2.gz WBYMRFWYQFTBIK-UHFFFAOYSA-N 2 0 403.517 4.264 20 0 HIADRP COc1ccc([C@H](CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccccc2)[NH+]2CCCCC2)cc1 ZINC000072015395 852467114 /nfs/dbraw/zinc/46/71/14/852467114.db2.gz IZOSNSQLILUUIK-RPBOFIJWSA-N 2 0 421.585 4.003 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)CC1 ZINC000236803479 853924561 /nfs/dbraw/zinc/92/45/61/853924561.db2.gz AVALZUXJMHWROQ-UHFFFAOYSA-N 3 0 408.634 4.349 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000236953356 853941202 /nfs/dbraw/zinc/94/12/02/853941202.db2.gz SMUKESXEYFRTPP-QGZVFWFLSA-N 2 0 420.395 4.072 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1 ZINC000236976197 853945305 /nfs/dbraw/zinc/94/53/05/853945305.db2.gz OFMDGOVDOOXKPJ-GOSISDBHSA-N 2 0 418.029 4.074 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2sc(Sc3ccccc3)nc2Cl)CC1 ZINC000236975411 853945458 /nfs/dbraw/zinc/94/54/58/853945458.db2.gz LTYDCAFBFHUTMM-HNNXBMFYSA-N 2 0 411.040 4.063 20 0 HIADRP COc1ccccc1-c1ccc(C[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)cc1 ZINC000237097064 853964262 /nfs/dbraw/zinc/96/42/62/853964262.db2.gz UOJBEIAXOFOOFC-UHFFFAOYSA-N 2 0 415.581 4.399 20 0 HIADRP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)ccc1-n1cncn1 ZINC000237180579 853976166 /nfs/dbraw/zinc/97/61/66/853976166.db2.gz NALDDOGYJHGZMY-UHFFFAOYSA-N 2 0 401.514 4.091 20 0 HIADRP COc1ccc([C@H](CNC2CC[NH+](Cc3ccccc3)CC2)[NH+]2CCCCC2)cc1 ZINC000237352962 854011625 /nfs/dbraw/zinc/01/16/25/854011625.db2.gz MBYOWNILQWFVNT-SANMLTNESA-N 2 0 407.602 4.476 20 0 HIADRP COc1cccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)c1OC(C)C ZINC000237388363 854020596 /nfs/dbraw/zinc/02/05/96/854020596.db2.gz UYBKALQPVJQDOL-PMACEKPBSA-N 2 0 412.574 4.381 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Br)s2)C[C@@H](C)O1 ZINC000237411728 854026407 /nfs/dbraw/zinc/02/64/07/854026407.db2.gz DKQAKKDCOBFKPE-HUUCEWRRSA-N 2 0 409.393 4.410 20 0 HIADRP COc1ccc(C(=O)Nc2cccc(C[NH2+]Cc3ccc(F)c(C[NH+](C)C)c3)c2)cc1 ZINC000237467684 854039019 /nfs/dbraw/zinc/03/90/19/854039019.db2.gz WGSXPKKOVGZLKV-UHFFFAOYSA-N 2 0 421.516 4.438 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2c(F)cccc2N2CCCC2)C[C@@H](C)O1 ZINC000237572603 854056156 /nfs/dbraw/zinc/05/61/56/854056156.db2.gz PJLMJUGGQYWPKU-WOJBJXKFSA-N 2 0 411.565 4.325 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(Br)cc2F)C[C@H](C)O1 ZINC000237621329 854063698 /nfs/dbraw/zinc/06/36/98/854063698.db2.gz LQKIMEXRZKFYGC-IYBDPMFKSA-N 2 0 421.354 4.487 20 0 HIADRP Cc1cccc(-c2n[nH]cc2C[NH2+]Cc2ccccc2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000237776856 854094966 /nfs/dbraw/zinc/09/49/66/854094966.db2.gz IHBZXTABOVPPBV-BGYRXZFFSA-N 2 0 404.558 4.284 20 0 HIADRP O[C@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cccc(C(F)(F)F)c1 ZINC000237960991 854126712 /nfs/dbraw/zinc/12/67/12/854126712.db2.gz OPVWLBMJISQMPY-OAQYLSRUSA-N 2 0 408.464 4.003 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2cccc(-c3ccccc3)c2)cc1 ZINC000238076454 854141795 /nfs/dbraw/zinc/14/17/95/854141795.db2.gz SYMFWEQSZNAION-UHFFFAOYSA-N 2 0 413.565 4.469 20 0 HIADRP O=C(N[C@@H](C[NH+]1CCCC1)c1ccccc1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000303140301 854781484 /nfs/dbraw/zinc/78/14/84/854781484.db2.gz BAPJFUNACKKSQG-UPVQGACJSA-N 2 0 412.622 4.121 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)NCc2ccccc2C[NH+]2CCCCCC2)C1 ZINC000303473736 854969633 /nfs/dbraw/zinc/96/96/33/854969633.db2.gz HYUHWAZAJOWTSQ-QFIPXVFZSA-N 2 0 414.638 4.374 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NCC(C)(C)[N@@H+]2CCC[C@H](C)C2)CC1 ZINC000303647567 855103361 /nfs/dbraw/zinc/10/33/61/855103361.db2.gz JNLNIBQGPPTCNC-PMACEKPBSA-N 2 0 400.611 4.022 20 0 HIADRP CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]([NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC000309674715 855362962 /nfs/dbraw/zinc/36/29/62/855362962.db2.gz VUBHEALTJFETLG-PQNGQFLHSA-N 2 0 401.595 4.324 20 0 HIADRP C[C@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309712032 855364039 /nfs/dbraw/zinc/36/40/39/855364039.db2.gz JQRLETARHARGBN-HJNYFJLDSA-N 2 0 401.595 4.276 20 0 HIADRP COc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1Br ZINC000310788938 855367550 /nfs/dbraw/zinc/36/75/50/855367550.db2.gz DEWAFJMDDKKIRN-LPHOPBHVSA-N 2 0 403.364 4.458 20 0 HIADRP C[C@@H](CC[NH2+]C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C)[N@H+](C)Cc1ccccc1 ZINC000379615798 855424313 /nfs/dbraw/zinc/42/43/13/855424313.db2.gz BCOPMPJVTMMNEE-BHGTWAMESA-N 2 0 401.595 4.417 20 0 HIADRP CC(C)(C)OC(=O)NC[C@@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390538409 855455186 /nfs/dbraw/zinc/45/51/86/855455186.db2.gz GSMGSDRYZSSJHZ-FYDVADAXSA-N 2 0 413.606 4.465 20 0 HIADRP CC(C)(C)OC(=O)NC1CCC([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000390775678 855455927 /nfs/dbraw/zinc/45/59/27/855455927.db2.gz MUKHHNMUNSTBIY-HWELCPFYSA-N 2 0 401.595 4.324 20 0 HIADRP C[C@@H]([NH2+]CC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000393945849 855469078 /nfs/dbraw/zinc/46/90/78/855469078.db2.gz QOOZLZHDBGGVTL-DENIHFKCSA-N 2 0 401.595 4.134 20 0 HIADRP OC1(C[NH2+]Cc2cccc(OCc3ccccc3)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000397599872 855472787 /nfs/dbraw/zinc/47/27/87/855472787.db2.gz SLKKYHWUVJKDHI-UHFFFAOYSA-N 2 0 416.565 4.382 20 0 HIADRP Ic1cccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000397562851 855472942 /nfs/dbraw/zinc/47/29/42/855472942.db2.gz YTJBUAHLQCWRFG-UHFFFAOYSA-N 2 0 420.338 4.293 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCN(C(=O)OC(C)(C)C)CC1 ZINC000398047819 855475088 /nfs/dbraw/zinc/47/50/88/855475088.db2.gz WLNSKVCSXKPDTR-SIKLNZKXSA-N 2 0 401.595 4.134 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)CC1 ZINC000410321257 855926692 /nfs/dbraw/zinc/92/66/92/855926692.db2.gz ALJFKDSALOFRPI-RUZDIDTESA-N 2 0 420.601 4.096 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)cc1 ZINC000410336895 855936425 /nfs/dbraw/zinc/93/64/25/855936425.db2.gz KFQLKXVIEZTAME-AVRDEDQJSA-N 2 0 414.619 4.225 20 0 HIADRP C[C@H]1CCCC[NH+]1Cc1ccc(CNC(=O)NCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000410346194 855940387 /nfs/dbraw/zinc/94/03/87/855940387.db2.gz UODFTPZHHYZHNV-SFTDATJTSA-N 2 0 400.611 4.125 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)CC1 ZINC000410348870 855942835 /nfs/dbraw/zinc/94/28/35/855942835.db2.gz BVOHEZOMPCMHRG-NRFANRHFSA-N 2 0 414.638 4.182 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)CC1 ZINC000410352017 855943892 /nfs/dbraw/zinc/94/38/92/855943892.db2.gz YUNVDJIAUOWYMK-UHFFFAOYSA-N 2 0 414.638 4.182 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NCc1ccc(C[NH+](C)C)cc1 ZINC000410362130 855950887 /nfs/dbraw/zinc/95/08/87/855950887.db2.gz BUOIMKTYLVHJNT-HXUWFJFHSA-N 2 0 408.590 4.122 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000410366018 855953579 /nfs/dbraw/zinc/95/35/79/855953579.db2.gz FXWIKQNSLOCJJW-NZQKXSOJSA-N 2 0 424.589 4.148 20 0 HIADRP COc1cccc2c1CC[C@H]([NH2+]CCCOC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC000426022817 856052600 /nfs/dbraw/zinc/05/26/00/856052600.db2.gz PAYKQEVYJGWHHR-QHCPKHFHSA-N 2 0 408.586 4.213 20 0 HIADRP C[NH+](C)Cc1cc(-c2noc([C@@H]3C[N@@H+](C(C)(C)C)C[C@H]3C(F)(F)F)n2)ccc1F ZINC000426392523 856272429 /nfs/dbraw/zinc/27/24/29/856272429.db2.gz AYUJSGQZQPIGEU-HUUCEWRRSA-N 2 0 414.447 4.314 20 0 HIADRP O=C(c1ccoc1)N1CCC([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000428224637 857117735 /nfs/dbraw/zinc/11/77/35/857117735.db2.gz XLCYXKHKXKNEEQ-FTBPSBKWSA-N 2 0 421.585 4.165 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000428277476 857137145 /nfs/dbraw/zinc/13/71/45/857137145.db2.gz RBWGZAXTEYJSJE-NQHRYMMQSA-N 2 0 420.601 4.176 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[NH+]2CCCC2)o1 ZINC000428688190 857297161 /nfs/dbraw/zinc/29/71/61/857297161.db2.gz ZJOPVQDGEWNJDL-PMOQBDJRSA-N 2 0 424.589 4.077 20 0 HIADRP Cc1cc(Br)cc(C)c1NC(=O)CCC[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000429544441 857735385 /nfs/dbraw/zinc/73/53/85/857735385.db2.gz YMQYWACETUOPFB-SFHVURJKSA-N 2 0 410.400 4.201 20 0 HIADRP Cc1ccc(-c2cc(C[N@@H+](C)CCC3CC[NH+](C4CCN(C)CC4)CC3)on2)cc1 ZINC000430915266 858369184 /nfs/dbraw/zinc/36/91/84/858369184.db2.gz PDYQFTGDBMWVNT-UHFFFAOYSA-N 2 0 410.606 4.278 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NCC1CC[NH+](CCC(C)C)CC1 ZINC000431616762 858691677 /nfs/dbraw/zinc/69/16/77/858691677.db2.gz JBSZSESTQMIPDK-UHFFFAOYSA-N 2 0 402.627 4.038 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000431678962 858734303 /nfs/dbraw/zinc/73/43/03/858734303.db2.gz OBXOSDXPDWBDHR-NQHRYMMQSA-N 2 0 420.601 4.176 20 0 HIADRP COc1ccccc1[C@H](CNC(=O)C[C@H](c1ccccc1)[NH+](C)C)[NH+]1CCCCC1 ZINC000431727880 858767583 /nfs/dbraw/zinc/76/75/83/858767583.db2.gz LVJOQYDUGRSOLC-PKTZIBPZSA-N 2 0 409.574 4.031 20 0 HIADRP C[C@H]1C[N@H+](CCC[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)CCCO1 ZINC000432357689 859119162 /nfs/dbraw/zinc/11/91/62/859119162.db2.gz MRRTYCPDXRQIPP-IBGZPJMESA-N 2 0 410.587 4.191 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CC(c3cccc(Br)c3)C2)[C@@H](C)C1 ZINC000432414979 859153614 /nfs/dbraw/zinc/15/36/14/859153614.db2.gz UMUJEDPNQGUDTF-CTHNVIJVSA-N 2 0 409.412 4.422 20 0 HIADRP C[C@@H]1CN(CCC[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCCO1 ZINC000432424565 859158964 /nfs/dbraw/zinc/15/89/64/859158964.db2.gz PFIXTRMFURJOPO-APWZRJJASA-N 2 0 403.567 4.417 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ccc(C(F)(F)F)s3)CC2)CC1 ZINC000432729060 859323348 /nfs/dbraw/zinc/32/33/48/859323348.db2.gz FJBHWMXNXINORK-UHFFFAOYSA-N 2 0 403.558 4.395 20 0 HIADRP c1ccc(C[NH+]2CCC3(CC[N@@H+](CCc4nc(-c5ccccc5)no4)C3)CC2)cc1 ZINC000433114478 859527012 /nfs/dbraw/zinc/52/70/12/859527012.db2.gz NNXZMZYGRPCHNF-UHFFFAOYSA-N 2 0 402.542 4.267 20 0 HIADRP C[C@H](C(=O)N(C)Cc1cccc(F)c1)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433121052 859528759 /nfs/dbraw/zinc/52/87/59/859528759.db2.gz MDMLIZXJOKDYDZ-OAQYLSRUSA-N 2 0 423.576 4.161 20 0 HIADRP Cc1ccc(F)cc1NC(=O)[C@@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433214311 859570852 /nfs/dbraw/zinc/57/08/52/859570852.db2.gz SMUZJSCMGBQBAE-HXUWFJFHSA-N 2 0 409.549 4.449 20 0 HIADRP C[NH+](Cc1cc(Br)ccc1C[N@@H+](C)[C@H]1CCSC1)[C@H]1CCSC1 ZINC000433261820 859599646 /nfs/dbraw/zinc/59/96/46/859599646.db2.gz XMJILSSAHAARGX-ROUUACIJSA-N 2 0 415.466 4.324 20 0 HIADRP C[NH+](Cc1cc(Br)ccc1C[N@@H+](C)[C@@H]1CCSC1)[C@H]1CCSC1 ZINC000433261813 859599947 /nfs/dbraw/zinc/59/99/47/859599947.db2.gz XMJILSSAHAARGX-MSOLQXFVSA-N 2 0 415.466 4.324 20 0 HIADRP C[C@@H]([NH2+]CCCN1CC[NH+](Cc2ccccc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000467736590 881539294 /nfs/dbraw/zinc/53/92/94/881539294.db2.gz DSXHHFHBPYDGJH-MRXNPFEDSA-N 2 0 412.525 4.020 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH+]2CCC(c3ncc4n3CCCC4)CC2)CC1 ZINC000435061859 860622788 /nfs/dbraw/zinc/62/27/88/860622788.db2.gz UZANIEUEPZVRBZ-UHFFFAOYSA-N 2 0 421.633 4.131 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(C(F)(F)F)cc1Cl ZINC000438060430 863431291 /nfs/dbraw/zinc/43/12/91/863431291.db2.gz WSAKJOLCIPZXLZ-OAHLLOKOSA-N 2 0 420.907 4.239 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(-c2ccccc2OC)c1 ZINC000438081296 863474808 /nfs/dbraw/zinc/47/48/08/863474808.db2.gz YSHUWMCVFNOHPA-QFIPXVFZSA-N 2 0 424.589 4.242 20 0 HIADRP Cc1ccc(NC(=O)N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)c(OCC[NH+](C)C)c1 ZINC000438305713 863786293 /nfs/dbraw/zinc/78/62/93/863786293.db2.gz MOFFNGSXMZTJIZ-NRFANRHFSA-N 2 0 424.589 4.064 20 0 HIADRP Cc1cc(N2CCC([NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)CC2)nc(C)n1 ZINC000438829579 864323979 /nfs/dbraw/zinc/32/39/79/864323979.db2.gz KNYKFINKFZJURC-UHFFFAOYSA-N 3 0 407.606 4.095 20 0 HIADRP COc1cc(NC(C)=O)ccc1[C@@H](C)N[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000439002756 864456396 /nfs/dbraw/zinc/45/63/96/864456396.db2.gz ZMJRYMQXBMXBND-BBRCJUOPSA-N 2 0 409.574 4.461 20 0 HIADRP c1cc(C[NH+]2CCC([C@H]3CCCO3)CC2)cc(C[NH+]2CCC([C@@H]3CCCO3)CC2)c1 ZINC000439297634 864725038 /nfs/dbraw/zinc/72/50/38/864725038.db2.gz SNORHSBIQAIMEL-WMPKNSHKSA-N 2 0 412.618 4.469 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N(C)Cc1ccccc1 ZINC000439598298 864920398 /nfs/dbraw/zinc/92/03/98/864920398.db2.gz QGRQHGWDLSYSRM-HXUWFJFHSA-N 2 0 405.542 4.048 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCCN(c2ccccc2)C1=O ZINC000439600572 864924322 /nfs/dbraw/zinc/92/43/22/864924322.db2.gz WAGDDHQQVHJAHV-XMMPIXPASA-N 2 0 403.526 4.197 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@H](c2ccccc2)c2ccccc2C)[C@@H](C)C1 ZINC000440688518 865866762 /nfs/dbraw/zinc/86/67/62/865866762.db2.gz AGAJNZKMZCMLRI-BJTUFNSYSA-N 2 0 410.602 4.124 20 0 HIADRP O=C(CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)N(Cc1ccccc1)c1ccccc1 ZINC000441401351 866475616 /nfs/dbraw/zinc/47/56/16/866475616.db2.gz MGHCINRITXPMFR-WIOPSUGQSA-N 2 0 403.570 4.169 20 0 HIADRP Cc1ccc([C@H](OC[C@H](O)C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c2ccccc2)cc1 ZINC000441460630 866536181 /nfs/dbraw/zinc/53/61/81/866536181.db2.gz YYVDASFUOPACJL-HUROMRQRSA-N 2 0 422.613 4.270 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@H]3Cc4[nH]c5ccccc5c4C3)CC2)cc1 ZINC000442778104 867672339 /nfs/dbraw/zinc/67/23/39/867672339.db2.gz FMGOBZBPCDBJFT-OAQYLSRUSA-N 2 0 403.570 4.296 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]C2CCC(C(F)F)CC2)CC1 ZINC000442789314 867675199 /nfs/dbraw/zinc/67/51/99/867675199.db2.gz YUEGUJGTJWFFDT-UHFFFAOYSA-N 2 0 405.455 4.371 20 0 HIADRP C[C@@H]([NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)c1cc2ccccc2o1 ZINC000442888838 867720014 /nfs/dbraw/zinc/72/00/14/867720014.db2.gz BMZHFKVAOSZWPF-QGZVFWFLSA-N 2 0 409.555 4.271 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1cc2ccccc2o1 ZINC000442891470 867723777 /nfs/dbraw/zinc/72/37/77/867723777.db2.gz MVXYLUDATLIVDO-MOPGFXCFSA-N 2 0 405.542 4.253 20 0 HIADRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)C1 ZINC000443614345 868180634 /nfs/dbraw/zinc/18/06/34/868180634.db2.gz GKXRKGZHUYHYNQ-NRFANRHFSA-N 2 0 402.970 4.038 20 0 HIADRP CCCc1cc(N2CCC(C(=O)NCCC[NH+](CC)CC)CC2)c2ccccc2[nH+]1 ZINC000443670462 868276830 /nfs/dbraw/zinc/27/68/30/868276830.db2.gz UUWZAUWOGZPUKP-UHFFFAOYSA-N 2 0 410.606 4.252 20 0 HIADRP C[NH+](C)CCN(C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)C1CCCC1 ZINC000468331647 882263550 /nfs/dbraw/zinc/26/35/50/882263550.db2.gz LAQKATLCBCTOBZ-UHFFFAOYSA-N 2 0 422.617 4.431 20 0 HIADRP C[C@@H](CC1CCOCC1)[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000468357106 882296677 /nfs/dbraw/zinc/29/66/77/882296677.db2.gz OVPNOLUMTYAGGC-QFIPXVFZSA-N 2 0 407.602 4.304 20 0 HIADRP C[C@H]([NH2+][C@H]1CCC[C@@H]1c1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000446005471 869970595 /nfs/dbraw/zinc/97/05/95/869970595.db2.gz YGMZXKIFAVPKHL-AMDXRBSFSA-N 2 0 405.586 4.082 20 0 HIADRP Cc1sc(C(=O)N(CCC[NH+](C)C)CCC[NH+](C)C)cc1-c1ccc(F)cc1 ZINC000446109648 870056969 /nfs/dbraw/zinc/05/69/69/870056969.db2.gz UXOLFXVZGZLRBB-UHFFFAOYSA-N 2 0 405.583 4.208 20 0 HIADRP C[NH+](C)CCOCC[NH2+][C@H](c1ccc(Br)cc1C(F)(F)F)C1CC1 ZINC000447596608 871503780 /nfs/dbraw/zinc/50/37/80/871503780.db2.gz DDQZPCPFLAVBTH-INIZCTEOSA-N 2 0 409.290 4.087 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000447604506 871513978 /nfs/dbraw/zinc/51/39/78/871513978.db2.gz AYSRBMRNMPGMFP-UIOOFZCWSA-N 2 0 404.529 4.466 20 0 HIADRP C[NH+](C)[C@@H]1CCOc2c(NC(=O)[C@@H]3CCC[N@H+](Cc4cccc(F)c4)C3)cccc21 ZINC000447728760 871676135 /nfs/dbraw/zinc/67/61/35/871676135.db2.gz MIQZPMXJHDOIEG-XMSQKQJNSA-N 2 0 411.521 4.062 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000448218842 872125032 /nfs/dbraw/zinc/12/50/32/872125032.db2.gz WLLJSNMDIDLTCS-XRODADMRSA-N 2 0 424.633 4.219 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](CC(C)C)[NH2+][C@H](C)c2ccccc2)[C@@H](C)C1 ZINC000448519702 872505578 /nfs/dbraw/zinc/50/55/78/872505578.db2.gz FMJJLBBVIVCNHX-MQFRRQCYSA-N 2 0 402.627 4.124 20 0 HIADRP CCN(C(=O)Nc1ccc(C)cc1OCC[NH+](C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000460132810 872619167 /nfs/dbraw/zinc/61/91/67/872619167.db2.gz ULILXGLCOGIQRO-QFIPXVFZSA-N 2 0 424.589 4.064 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N2C[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC000461435849 874487922 /nfs/dbraw/zinc/48/79/22/874487922.db2.gz KQJPHJKKSSLNJL-RPBOFIJWSA-N 2 0 405.586 4.123 20 0 HIADRP Cc1c([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cnn1C(C)(C)C ZINC000468835116 882882132 /nfs/dbraw/zinc/88/21/32/882882132.db2.gz FVZXNUXIINEJGY-IAGOWNOFSA-N 2 0 401.574 4.249 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@H]2CCO[C@]3(CCOC3)C2)c2ccc(F)cc2)CC1 ZINC000462802429 875850304 /nfs/dbraw/zinc/85/03/04/875850304.db2.gz NDAIDAYYLNXFSM-KMDXXIMOSA-N 2 0 404.570 4.307 20 0 HIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CCN(CC[NH+]2[C@H](C)CC[C@H]2C)CC1 ZINC000463072609 876102418 /nfs/dbraw/zinc/10/24/18/876102418.db2.gz QSIJTEIDQLWAQZ-FGZHOGPDSA-N 2 0 411.638 4.005 20 0 HIADRP C[NH+](C)CCCOc1ccc(C[NH2+]C2CCN(Cc3ccccc3Cl)CC2)cc1 ZINC000463120026 876163268 /nfs/dbraw/zinc/16/32/68/876163268.db2.gz SBNDALWVNFNRLC-UHFFFAOYSA-N 2 0 416.009 4.425 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[C@@H]1CCCC[NH+]1C/C=C\C[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000463190373 876250014 /nfs/dbraw/zinc/25/00/14/876250014.db2.gz CUDPAKWBTVRFOH-KGGMOALTSA-N 2 0 418.666 4.354 20 0 HIADRP O[C@H]1CCC[C@@]1(C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1ccc(F)cc1 ZINC000463235073 876290654 /nfs/dbraw/zinc/29/06/54/876290654.db2.gz FPBQKPMFHITXAM-UIOOFZCWSA-N 2 0 410.577 4.196 20 0 HIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2c(C)nn(Cc3ccc(OC)cc3)c2C)c1 ZINC000463745272 876868010 /nfs/dbraw/zinc/86/80/10/876868010.db2.gz MAAXUWUHRHTFOO-UHFFFAOYSA-N 2 0 406.574 4.298 20 0 HIADRP O=C(C[N@H+](C1CC1)[C@@H]1CCCC[C@H]1C1CCCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000464735491 877972083 /nfs/dbraw/zinc/97/20/83/877972083.db2.gz UBCWHLJZFAFDCU-BJKOFHAPSA-N 2 0 401.639 4.333 20 0 HIADRP C[C@@H]1CCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1Cc1ccccc1 ZINC000465525048 878977591 /nfs/dbraw/zinc/97/75/91/878977591.db2.gz RQBIBILBRBGSJB-JOCHJYFZSA-N 2 0 420.601 4.088 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCC[NH+]1CCCC[C@@H]1C ZINC000465602788 879092745 /nfs/dbraw/zinc/09/27/45/879092745.db2.gz PYJFKEHDKVAZCD-UPVQGACJSA-N 2 0 414.638 4.195 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000503433785 912436097 /nfs/dbraw/zinc/43/60/97/912436097.db2.gz KKBAPBVWOAZKAY-JOCHJYFZSA-N 2 0 414.638 4.324 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@H](c1ccc(C)cc1)[NH+](C)C ZINC000465817085 879440672 /nfs/dbraw/zinc/44/06/72/879440672.db2.gz ORPHINXACFAAPT-ILBGXUMGSA-N 2 0 422.617 4.151 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCc1cccc(C[NH+]3CCC(C)CC3)c1)CC2 ZINC000465934553 879598548 /nfs/dbraw/zinc/59/85/48/879598548.db2.gz JECPGEIQZHRZEM-RPWUZVMVSA-N 2 0 412.622 4.075 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000466507550 880281534 /nfs/dbraw/zinc/28/15/34/880281534.db2.gz XDZGUJNIEOTSQM-DNRQZRRGSA-N 2 0 420.601 4.174 20 0 HIADRP c1ccc(Oc2ccc(OCC[NH+]3CCC(OCC[NH+]4CCCC4)CC3)cc2)cc1 ZINC000466931129 880700583 /nfs/dbraw/zinc/70/05/83/880700583.db2.gz QARODAFRUZCYHE-UHFFFAOYSA-N 2 0 410.558 4.435 20 0 HIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000503564508 912641426 /nfs/dbraw/zinc/64/14/26/912641426.db2.gz AREFGDSEIYEPLF-KNTRCKAVSA-N 2 0 409.540 4.458 20 0 HIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000467341314 881093389 /nfs/dbraw/zinc/09/33/89/881093389.db2.gz DLCNQOCWRSGXAZ-VFNWGFHPSA-N 2 0 401.501 4.063 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c1 ZINC000469221240 883322029 /nfs/dbraw/zinc/32/20/29/883322029.db2.gz JBXLZEZZTCMLCT-HSZRJFAPSA-N 2 0 415.528 4.087 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000469369098 883493347 /nfs/dbraw/zinc/49/33/47/883493347.db2.gz IMNQLTITBXGYLU-UHFFFAOYSA-N 2 0 419.569 4.479 20 0 HIADRP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000503899979 912857502 /nfs/dbraw/zinc/85/75/02/912857502.db2.gz FXZQTIAMXNRVEX-UHFFFAOYSA-N 2 0 405.384 4.073 20 0 HIADRP C[C@H]1CCN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000470517138 884907070 /nfs/dbraw/zinc/90/70/70/884907070.db2.gz FULWITTYDWXEFX-IBGZPJMESA-N 2 0 405.542 4.231 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)c1cccc(C(F)(F)F)c1 ZINC000470600046 885026035 /nfs/dbraw/zinc/02/60/35/885026035.db2.gz QMCQUAWLKRZXOU-OAQYLSRUSA-N 2 0 419.491 4.334 20 0 HIADRP CN(C(=O)C1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470659703 885084317 /nfs/dbraw/zinc/08/43/17/885084317.db2.gz OUJJEMJYBHJRAQ-VWLOTQADSA-N 2 0 405.586 4.022 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N(C)[C@H]2CCC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)o1 ZINC000470733648 885187334 /nfs/dbraw/zinc/18/73/34/885187334.db2.gz SWAQKANPRSKXBJ-GOTSBHOMSA-N 2 0 424.589 4.031 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N(C)[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000470740482 885199826 /nfs/dbraw/zinc/19/98/26/885199826.db2.gz MLKHDPWJPITCPF-VWLOTQADSA-N 2 0 422.617 4.334 20 0 HIADRP CN(C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470740226 885200264 /nfs/dbraw/zinc/20/02/64/885200264.db2.gz KEAOXZFPCGOYNJ-VWLOTQADSA-N 2 0 420.601 4.088 20 0 HIADRP CN(C(=O)NCc1ccccc1C[NH+]1CCCC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470756919 885223117 /nfs/dbraw/zinc/22/31/17/885223117.db2.gz SFQMKWMOGNZNRH-RUZDIDTESA-N 2 0 420.601 4.088 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@H](C[NH+]2CCCC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000470893973 885390672 /nfs/dbraw/zinc/39/06/72/885390672.db2.gz AGUGJYQZSAQYEF-NHCUHLMSSA-N 2 0 400.611 4.023 20 0 HIADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CCC(=O)Nc2ccccc2Oc2ccccc2)C1 ZINC000470961934 885461893 /nfs/dbraw/zinc/46/18/93/885461893.db2.gz UAXCDHYAFXVCIM-OAQYLSRUSA-N 2 0 407.558 4.471 20 0 HIADRP Cc1c([C@H](C)[NH2+][C@@H](C)CCN2CC[NH+](C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000471592749 886304705 /nfs/dbraw/zinc/30/47/05/886304705.db2.gz GPHWMTRWZSHZMM-HOTGVXAUSA-N 2 0 424.420 4.164 20 0 HIADRP Oc1cc(F)cc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)c1 ZINC000472065474 886872498 /nfs/dbraw/zinc/87/24/98/886872498.db2.gz MYGNPAXWKHZWJT-UHFFFAOYSA-N 2 0 405.517 4.143 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000473276243 888033559 /nfs/dbraw/zinc/03/35/59/888033559.db2.gz KATDYQKTLKDQCG-NHCUHLMSSA-N 2 0 405.586 4.169 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N(C)[C@@H]2CC[NH+](CC)[C@H](C)C2)c1 ZINC000473745397 888529272 /nfs/dbraw/zinc/52/92/72/888529272.db2.gz DTZSMUYUEYSRDW-NFBKMPQASA-N 2 0 402.627 4.323 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)[C@H](C)c3nc4ccccc4s3)cn2)CC1 ZINC000474483211 889343470 /nfs/dbraw/zinc/34/34/70/889343470.db2.gz UCAWZVSMNOHFAM-ROUUACIJSA-N 2 0 409.603 4.115 20 0 HIADRP COc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1OCc1cccnc1 ZINC000475218379 890086430 /nfs/dbraw/zinc/08/64/30/890086430.db2.gz GTVXXZGHUGTQTB-HSZRJFAPSA-N 2 0 417.553 4.281 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475282713 890181331 /nfs/dbraw/zinc/18/13/31/890181331.db2.gz GEPKEWNYGBWEMK-CTNGQTDRSA-N 2 0 413.993 4.189 20 0 HIADRP CC[NH+](CC)CCN(Cc1ccccc1)C(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000476013978 890944190 /nfs/dbraw/zinc/94/41/90/890944190.db2.gz VBSVQBFEGOSUFM-UHFFFAOYSA-N 2 0 414.638 4.337 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2cccc(C[NH+]3CCC(CO)CC3)c2)cc1 ZINC000477716479 892824156 /nfs/dbraw/zinc/82/41/56/892824156.db2.gz LESRLPWAMLRMNU-UHFFFAOYSA-N 2 0 423.601 4.375 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1cccc(NS(C)(=O)=O)c1 ZINC000477936025 893025130 /nfs/dbraw/zinc/02/51/30/893025130.db2.gz KCRJTTSWPJJVNF-IBGZPJMESA-N 2 0 415.603 4.141 20 0 HIADRP CC(C)(C[NH2+]C1CCN(Cc2ccccc2Br)CC1)C[NH+]1CCCC1 ZINC000477944968 893035827 /nfs/dbraw/zinc/03/58/27/893035827.db2.gz OBARXWDCQNJORV-UHFFFAOYSA-N 2 0 408.428 4.125 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccccc1N1CCCCC1)C1CC[NH+](C)CC1 ZINC000478222281 893382805 /nfs/dbraw/zinc/38/28/05/893382805.db2.gz CYZMOMHIBYOKKL-UHFFFAOYSA-N 2 0 406.618 4.497 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)Nc2cccc(OCC[NH+](C)C)c2)CC1 ZINC000478245241 893412919 /nfs/dbraw/zinc/41/29/19/893412919.db2.gz AXNNGHIGYKAYHW-HXUWFJFHSA-N 2 0 416.610 4.135 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479264344 894535108 /nfs/dbraw/zinc/53/51/08/894535108.db2.gz COHXOCYIMRDARN-GCJKJVERSA-N 2 0 416.407 4.154 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000479267948 894540145 /nfs/dbraw/zinc/54/01/45/894540145.db2.gz YAEBJRMCJUPWBW-AWEZNQCLSA-N 2 0 422.333 4.146 20 0 HIADRP C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479280451 894559207 /nfs/dbraw/zinc/55/92/07/894559207.db2.gz MDZZOBOAPLXSPZ-ZDUSSCGKSA-N 2 0 422.333 4.145 20 0 HIADRP CC1(C)C[C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)c2cc(Br)ccc21 ZINC000479407739 894714855 /nfs/dbraw/zinc/71/48/55/894714855.db2.gz BSDRPKFARAXZRB-ZCNNSNEGSA-N 2 0 407.396 4.139 20 0 HIADRP C[C@@H]1CCCC[NH+]1CCC1CCN(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000479436157 894751420 /nfs/dbraw/zinc/75/14/20/894751420.db2.gz IYDLCJYQENUQPG-FCHUYYIVSA-N 2 0 406.659 4.327 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC2CC[NH+](C3CCCC3)CC2)CC1 ZINC000479562478 894859545 /nfs/dbraw/zinc/85/95/45/894859545.db2.gz IWVVTBACASBMAA-FQEVSTJZSA-N 2 0 404.643 4.080 20 0 HIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000479767576 895068058 /nfs/dbraw/zinc/06/80/58/895068058.db2.gz JTKNZZUOHGDMNT-CVEARBPZSA-N 2 0 422.415 4.499 20 0 HIADRP COc1ccc([C@H](CN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)[NH+]2CCCC2)cc1 ZINC000480086236 895446753 /nfs/dbraw/zinc/44/67/53/895446753.db2.gz AHAXIZBDSIWHFL-QGDZQMKYSA-N 2 0 407.602 4.332 20 0 HIADRP COc1ccc([C@H](CN[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)[NH+]2CCCC2)cc1 ZINC000480086228 895446921 /nfs/dbraw/zinc/44/69/21/895446921.db2.gz AHAXIZBDSIWHFL-MZBJOSPHSA-N 2 0 407.602 4.332 20 0 HIADRP C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(-c2ccc(Br)cc2)s1 ZINC000480168732 895558589 /nfs/dbraw/zinc/55/85/89/895558589.db2.gz VUYTVGXUFWXNHC-INIZCTEOSA-N 2 0 422.436 4.466 20 0 HIADRP COCCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000480238559 895648590 /nfs/dbraw/zinc/64/85/90/895648590.db2.gz DMVYUFBMKAXJJJ-HBMCJLEFSA-N 2 0 412.574 4.172 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(OCc2nccn2C)cc1 ZINC000480266962 895675661 /nfs/dbraw/zinc/67/56/61/895675661.db2.gz QDNRKPHMAUJVFU-FQEVSTJZSA-N 2 0 404.558 4.446 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480267941 895675845 /nfs/dbraw/zinc/67/58/45/895675845.db2.gz SRTREXGDFJIJCK-GOSISDBHSA-N 2 0 418.578 4.312 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480267942 895676099 /nfs/dbraw/zinc/67/60/99/895676099.db2.gz SRTREXGDFJIJCK-SFHVURJKSA-N 2 0 418.578 4.312 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccc(NS(=O)(=O)CC)cc1 ZINC000480417531 895814845 /nfs/dbraw/zinc/81/48/45/895814845.db2.gz OXLQERPMVDRXNY-GOSISDBHSA-N 2 0 403.592 4.141 20 0 HIADRP CSc1ccc([C@H](C[NH2+][C@H]2CC[N@H+](C)C[C@H]2C)N2CCc3sccc3C2)cc1 ZINC000480615795 895982278 /nfs/dbraw/zinc/98/22/78/895982278.db2.gz SZRVLPUZNJXELL-WTNAPCKOSA-N 2 0 415.672 4.499 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000480619837 895988245 /nfs/dbraw/zinc/98/82/45/895988245.db2.gz QPZLURIDUWIWKG-MOPGFXCFSA-N 2 0 415.603 4.141 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccc(SC)c(OC)c2)CC1 ZINC000480694425 896055928 /nfs/dbraw/zinc/05/59/28/896055928.db2.gz PEBVUPGYAGTZRU-IBGZPJMESA-N 2 0 413.631 4.405 20 0 HIADRP Cc1ccc(OCCCC(=O)Nc2ccc(C[NH2+][C@@H]3CC[N@@H+](C)C[C@H]3C)cc2)cc1 ZINC000480694048 896056722 /nfs/dbraw/zinc/05/67/22/896056722.db2.gz KXLNFPZRGDUHTQ-HYBUGGRVSA-N 2 0 409.574 4.223 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccc(SC)c(OC)c2)CC1 ZINC000480694427 896057094 /nfs/dbraw/zinc/05/70/94/896057094.db2.gz PEBVUPGYAGTZRU-LJQANCHMSA-N 2 0 413.631 4.405 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000480703185 896065805 /nfs/dbraw/zinc/06/58/05/896065805.db2.gz JNWMKLGKGFZCEM-DEOSSOPVSA-N 2 0 405.586 4.360 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CC4(CCC4)Oc4ccccc43)cc2)CC1 ZINC000480725149 896085187 /nfs/dbraw/zinc/08/51/87/896085187.db2.gz XQDTWQQKOJIAJK-XMMPIXPASA-N 2 0 405.586 4.360 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccc(OC(F)F)cc1 ZINC000480728336 896088421 /nfs/dbraw/zinc/08/84/21/896088421.db2.gz LTMJGYWVMSJBMB-HXUWFJFHSA-N 2 0 404.505 4.066 20 0 HIADRP Cc1nc(-c2cc([C@H](C)[NH2+]Cc3ccnc(N4CC[NH+](C)CC4)c3)cs2)cs1 ZINC000480734350 896095028 /nfs/dbraw/zinc/09/50/28/896095028.db2.gz VVZVETHKCVWANP-HNNXBMFYSA-N 2 0 413.616 4.178 20 0 HIADRP C[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000480735679 896096916 /nfs/dbraw/zinc/09/69/16/896096916.db2.gz YEPAFRLYMGEUFA-CVEARBPZSA-N 2 0 423.388 4.086 20 0 HIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000480736041 896097762 /nfs/dbraw/zinc/09/77/62/896097762.db2.gz TYLPOCNPAVKGKY-GOSISDBHSA-N 2 0 421.614 4.040 20 0 HIADRP CC[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)[C@@H]1CCOC1 ZINC000480748647 896111356 /nfs/dbraw/zinc/11/13/56/896111356.db2.gz YEIVTZIBRBUDAU-NQIIRXRSSA-N 2 0 413.528 4.012 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000480771386 896136531 /nfs/dbraw/zinc/13/65/31/896136531.db2.gz QYCIDMDDUNQHQT-AWEZNQCLSA-N 2 0 411.434 4.402 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccc(-c2ccncc2)c1 ZINC000480878522 896236934 /nfs/dbraw/zinc/23/69/34/896236934.db2.gz FYTNMAHSLNNUPJ-NRFANRHFSA-N 2 0 400.570 4.347 20 0 HIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2sc(Cc3ccc(OC)c(OC)c3)nc2C)C1 ZINC000481019858 896349516 /nfs/dbraw/zinc/34/95/16/896349516.db2.gz GLDYHDHULKXKDO-LPHOPBHVSA-N 2 0 417.619 4.442 20 0 HIADRP COc1ccccc1[C@H](C[NH2+][C@H]1CCN(Cc2ccccn2)C[C@@H]1C)N1CCCCC1 ZINC000481181390 896522272 /nfs/dbraw/zinc/52/22/72/896522272.db2.gz ZJWDSWRHGFXZJO-TUSQITKMSA-N 2 0 422.617 4.117 20 0 HIADRP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000481239701 896590751 /nfs/dbraw/zinc/59/07/51/896590751.db2.gz GJAJYTSKZMOOSL-NRFANRHFSA-N 2 0 416.569 4.263 20 0 HIADRP COc1ccc(C2(C[NH2+][C@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C)CCOCC2)cc1 ZINC000481557085 896928313 /nfs/dbraw/zinc/92/83/13/896928313.db2.gz LCOQYFWKWPILBV-BWKNWUBXSA-N 2 0 408.586 4.244 20 0 HIADRP Cc1c([C@H](C)NCc2ccccc2OCC[NH+](C)C)nnn1-c1cccc(Cl)c1 ZINC000481718245 897112010 /nfs/dbraw/zinc/11/20/10/897112010.db2.gz AHEYNYYSMASSRC-INIZCTEOSA-N 2 0 413.953 4.020 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000481721926 897115902 /nfs/dbraw/zinc/11/59/02/897115902.db2.gz YILMAFMYVDFYDF-IBGZPJMESA-N 2 0 415.603 4.285 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)[C@@H](C)C1 ZINC000481736367 897131870 /nfs/dbraw/zinc/13/18/70/897131870.db2.gz NRCRMXPWPSQDJV-DHLKQENFSA-N 3 0 401.639 4.289 20 0 HIADRP C[C@@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000482116734 897567812 /nfs/dbraw/zinc/56/78/12/897567812.db2.gz XUPKNJNQJRCJBB-OAQYLSRUSA-N 2 0 401.558 4.007 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CCCOc3ccccc32)c1)C1CCOCC1 ZINC000482257413 897740599 /nfs/dbraw/zinc/74/05/99/897740599.db2.gz CTQKYWWGQDWPKP-DEOSSOPVSA-N 2 0 410.558 4.180 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cc(F)ccc1F ZINC000482263903 897748847 /nfs/dbraw/zinc/74/88/47/897748847.db2.gz MDFPSSLPSYJSJM-KRWDZBQOSA-N 2 0 404.501 4.305 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)c1 ZINC000482267677 897752548 /nfs/dbraw/zinc/75/25/48/897752548.db2.gz QFCTWCZIMNSSAO-JOCHJYFZSA-N 2 0 418.965 4.301 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)c(F)c1 ZINC000482271545 897757464 /nfs/dbraw/zinc/75/74/64/897757464.db2.gz TXHKTHMTVGFTLQ-SFHVURJKSA-N 2 0 416.537 4.175 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cccc(Cl)c1Cl ZINC000482434217 897992689 /nfs/dbraw/zinc/99/26/89/897992689.db2.gz DZBVNIZOIYHPFQ-INIZCTEOSA-N 2 0 408.377 4.036 20 0 HIADRP c1cnc(N2CC[NH+](CCCC[NH2+][C@@H]3CCCc4c5ccccc5sc43)CC2)nc1 ZINC000482450868 898017907 /nfs/dbraw/zinc/01/79/07/898017907.db2.gz JDSVBDHGKZSCQA-OAQYLSRUSA-N 2 0 421.614 4.261 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(-n2cncn2)cc1Cl ZINC000482452336 898018833 /nfs/dbraw/zinc/01/88/33/898018833.db2.gz ATNKQUGJDDLJCY-KRWDZBQOSA-N 2 0 413.953 4.102 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)CC1 ZINC000482497387 898077328 /nfs/dbraw/zinc/07/73/28/898077328.db2.gz YATMDEJXAOEIPB-IAGOWNOFSA-N 2 0 404.599 4.182 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000482498764 898079165 /nfs/dbraw/zinc/07/91/65/898079165.db2.gz BZRHXCPRKARELR-FXAWDEMLSA-N 2 0 416.610 4.190 20 0 HIADRP C[C@@H](C[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)CN1CC[NH+](C)CC1 ZINC000482502268 898084088 /nfs/dbraw/zinc/08/40/88/898084088.db2.gz COSYQZWMJRJDQL-QFBILLFUSA-N 2 0 419.038 4.314 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000482513898 898100400 /nfs/dbraw/zinc/10/04/00/898100400.db2.gz UGRYVIGVCVJQPQ-DVECYGJZSA-N 2 0 401.545 4.112 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(-n2ccnc2)cc1 ZINC000482539398 898126764 /nfs/dbraw/zinc/12/67/64/898126764.db2.gz ACOTTYNADAQZPF-MOPGFXCFSA-N 2 0 407.537 4.175 20 0 HIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@H]3CCN(Cc4ccccn4)C[C@@H]3C)c2)CC1 ZINC000482553636 898145373 /nfs/dbraw/zinc/14/53/73/898145373.db2.gz JQMPSOBYAVQVOH-NVQXNPDNSA-N 2 0 406.618 4.314 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](CCSc1ccccc1)c1ccc(F)cc1 ZINC000482634132 898237787 /nfs/dbraw/zinc/23/77/87/898237787.db2.gz UEXXESMYBIKVEK-CVDCTZTESA-N 2 0 401.595 4.275 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(-c2ccc(Br)cc2)s1 ZINC000482637413 898241755 /nfs/dbraw/zinc/24/17/55/898241755.db2.gz OUAZPRRFIMCTOB-JKSUJKDBSA-N 2 0 422.436 4.464 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2ccc(Br)cc2)s1 ZINC000482637407 898241920 /nfs/dbraw/zinc/24/19/20/898241920.db2.gz OUAZPRRFIMCTOB-CVEARBPZSA-N 2 0 422.436 4.464 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](CCSc1ccc(F)cc1)c1ccc(F)cc1 ZINC000482644946 898248742 /nfs/dbraw/zinc/24/87/42/898248742.db2.gz UUGGAEYASFAHCS-JPYJTQIMSA-N 2 0 419.585 4.414 20 0 HIADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000482649902 898253745 /nfs/dbraw/zinc/25/37/45/898253745.db2.gz RZZXQOKHYHSVMT-NQIIRXRSSA-N 2 0 405.542 4.289 20 0 HIADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c2ccsc2S1 ZINC000482652375 898254630 /nfs/dbraw/zinc/25/46/30/898254630.db2.gz RCCWFWWUXLWJMR-QKYXUNIQSA-N 2 0 415.628 4.161 20 0 HIADRP CC1(C(=O)NCc2ccccc2C[NH+]2CCCC2)CC[NH+](Cc2ccccc2)CC1 ZINC000482701588 898300754 /nfs/dbraw/zinc/30/07/54/898300754.db2.gz ANAOPIOOYOKULF-UHFFFAOYSA-N 2 0 405.586 4.201 20 0 HIADRP COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)CCC3)cc1 ZINC000482866641 898479251 /nfs/dbraw/zinc/47/92/51/898479251.db2.gz FZPXUXZSEPAYMS-QUCCMNQESA-N 2 0 415.603 4.023 20 0 HIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)CCC3)cc1 ZINC000482866637 898479849 /nfs/dbraw/zinc/47/98/49/898479849.db2.gz FZPXUXZSEPAYMS-AZUAARDMSA-N 2 0 415.603 4.023 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NC(C)(C)CC[NH+]2CCCCCC2)[C@@H]1c1cccs1 ZINC000483105118 898799041 /nfs/dbraw/zinc/79/90/41/898799041.db2.gz XUZYDBBNOQTVCW-TZIWHRDSSA-N 2 0 420.667 4.475 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2sc(-c3cccnc3)nc2C)[C@H](C)C1 ZINC000483141195 898820342 /nfs/dbraw/zinc/82/03/42/898820342.db2.gz RVZDOTQBNBIINL-UWVAXJGDSA-N 2 0 402.608 4.301 20 0 HIADRP O=C([C@@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000483140892 898820454 /nfs/dbraw/zinc/82/04/54/898820454.db2.gz DZRUOWLJIHKCLV-BVAGGSTKSA-N 2 0 409.618 4.156 20 0 HIADRP Cc1ccc(C[NH+]2CCSCC2)cc1NC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000483208854 898859892 /nfs/dbraw/zinc/85/98/92/898859892.db2.gz AFVOBWMDLNLVRG-FQEVSTJZSA-N 2 0 401.620 4.137 20 0 HIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]C1CC[NH+](C[C@H]3CCOC3)CC1)CCC2 ZINC000483214343 898863054 /nfs/dbraw/zinc/86/30/54/898863054.db2.gz DLOIBRGDOBYPLY-OXQOHEQNSA-N 2 0 415.578 4.417 20 0 HIADRP C[C@H]1[C@@H]([NH+]2CCCC2)CCN1C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000483301660 898932841 /nfs/dbraw/zinc/93/28/41/898932841.db2.gz UPVHOJDFXAPNST-RDPSFJRHSA-N 2 0 412.622 4.219 20 0 HIADRP C[C@@H](CCNC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[N@H+](C)Cc1ccccc1 ZINC000483331980 898960125 /nfs/dbraw/zinc/96/01/25/898960125.db2.gz UIQZZUKPVQXOSU-QFIPXVFZSA-N 2 0 407.602 4.316 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@@H](c2cccs2)[NH+]2CCC(C)CC2)C[C@@H]1C ZINC000483518622 899180251 /nfs/dbraw/zinc/18/02/51/899180251.db2.gz MYIFGNCHWWFXTQ-UFYCRDLUSA-N 2 0 406.640 4.035 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)(N2CCCCC2)CC1 ZINC000483543431 899204443 /nfs/dbraw/zinc/20/44/43/899204443.db2.gz LZPUKRSOORZHRK-FQEVSTJZSA-N 2 0 411.512 4.112 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CCCN(C)[C@H]1c1cccs1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483710518 899365970 /nfs/dbraw/zinc/36/59/70/899365970.db2.gz HQLYSNZIYONOGY-JXHRLWIKSA-N 2 0 401.620 4.422 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)C[C@@H]1C ZINC000483800317 899475645 /nfs/dbraw/zinc/47/56/45/899475645.db2.gz OLCGXVKJKHOGDV-ONTIZHBOSA-N 2 0 400.611 4.164 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H](CO)Cc1c(F)cccc1Cl ZINC000483803692 899478926 /nfs/dbraw/zinc/47/89/26/899478926.db2.gz FYVRIEWBOHPBBK-HFJQGTKSSA-N 2 0 404.957 4.130 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(-c2ccncc2)cc1 ZINC000484306621 899867953 /nfs/dbraw/zinc/86/79/53/899867953.db2.gz JSBKGUDOFQWDOS-IBGZPJMESA-N 2 0 408.590 4.026 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CCN1CCC([NH+](C)C)CC1 ZINC000484472588 899966340 /nfs/dbraw/zinc/96/63/40/899966340.db2.gz KWJWRHLSOOFHGC-OAHLLOKOSA-N 2 0 407.027 4.449 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCc3cc(Br)ccc32)CC1 ZINC000484480840 899973462 /nfs/dbraw/zinc/97/34/62/899973462.db2.gz ADCNHILZVIHEGC-QFIPXVFZSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccccc1OC(F)(F)F ZINC000484485690 899976849 /nfs/dbraw/zinc/97/68/49/899976849.db2.gz JNZPBWOEFQBLHX-INIZCTEOSA-N 2 0 408.464 4.393 20 0 HIADRP COc1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)ccc1OC(F)F ZINC000484486411 899978515 /nfs/dbraw/zinc/97/85/15/899978515.db2.gz KRUREGXKDYBNOS-INIZCTEOSA-N 2 0 420.500 4.104 20 0 HIADRP COc1ccc([C@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1NC(C)=O ZINC000484498828 899989801 /nfs/dbraw/zinc/98/98/01/899989801.db2.gz FGWUEAMALIDOOO-WKGYELDXSA-N 2 0 409.574 4.461 20 0 HIADRP COc1ccc([C@H](C)[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)cc1NC(C)=O ZINC000484498826 899990038 /nfs/dbraw/zinc/99/00/38/899990038.db2.gz FGWUEAMALIDOOO-QRVBRYPASA-N 2 0 409.574 4.461 20 0 HIADRP O[C@@H](COc1ccccc1Cl)C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000485463377 900757316 /nfs/dbraw/zinc/75/73/16/900757316.db2.gz GCMWHCBDLHTBGK-OAQYLSRUSA-N 2 0 414.977 4.068 20 0 HIADRP C[NH+](C)CCC1CC[NH+](CCC(=O)Nc2ccc(OCc3ccccc3)cc2)CC1 ZINC000485676060 900926720 /nfs/dbraw/zinc/92/67/20/900926720.db2.gz VVXKQOPOWRKBOJ-UHFFFAOYSA-N 2 0 409.574 4.258 20 0 HIADRP C[C@H](NC(=O)c1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487296032 902140568 /nfs/dbraw/zinc/14/05/68/902140568.db2.gz GSBGCHGFXVNNOA-OFVILXPXSA-N 2 0 405.586 4.313 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2csc(-c3cccs3)n2)[C@H](c2ccccc2)C1 ZINC000488488242 902850970 /nfs/dbraw/zinc/85/09/70/902850970.db2.gz AKIHXGQCJBYJHY-FQEVSTJZSA-N 2 0 412.628 4.340 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489294475 903315087 /nfs/dbraw/zinc/31/50/87/903315087.db2.gz PFGMRKBTKSBESP-ZJSXRUAMSA-N 2 0 420.601 4.128 20 0 HIADRP c1ccc(C[N@@H+]2CCC[C@]3(CCCOC3)C2)c(C[NH+]2CCC[C@]3(CCCOC3)C2)c1 ZINC000489390514 903360810 /nfs/dbraw/zinc/36/08/10/903360810.db2.gz MMVYXAGKHPYFJH-UIOOFZCWSA-N 2 0 412.618 4.472 20 0 HIADRP c1csc(C2([NH2+]CCOCC[NH2+]C3(c4nccs4)CCCC3)CCCC2)n1 ZINC000489623480 903502974 /nfs/dbraw/zinc/50/29/74/903502974.db2.gz PXADGSCGOPIICZ-UHFFFAOYSA-N 2 0 406.621 4.034 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000489842835 903625905 /nfs/dbraw/zinc/62/59/05/903625905.db2.gz WRMVHWGPDFLBLA-MZYLBHOOSA-N 2 0 424.589 4.016 20 0 HIADRP Clc1cccc(-c2cnc(C[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)o2)c1 ZINC000506047747 914742582 /nfs/dbraw/zinc/74/25/82/914742582.db2.gz PEJRLMQVQLVVLU-UHFFFAOYSA-N 2 0 403.954 4.319 20 0 HIADRP CC(C)[NH+]1CCC(NC(=O)N(CC[N@H+](C)Cc2ccccc2)Cc2ccccc2)CC1 ZINC000490016984 903726824 /nfs/dbraw/zinc/72/68/24/903726824.db2.gz WWSRNGSLWXCLQM-UHFFFAOYSA-N 2 0 422.617 4.203 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(F)c(C)c2)c2ccccc2Cl)CC1 ZINC000490120399 903776762 /nfs/dbraw/zinc/77/67/62/903776762.db2.gz UCIKLXOUDAIUMU-QHCPKHFHSA-N 2 0 403.973 4.494 20 0 HIADRP CSc1cccc([C@@H]([NH2+]C[C@@H](C)N2CC[NH+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491025645 904377547 /nfs/dbraw/zinc/37/75/47/904377547.db2.gz WUAZDEKBRSVKIH-OPAMFIHVSA-N 2 0 405.558 4.002 20 0 HIADRP CCOc1ccc([C@H]([NH2+]CC2CC[NH+](CCO)CC2)c2ccccc2Cl)cc1 ZINC000491037692 904391314 /nfs/dbraw/zinc/39/13/14/904391314.db2.gz OGFVHZDTPZQGIK-QHCPKHFHSA-N 2 0 402.966 4.122 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000491058967 904403411 /nfs/dbraw/zinc/40/34/11/904403411.db2.gz JHAMBVBUOAIESN-HSZRJFAPSA-N 2 0 417.544 4.241 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c2ccccc2C1 ZINC000492146162 904805791 /nfs/dbraw/zinc/80/57/91/904805791.db2.gz YTRBJPYKNSXGLV-PPCYGTQYSA-N 2 0 403.570 4.265 20 0 HIADRP C[C@@H](C(=O)Nc1ccccc1-c1ccccc1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000492377272 904840909 /nfs/dbraw/zinc/84/09/09/904840909.db2.gz QDICTOLCZNMBRV-NRFANRHFSA-N 2 0 421.585 4.115 20 0 HIADRP Cc1ccc([C@@H]([NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)c2ccccc2)cc1 ZINC000493206260 905050973 /nfs/dbraw/zinc/05/09/73/905050973.db2.gz PYRZOLACJGCPNE-VWLOTQADSA-N 2 0 407.602 4.301 20 0 HIADRP COC[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(Cl)cc1 ZINC000493738518 905207997 /nfs/dbraw/zinc/20/79/97/905207997.db2.gz PQDODLKAAQOQGC-IXFSTUDKSA-N 2 0 402.966 4.427 20 0 HIADRP COC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(Cl)cc1 ZINC000493738519 905208562 /nfs/dbraw/zinc/20/85/62/905208562.db2.gz PQDODLKAAQOQGC-PNCHPQGNSA-N 2 0 402.966 4.427 20 0 HIADRP FC(F)(F)C1CCC(C[NH+]2CCN([C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)CC1 ZINC000512428385 921154491 /nfs/dbraw/zinc/15/44/91/921154491.db2.gz SUDHMDYKPPHMSM-LZBANZJXSA-N 2 0 409.540 4.247 20 0 HIADRP CC(C)C[N@@H+]1Cc2cccc(NC(=O)c3ccc(N4CC[NH+](C(C)C)CC4)cc3)c2C1 ZINC000494442688 905726890 /nfs/dbraw/zinc/72/68/90/905726890.db2.gz LTGFXXMDBICKEX-UHFFFAOYSA-N 2 0 420.601 4.441 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H](C[C@H]1CCOC1)c1ccc(F)cc1 ZINC000495000776 906162847 /nfs/dbraw/zinc/16/28/47/906162847.db2.gz VMORDFNRQQMHHV-NGXZDTIWSA-N 2 0 412.549 4.040 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H](C[C@H]3CCOC3)c3ccc(F)cc3)cc2)CC1 ZINC000495090532 906231641 /nfs/dbraw/zinc/23/16/41/906231641.db2.gz IKMYSOJQONLVRT-PXDATVDWSA-N 2 0 412.549 4.040 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495092390 906232386 /nfs/dbraw/zinc/23/23/86/906232386.db2.gz LYKSIHXMCQWZFB-DFBJGRDBSA-N 2 0 412.549 4.040 20 0 HIADRP C[C@H]([NH2+]C1CCC2(CC1)c1ccccc1NC2=O)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495421112 906441280 /nfs/dbraw/zinc/44/12/80/906441280.db2.gz NVBZSWHCZAVWQF-ZXDSDLQLSA-N 2 0 403.570 4.319 20 0 HIADRP Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000495445625 906456006 /nfs/dbraw/zinc/45/60/06/906456006.db2.gz XXNZWLLDWLJTBR-LSDHHAIUSA-N 2 0 412.500 4.414 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc2ccccc2c1 ZINC000495466307 906469104 /nfs/dbraw/zinc/46/91/04/906469104.db2.gz XLYCPLWJNDYCMP-KBMIEXCESA-N 2 0 401.554 4.388 20 0 HIADRP O=C1CCCN1Cc1ccc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000512619266 921264156 /nfs/dbraw/zinc/26/41/56/921264156.db2.gz LPWNQTWCSODHNM-KKUQBAQOSA-N 2 0 417.597 4.199 20 0 HIADRP COc1ccccc1[C@@H](C)NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000497292767 906829120 /nfs/dbraw/zinc/82/91/20/906829120.db2.gz JLGZYCKUIXPSQV-RTWAWAEBSA-N 2 0 423.601 4.427 20 0 HIADRP c1cn(Cc2ccc(C[NH2+][C@H]3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)cc2)cn1 ZINC000512648528 921273902 /nfs/dbraw/zinc/27/39/02/921273902.db2.gz NZFPGTZPFHKNBP-GSDHBNRESA-N 2 0 400.570 4.322 20 0 HIADRP c1cn(Cc2ccccc2C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000512660439 921279006 /nfs/dbraw/zinc/27/90/06/921279006.db2.gz NFTPFLKPAJSYBI-JIMJEQGWSA-N 2 0 400.570 4.322 20 0 HIADRP CCCN(CC[NH+]1CCCCC1)C(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000497610845 907090177 /nfs/dbraw/zinc/09/01/77/907090177.db2.gz KOBPRZGSOQDUEK-NRFANRHFSA-N 2 0 400.611 4.120 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N(Cc2ccncc2)C[C@H]2CCC[N@@H+]2CC)cc1 ZINC000512708048 921293375 /nfs/dbraw/zinc/29/33/75/921293375.db2.gz MGCUTAPMKRIRFS-XMMPIXPASA-N 2 0 408.590 4.050 20 0 HIADRP C[C@H](NC(=O)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1)[C@H](c1ccccc1)[NH+](C)C ZINC000497634216 907117873 /nfs/dbraw/zinc/11/78/73/907117873.db2.gz QKBLMCRWTPAVAR-MZLICYQSSA-N 2 0 408.590 4.203 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccccc2C[NH+]2CCCCCC2)CC1 ZINC000497701485 907205450 /nfs/dbraw/zinc/20/54/50/907205450.db2.gz SJURMLSMUPHLRE-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP C[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000498124358 907638379 /nfs/dbraw/zinc/63/83/79/907638379.db2.gz HNBUMFPDMCCJMT-WWNPGLIZSA-N 2 0 424.589 4.016 20 0 HIADRP Cc1nc(CN2CCC(C[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)CC2)oc1C ZINC000499151787 908510869 /nfs/dbraw/zinc/51/08/69/908510869.db2.gz ZGMVUABFUURRCI-MPIKPJSNSA-N 2 0 422.617 4.289 20 0 HIADRP COc1cccc(N2CCC[C@H]([NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499213869 908569642 /nfs/dbraw/zinc/56/96/42/908569642.db2.gz UUORXWHMYUAVCI-HFOXQMJASA-N 2 0 405.586 4.449 20 0 HIADRP O=C(CCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)N1Cc2ccccc2C1 ZINC000499220239 908577494 /nfs/dbraw/zinc/57/74/94/908577494.db2.gz VBEIRJJWUROGGY-MPIKPJSNSA-N 2 0 403.570 4.094 20 0 HIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CC2(CN4CCOCC4)CCCCC2)C3)cc1 ZINC000499238806 908604892 /nfs/dbraw/zinc/60/48/92/908604892.db2.gz XDJAPVILZVAMHI-MPIKPJSNSA-N 2 0 411.634 4.054 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+]Cc3cccc(OCc4ccc(F)cc4)c3)CC2)CC1 ZINC000499661238 908868199 /nfs/dbraw/zinc/86/81/99/908868199.db2.gz BIMWYSAEXLZLIF-UHFFFAOYSA-N 2 0 411.565 4.053 20 0 HIADRP COc1ccc2c(c1)C[N@@H+](CCCN1CC[NH+](C(C)C)CC1)[C@@H](c1ccccc1)C2 ZINC000500073909 909544704 /nfs/dbraw/zinc/54/47/04/909544704.db2.gz JOZDFQICAZGLLW-AREMUKBSSA-N 2 0 407.602 4.211 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000500441882 909861115 /nfs/dbraw/zinc/86/11/15/909861115.db2.gz ZKJRKKNMUPHYSG-VXKWHMMOSA-N 2 0 405.586 4.020 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)NCc2ccc(C[NH+](C)C)cc2)C1 ZINC000500848017 910122949 /nfs/dbraw/zinc/12/29/49/910122949.db2.gz HHHFVUKTPFQGOZ-NHCUHLMSSA-N 2 0 422.617 4.226 20 0 HIADRP CC1(C)CC(NC(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)CC(C)(C)[NH2+]1 ZINC000501006818 910228950 /nfs/dbraw/zinc/22/89/50/910228950.db2.gz KOQUIOFVQILXAT-IBGZPJMESA-N 2 0 407.002 4.085 20 0 HIADRP C[N@H+](CCc1nc(-c2cccc(Cl)c2)no1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501028604 910246178 /nfs/dbraw/zinc/24/61/78/910246178.db2.gz FDHZMMCNHRITNN-UHFFFAOYSA-N 2 0 411.937 4.176 20 0 HIADRP C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501039080 910253477 /nfs/dbraw/zinc/25/34/77/910253477.db2.gz LCRAPTRSXWFLCG-NRFANRHFSA-N 2 0 420.601 4.057 20 0 HIADRP C[C@@H](OC[C@H](O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000501052593 910262535 /nfs/dbraw/zinc/26/25/35/910262535.db2.gz PCQSYHLDBAUUIK-WZONZLPQSA-N 2 0 417.981 4.022 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000501054299 910264859 /nfs/dbraw/zinc/26/48/59/910264859.db2.gz XUTHZHLKZCLQTN-SIKLNZKXSA-N 2 0 421.029 4.431 20 0 HIADRP CC(C)[N@H+](CCCN1CC[NH+](C(C)C)CC1)Cc1cc(Br)ccc1F ZINC000501136669 910316655 /nfs/dbraw/zinc/31/66/55/910316655.db2.gz BRWDSBWHBYYSCU-UHFFFAOYSA-N 2 0 414.407 4.215 20 0 HIADRP Cc1cc(Br)cc(C)c1NC(=O)CCC[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513143202 921580619 /nfs/dbraw/zinc/58/06/19/921580619.db2.gz AWPXJFVYCJPIAH-DFNIBXOVSA-N 2 0 422.411 4.342 20 0 HIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000501446364 910572664 /nfs/dbraw/zinc/57/26/64/910572664.db2.gz GQEVIJSNCRUFMA-LGMDPLHJSA-N 2 0 419.491 4.190 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)c1)C1CCOCC1 ZINC000501482774 910597407 /nfs/dbraw/zinc/59/74/07/910597407.db2.gz UPIMCPVSAKDFAE-ISKFKSNPSA-N 2 0 423.601 4.387 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)c2cccs2)CC1 ZINC000501520893 910629972 /nfs/dbraw/zinc/62/99/72/910629972.db2.gz XPSNYYUGRQNFKW-MOPGFXCFSA-N 2 0 420.648 4.185 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2cccc(Cl)c2C)CC1 ZINC000501802229 910853711 /nfs/dbraw/zinc/85/37/11/910853711.db2.gz FFSWHECAQFTSQF-SFHVURJKSA-N 2 0 410.002 4.046 20 0 HIADRP CSc1nnc(CCC[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)n1CC(C)C ZINC000513208410 921624524 /nfs/dbraw/zinc/62/45/24/921624524.db2.gz SQECCNLZVLHUAN-AZUAARDMSA-N 2 0 407.672 4.221 20 0 HIADRP CSc1nnc(CCC[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)n1CC(C)C ZINC000513208705 921624714 /nfs/dbraw/zinc/62/47/14/921624714.db2.gz XJXJNJCNOFAAQZ-UYAOXDASSA-N 2 0 407.672 4.221 20 0 HIADRP CC1CC[NH+](C[C@H]2CCCN(C(=O)NC3CCC([NH+]4CCC(C)CC4)CC3)C2)CC1 ZINC000502766383 911789640 /nfs/dbraw/zinc/78/96/40/911789640.db2.gz GVGFGWPPVHIFOE-ZKMFCFPVSA-N 2 0 418.670 4.183 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)[NH+]2CCCC2)o1 ZINC000502767459 911789737 /nfs/dbraw/zinc/78/97/37/911789737.db2.gz LQCBKCWPINJVQH-LZBANZJXSA-N 2 0 416.610 4.067 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)NCc2ccccc2C[NH+]2CCCCC2)C1 ZINC000502864167 911870927 /nfs/dbraw/zinc/87/09/27/911870927.db2.gz SOUICMPDZCGKCP-VXKWHMMOSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NCc1ccccc1C[NH+]1CCCCC1 ZINC000502877260 911878557 /nfs/dbraw/zinc/87/85/57/911878557.db2.gz USCOULKINVIFAE-OAQYLSRUSA-N 2 0 400.611 4.126 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NCC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000503089969 912060043 /nfs/dbraw/zinc/06/00/43/912060043.db2.gz XDZPDAWLDGJWRD-OAQYLSRUSA-N 2 0 422.617 4.327 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000503129672 912092941 /nfs/dbraw/zinc/09/29/41/912092941.db2.gz CWHXNGUXEUAPEZ-RUZDIDTESA-N 2 0 422.617 4.376 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1)c1ccccc1 ZINC000503151200 912116296 /nfs/dbraw/zinc/11/62/96/912116296.db2.gz JUXYCNQZSGDCRH-QUCCMNQESA-N 2 0 414.619 4.314 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000506331701 914942540 /nfs/dbraw/zinc/94/25/40/914942540.db2.gz PCCZDWNMQWBZOB-KRWDZBQOSA-N 2 0 415.965 4.451 20 0 HIADRP CN(c1ccccc1C[N@H+]1CC=C(c2c[nH]c3ncccc23)CC1)C1CC[NH+](C)CC1 ZINC000506647790 915316430 /nfs/dbraw/zinc/31/64/30/915316430.db2.gz IEHIMYPVQAKFGH-UHFFFAOYSA-N 2 0 415.585 4.383 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)C1 ZINC000506862979 915651581 /nfs/dbraw/zinc/65/15/81/915651581.db2.gz JDULBFJZEGJCMB-AOHZBQACSA-N 2 0 412.622 4.120 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000506913735 915714131 /nfs/dbraw/zinc/71/41/31/915714131.db2.gz FQGVQMKUTZTZOX-FCHUYYIVSA-N 2 0 414.638 4.323 20 0 HIADRP c1sc(CC[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)nc1-c1ccncc1 ZINC000507464744 916234103 /nfs/dbraw/zinc/23/41/03/916234103.db2.gz YNVVLMYTDQNQLB-BHDDXSALSA-N 2 0 404.583 4.248 20 0 HIADRP C[C@H](Nc1ccccc1C[NH+]1CCC(CO)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508699517 917459923 /nfs/dbraw/zinc/45/99/23/917459923.db2.gz OICMRIBWLJVKPD-URXFXBBRSA-N 2 0 407.602 4.213 20 0 HIADRP COc1cccc([C@H](CN[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)c1 ZINC000508718555 917480964 /nfs/dbraw/zinc/48/09/64/917480964.db2.gz NYRYUPISEFJWPR-QQSVUBKYSA-N 2 0 407.602 4.332 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccccn2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721152 917482428 /nfs/dbraw/zinc/48/24/28/917482428.db2.gz TWVRQIQNBYAOSY-REWPJTCUSA-N 2 0 414.553 4.334 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@@H](C)[C@H](c2ccccc2)[NH+](C)C)CC1)CC1CC1 ZINC000508869823 917623858 /nfs/dbraw/zinc/62/38/58/917623858.db2.gz JDBCTVKIKHBRRP-GBXCKJPGSA-N 2 0 414.638 4.221 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@H](C)[C@@H](c1ccccc1C)[NH+](C)C ZINC000508915800 917674156 /nfs/dbraw/zinc/67/41/56/917674156.db2.gz GKQOPWIKINKVSO-YKSBVNFPSA-N 2 0 410.606 4.280 20 0 HIADRP CCC[N@H+](C)[C@@H](CNC(=O)N1CC[C@@H](C[NH+](C)CC2CC2)C1)c1ccc(Cl)cc1 ZINC000509040472 917794186 /nfs/dbraw/zinc/79/41/86/917794186.db2.gz SETMHHRIJRJXMZ-UGKGYDQZSA-N 2 0 421.029 4.096 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N(C)[C@@H](C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000509047916 917798620 /nfs/dbraw/zinc/79/86/20/917798620.db2.gz CXJBEPAGQYMNIB-LAUBAEHRSA-N 2 0 409.018 4.095 20 0 HIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]Cc3ccc(-c4cnn(C)c4)s3)cc2)C[C@H](C)O1 ZINC000509533245 918181023 /nfs/dbraw/zinc/18/10/23/918181023.db2.gz POMOBFWZUGRBDU-ROUUACIJSA-N 2 0 410.587 4.048 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N1CC[C@@H](C)[N@H+](Cc2ccccc2)CC1)c1ccco1 ZINC000509592575 918241485 /nfs/dbraw/zinc/24/14/85/918241485.db2.gz UFDPMCWYZWLMPH-VWPQPMDRSA-N 2 0 412.578 4.015 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccco1 ZINC000509595721 918246993 /nfs/dbraw/zinc/24/69/93/918246993.db2.gz JGDUGESAVKIKEZ-HBMCJLEFSA-N 2 0 404.599 4.006 20 0 HIADRP C[C@H]1C[C@H](CCNC(=O)NCCCC[N@@H+]2CCCC[C@H]2C)C[NH+]1Cc1ccccc1 ZINC000509793918 918400907 /nfs/dbraw/zinc/40/09/07/918400907.db2.gz YJZZZFDLOZFTTO-GPXNEJASSA-N 2 0 414.638 4.241 20 0 HIADRP COc1ccc([C@H](CNC(=O)c2oc3ccccc3c2C[NH+](C)C)[NH+]2CCCC2)cc1 ZINC000510181572 918730410 /nfs/dbraw/zinc/73/04/10/918730410.db2.gz AWCOWPXLZWGNBR-QFIPXVFZSA-N 2 0 421.541 4.070 20 0 HIADRP CCCC[NH+]1CCC([NH2+]C2CCC(NC(=O)COc3ccc(Cl)cc3)CC2)CC1 ZINC000510210285 918757837 /nfs/dbraw/zinc/75/78/37/918757837.db2.gz JEJPPCLLGNFRKF-UHFFFAOYSA-N 2 0 422.013 4.000 20 0 HIADRP C[C@H](NC(=O)NCc1ccccc1C[NH+]1CCCCC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000510512650 918959892 /nfs/dbraw/zinc/95/98/92/918959892.db2.gz PPUWRXVKYRDWJV-UNMCSNQZSA-N 2 0 412.622 4.125 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000511162493 919784011 /nfs/dbraw/zinc/78/40/11/919784011.db2.gz RPIPTFZDKDUJIE-JOCHJYFZSA-N 2 0 419.613 4.447 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000511658369 920322936 /nfs/dbraw/zinc/32/29/36/920322936.db2.gz XVVUHMTWAQTMCK-UHFFFAOYSA-N 2 0 413.631 4.331 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000511803588 920498217 /nfs/dbraw/zinc/49/82/17/920498217.db2.gz ZEGNLXIRJBSBDN-XMMPIXPASA-N 2 0 405.586 4.313 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CCC([NH+]3CCc4ccccc4C3)CC2)cc1)C1CC1 ZINC000511927670 920675971 /nfs/dbraw/zinc/67/59/71/920675971.db2.gz WHQAAEJISHCVRQ-UHFFFAOYSA-N 2 0 417.597 4.334 20 0 HIADRP C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+]CCC1CC[NH+](C)CC1 ZINC000512069401 920836151 /nfs/dbraw/zinc/83/61/51/920836151.db2.gz XOSRMTLDOJZNAZ-ZDUSSCGKSA-N 2 0 405.892 4.397 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c(Br)c1 ZINC000512135314 920882609 /nfs/dbraw/zinc/88/26/09/920882609.db2.gz IGQYXJKWLLGNPI-UHFFFAOYSA-N 2 0 407.352 4.078 20 0 HIADRP C[C@@H]1C[NH+](CC2CC[NH+](Cc3cn(C)nc3-c3ccccc3Cl)CC2)C[C@@H](C)O1 ZINC000512176842 920916672 /nfs/dbraw/zinc/91/66/72/920916672.db2.gz DZJACBMFZORFKO-QZTJIDSGSA-N 2 0 416.997 4.062 20 0 HIADRP CCOc1cc(C[NH+]2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)ccc1OC(F)F ZINC000512188154 920930252 /nfs/dbraw/zinc/93/02/52/920930252.db2.gz WHWAHEVOXWZREZ-IAGOWNOFSA-N 2 0 412.521 4.008 20 0 HIADRP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(-c4ccc(Cl)c(Cl)c4)o3)C2)CC1 ZINC000513466706 921829095 /nfs/dbraw/zinc/82/90/95/921829095.db2.gz JPGXOVAFLIYYOT-KRWDZBQOSA-N 2 0 408.373 4.465 20 0 HIADRP CCOc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc(Cl)c1O ZINC000513612922 921941733 /nfs/dbraw/zinc/94/17/33/921941733.db2.gz KEPYGRUFPKIQNW-IRXDYDNUSA-N 2 0 418.965 4.343 20 0 HIADRP c1cnn(-c2ncccc2C[NH2+][C@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000513668113 921991372 /nfs/dbraw/zinc/99/13/72/921991372.db2.gz VXITWJVKGPYAIM-HJOGWXRNSA-N 2 0 401.558 4.048 20 0 HIADRP COc1ccc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c(C)c1OC ZINC000513713161 922032864 /nfs/dbraw/zinc/03/28/64/922032864.db2.gz LHRARWUVJCSWQS-NRFANRHFSA-N 2 0 411.590 4.265 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)[NH+]2CCCC2)cc1 ZINC000514029682 922352007 /nfs/dbraw/zinc/35/20/07/922352007.db2.gz UYHZBZZOJIHNNM-VWLOTQADSA-N 2 0 420.601 4.227 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3ccc(OC)c(OC)c3C)cc2)CC1 ZINC000514101150 922429204 /nfs/dbraw/zinc/42/92/04/922429204.db2.gz ZCWNLVYBSINQEC-FQEVSTJZSA-N 2 0 411.590 4.001 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cccc(OCc3ccc(F)cc3)c2)C1 ZINC000514237199 922577039 /nfs/dbraw/zinc/57/70/39/922577039.db2.gz FGFWWGNOLFRHHO-VWLOTQADSA-N 2 0 420.528 4.261 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(=O)Nc1ccc(F)c(F)c1 ZINC000515518762 923148828 /nfs/dbraw/zinc/14/88/28/923148828.db2.gz NDLLWNWSWNJYNT-SJORKVTESA-N 2 0 401.501 4.314 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@@H]2CCCNc3ccccc32)CC1 ZINC000516116569 923553459 /nfs/dbraw/zinc/55/34/59/923553459.db2.gz NUZXCAGSKLCWLL-OAQYLSRUSA-N 2 0 418.507 4.494 20 0 HIADRP COC1CC[NH+](C2(CN[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)CCCC2)CC1 ZINC000516708469 923857093 /nfs/dbraw/zinc/85/70/93/923857093.db2.gz GWTKPMWNAXNWMK-JOZNFPNDSA-N 2 0 411.634 4.195 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CN(CC[NH+](C)C)Cc1ccc(C(F)(F)F)cc1 ZINC000516997097 923959010 /nfs/dbraw/zinc/95/90/10/923959010.db2.gz BWWCEMKQGSKZSG-UHFFFAOYSA-N 2 0 417.479 4.158 20 0 HIADRP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)C1 ZINC000517140151 924021733 /nfs/dbraw/zinc/02/17/33/924021733.db2.gz DMCZIGUQUCJADN-VSKRKVRLSA-N 2 0 414.638 4.084 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H](NC(=O)c1ccc(C[NH+]3CCCC3)cc1)c1ccccc1O2 ZINC000517397229 924156345 /nfs/dbraw/zinc/15/63/45/924156345.db2.gz UFJWMOYMXWENCO-QHCPKHFHSA-N 2 0 419.569 4.000 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)cc1 ZINC000517422411 924172870 /nfs/dbraw/zinc/17/28/70/924172870.db2.gz UXWSGLHVORPSOC-QPPBQGQZSA-N 2 0 412.622 4.221 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000518632082 927391823 /nfs/dbraw/zinc/39/18/23/927391823.db2.gz YCCMBWCNZQURMG-ZJSXRUAMSA-N 2 0 412.622 4.221 20 0 HIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc(OC)cc2)C1 ZINC000518759719 927479454 /nfs/dbraw/zinc/47/94/54/927479454.db2.gz DBZZTTPVHUSSSS-FQEVSTJZSA-N 2 0 404.558 4.369 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+]Cc1c(Cl)cccc1OCc1ccccc1Cl ZINC000518793997 927497208 /nfs/dbraw/zinc/49/72/08/927497208.db2.gz IWMDMXIQCRJCOB-KRWDZBQOSA-N 2 0 422.400 4.298 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000520214045 928392891 /nfs/dbraw/zinc/39/28/91/928392891.db2.gz CKFLUJOXQZXKKX-UHFFFAOYSA-N 2 0 403.517 4.120 20 0 HIADRP FC(F)(F)COc1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cn1 ZINC000521062229 928968996 /nfs/dbraw/zinc/96/89/96/928968996.db2.gz XZMVYOJINHBVGY-WKCHPHFGSA-N 2 0 419.491 4.350 20 0 HIADRP CC(C)c1ccc([C@H](NC(=O)N(CC[NH+](C)C)CC[NH+](C)C)c2cccs2)cc1 ZINC000525452347 930248740 /nfs/dbraw/zinc/24/87/40/930248740.db2.gz YRTNHGOHLNFZFD-QFIPXVFZSA-N 2 0 416.635 4.096 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@H](c1ccccc1Cl)[NH+]1CCCC1 ZINC000526095681 930530036 /nfs/dbraw/zinc/53/00/36/930530036.db2.gz BWGWKSDBIHCPST-JOCHJYFZSA-N 2 0 414.981 4.403 20 0 HIADRP Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000527376870 930652086 /nfs/dbraw/zinc/65/20/86/930652086.db2.gz DAPRKBLTVCWLHG-FQEVSTJZSA-N 2 0 412.578 4.092 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NC1CC[NH+](C(C)(C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000530569153 930753127 /nfs/dbraw/zinc/75/31/27/930753127.db2.gz BMZJWJNEVDWKHY-IBGZPJMESA-N 2 0 413.528 4.467 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NCc1cccc(C[NH+]2CCCC2)c1)c1ccc(Cl)cc1 ZINC000530839322 930837489 /nfs/dbraw/zinc/83/74/89/930837489.db2.gz MWMWRKRLGZJIGM-QFIPXVFZSA-N 2 0 414.981 4.038 20 0 HIADRP C[C@H](c1ccc(Cl)cc1)[NH+]1CCC(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1 ZINC000530926996 930860466 /nfs/dbraw/zinc/86/04/66/930860466.db2.gz KGQSNNQRVWRSDA-LJQANCHMSA-N 2 0 413.993 4.361 20 0 HIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3ccc(OCc4ccccn4)cc3)CC2)C[C@@H](C)O1 ZINC000530939603 930862899 /nfs/dbraw/zinc/86/28/99/930862899.db2.gz CYJLJWYFZLPEGW-FGZHOGPDSA-N 2 0 423.601 4.372 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)C[C@H]1C ZINC000531140668 930940814 /nfs/dbraw/zinc/94/08/14/930940814.db2.gz FNHLALPFUPLUHT-CBRSEMLDSA-N 2 0 410.602 4.267 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2cccc(C[NH+]3CCC(C)CC3)c2)CC1 ZINC000531205595 930964908 /nfs/dbraw/zinc/96/49/08/930964908.db2.gz ZXQLCVJODHPUGK-UHFFFAOYSA-N 2 0 420.601 4.155 20 0 HIADRP COc1ccc([C@H](CNC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccccc2)[NH+]2CCCC2)cc1 ZINC000531281675 930999942 /nfs/dbraw/zinc/99/99/42/930999942.db2.gz XZYVKKFYFUIDNW-DQEYMECFSA-N 2 0 421.585 4.003 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NC[C@@H](CC(C)C)[NH2+][C@@H](C)c2ccccc2)CC1 ZINC000531460437 931065948 /nfs/dbraw/zinc/06/59/48/931065948.db2.gz OXXJVHYAULMFOZ-XUZZJYLKSA-N 2 0 422.617 4.488 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@@H]1CCCO[C@H]1c1ccccc1)C1CC[NH+](C)CC1 ZINC000531596856 931115272 /nfs/dbraw/zinc/11/52/72/931115272.db2.gz AOVFLSYXSNFEAN-OZXSUGGESA-N 2 0 407.602 4.475 20 0 HIADRP CCCC(=O)Nc1cccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000531597486 931116565 /nfs/dbraw/zinc/11/65/65/931116565.db2.gz QTFKBUCSCYXJQJ-UHFFFAOYSA-N 2 0 408.590 4.245 20 0 HIADRP c1ccc(CC2CC[NH+](CCCC[NH2+]C3CCN(Cc4ccccn4)CC3)CC2)cc1 ZINC000531714710 931171791 /nfs/dbraw/zinc/17/17/91/931171791.db2.gz NRUZSRVKVAWSMK-UHFFFAOYSA-N 2 0 420.645 4.371 20 0 HIADRP C[C@@H](c1ccccc1)N1CC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000531785713 931196888 /nfs/dbraw/zinc/19/68/88/931196888.db2.gz YREUVADLRMJCCK-OZXSUGGESA-N 2 0 421.629 4.483 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000531937973 931254186 /nfs/dbraw/zinc/25/41/86/931254186.db2.gz UXRKOTWSGBFBLV-QGZVFWFLSA-N 2 0 410.400 4.268 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000531937518 931254377 /nfs/dbraw/zinc/25/43/77/931254377.db2.gz JGDDWDJCWKFTQA-ZCNNSNEGSA-N 2 0 414.615 4.419 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000531947122 931258935 /nfs/dbraw/zinc/25/89/35/931258935.db2.gz FKOMFWDWDNBSRY-OALUTQOASA-N 2 0 406.014 4.292 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CCC1CC[NH+](C)CC1 ZINC000531958310 931264702 /nfs/dbraw/zinc/26/47/02/931264702.db2.gz HTSGTBYMFDDQHW-CYBMUJFWSA-N 2 0 405.892 4.397 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCOc4c(Cl)c(Cl)ccc43)cn2)CC1 ZINC000531989673 931278183 /nfs/dbraw/zinc/27/81/83/931278183.db2.gz NGYFRSCWPYLONJ-SFHVURJKSA-N 2 0 421.372 4.144 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)C1CC[NH+](C)CC1 ZINC000532108344 931315456 /nfs/dbraw/zinc/31/54/56/931315456.db2.gz HGNJIUFKDWBBBI-UHFFFAOYSA-N 3 0 406.618 4.103 20 0 HIADRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000532120209 931321095 /nfs/dbraw/zinc/32/10/95/931321095.db2.gz SLYBBQOVAXCWPA-UHFFFAOYSA-N 2 0 407.352 4.034 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]C2CCC3(CCOCC3)CC2)cc1OC ZINC000532210794 931354283 /nfs/dbraw/zinc/35/42/83/931354283.db2.gz BYXOHFGLAXHSDM-UHFFFAOYSA-N 2 0 404.595 4.245 20 0 HIADRP COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000532213551 931355057 /nfs/dbraw/zinc/35/50/57/931355057.db2.gz YGIXKRCSZRDOHM-HXUWFJFHSA-N 2 0 412.574 4.344 20 0 HIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)ccc1SC ZINC000532214896 931355974 /nfs/dbraw/zinc/35/59/74/931355974.db2.gz YSOWUGINKOYIQG-QGZVFWFLSA-N 2 0 400.588 4.225 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccccc1C(F)(F)F ZINC000532230551 931364270 /nfs/dbraw/zinc/36/42/70/931364270.db2.gz ADXOVAVHGHPMCL-LPHOPBHVSA-N 2 0 419.491 4.254 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(N3CCCCCC3)nc2)CC1 ZINC000532296038 931389426 /nfs/dbraw/zinc/38/94/26/931389426.db2.gz FISPRASBBQKYBD-UHFFFAOYSA-N 2 0 421.633 4.284 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2cn(-c3ccccc3)nc2C(C)(C)C)cc1 ZINC000532328750 931398776 /nfs/dbraw/zinc/39/87/76/931398776.db2.gz TYAAZGXKPVHZAQ-UHFFFAOYSA-N 2 0 406.574 4.400 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000532454259 931441527 /nfs/dbraw/zinc/44/15/27/931441527.db2.gz GYTPPJPAUYSJGO-LJQANCHMSA-N 2 0 413.993 4.463 20 0 HIADRP C[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(Br)cc1 ZINC000532497857 931462892 /nfs/dbraw/zinc/46/28/92/931462892.db2.gz ZIGUUIXPKHFTRF-UTKZUKDTSA-N 2 0 402.380 4.088 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](CCC(=O)NC(c2ccccc2)c2ccccc2)CC1 ZINC000532950184 931708647 /nfs/dbraw/zinc/70/86/47/931708647.db2.gz SZNJGCCQQBWPFT-UHFFFAOYSA-N 2 0 407.602 4.335 20 0 HIADRP C(CN1CCC[C@H](C[NH+]2CCCCCC2)C1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000532950331 931708836 /nfs/dbraw/zinc/70/88/36/931708836.db2.gz IFWTVDRGGDBHPG-WMPKNSHKSA-N 2 0 418.714 4.162 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[NH2+]C4CCC(C[NH+](C)C)CC4)cc3)nc12 ZINC000533068935 931761733 /nfs/dbraw/zinc/76/17/33/931761733.db2.gz VWRVZMZPERYRAT-UHFFFAOYSA-N 2 0 406.574 4.432 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000533253857 931820321 /nfs/dbraw/zinc/82/03/21/931820321.db2.gz POGAYIQLEGSLOZ-UHFFFAOYSA-N 2 0 411.434 4.087 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](CC(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000533271722 931824723 /nfs/dbraw/zinc/82/47/23/931824723.db2.gz QECFBKLEILQOFF-HNNXBMFYSA-N 2 0 400.394 4.223 20 0 HIADRP O=C(CC[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)NC(c1ccccc1)c1ccccc1 ZINC000533426403 931864830 /nfs/dbraw/zinc/86/48/30/931864830.db2.gz CJZXERYEEQIPPD-XMMPIXPASA-N 2 0 405.586 4.233 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](CNCc2nc(-c3ccc(Br)cc3)c[nH]2)C1 ZINC000533444374 931870970 /nfs/dbraw/zinc/87/09/70/931870970.db2.gz UABVTTIBRACSCE-MRXNPFEDSA-N 2 0 405.384 4.297 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)[C@@H](c2ccccc2)C1 ZINC000534352020 932389876 /nfs/dbraw/zinc/38/98/76/932389876.db2.gz IHAVVLAGXFBEEA-DNRSQYFGSA-N 2 0 407.602 4.123 20 0 HIADRP CN1CC[C@@H](NC(=O)NC2CC[NH+](CC3CCCC3)CC2)[C@H]1c1ccc(Cl)cc1 ZINC000535018416 932885593 /nfs/dbraw/zinc/88/55/93/932885593.db2.gz XXTKOFTYZFREAW-FGZHOGPDSA-N 2 0 419.013 4.039 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000535282500 933048352 /nfs/dbraw/zinc/04/83/52/933048352.db2.gz ZXQCCOGKFUOCNK-DEOSSOPVSA-N 2 0 421.585 4.115 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000537293764 933700957 /nfs/dbraw/zinc/70/09/57/933700957.db2.gz FPCSJLVJGBZQHY-JKSUJKDBSA-N 2 0 408.384 4.120 20 0 HIADRP Cc1ccc(NC(=O)C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000537843522 938388232 /nfs/dbraw/zinc/38/82/32/938388232.db2.gz TXOYDFSBOTYTJB-UHFFFAOYSA-N 2 0 400.954 4.220 20 0 HIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000537971129 938440746 /nfs/dbraw/zinc/44/07/46/938440746.db2.gz AJDPXBNRRBFOEF-DYQZNNLLSA-N 2 0 422.585 4.314 20 0 HIADRP Fc1ccccc1[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)C1CCCC1 ZINC000538101076 938502556 /nfs/dbraw/zinc/50/25/56/938502556.db2.gz OLVBMRZIFTZTGN-QHCPKHFHSA-N 2 0 411.569 4.039 20 0 HIADRP CCc1ccc([C@@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)C(C)C)cc1 ZINC000538101208 938502659 /nfs/dbraw/zinc/50/26/59/938502659.db2.gz NEIQNFMGMXRAIP-RPBOFIJWSA-N 2 0 407.602 4.433 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H](c2ccc(Br)cc2)C2CC2)ccn1 ZINC000538117801 938506658 /nfs/dbraw/zinc/50/66/58/938506658.db2.gz WTCANUUANMGQRF-FQEVSTJZSA-N 2 0 404.352 4.025 20 0 HIADRP Cc1nccn1-c1ccc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1F ZINC000538276748 938581692 /nfs/dbraw/zinc/58/16/92/938581692.db2.gz REWGNVUOQLLIIC-QFIPXVFZSA-N 2 0 420.532 4.398 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@@H]1CCOC3(CCSCC3)C1)c1ccccc1O2 ZINC000538294923 938585431 /nfs/dbraw/zinc/58/54/31/938585431.db2.gz VSYPKCFRLLWLSI-UYAOXDASSA-N 2 0 402.604 4.009 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@@H]1CCCN1Cc1ccccc1)c1ccccc1O2 ZINC000538295938 938585922 /nfs/dbraw/zinc/58/59/22/938585922.db2.gz NCFSCOZRZWKQLU-UPVQGACJSA-N 2 0 405.586 4.229 20 0 HIADRP COc1ccc(C[C@@H](C)C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1OC ZINC000538308464 938589256 /nfs/dbraw/zinc/58/92/56/938589256.db2.gz UYICYLIYDWSYEW-DENIHFKCSA-N 2 0 424.585 4.460 20 0 HIADRP Cc1cc(Br)cc2cc([C@H]([NH2+]C[C@H](C)N3CC[NH+](C)CC3)C(C)C)oc21 ZINC000538445436 938623189 /nfs/dbraw/zinc/62/31/89/938623189.db2.gz LKBXJKGBVLDQIT-OXJNMPFZSA-N 2 0 422.411 4.426 20 0 HIADRP C[C@H](Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000538528751 938642164 /nfs/dbraw/zinc/64/21/64/938642164.db2.gz ZAJSIKIOXUQBAE-NRFANRHFSA-N 2 0 422.617 4.332 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@@H](CC(C)C)C(=O)NCC[NH+](C)C ZINC000538547307 938646102 /nfs/dbraw/zinc/64/61/02/938646102.db2.gz YUCUAWGIHJHFSM-BEFAXECRSA-N 2 0 420.598 4.001 20 0 HIADRP C[C@H](Nc1ccc(N2CCC([NH+](C)C)CC2)cn1)c1ncc(Br)s1 ZINC000538591065 938657179 /nfs/dbraw/zinc/65/71/79/938657179.db2.gz XFCBNFMWGMTGRS-LBPRGKRZSA-N 2 0 410.385 4.004 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cccc(-c4cccnc4)c3)CC2)CC1 ZINC000538725088 938692539 /nfs/dbraw/zinc/69/25/39/938692539.db2.gz UMINFOMKFFZDCO-UHFFFAOYSA-N 2 0 406.618 4.377 20 0 HIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3ccccc3OCc3ccccn3)CC2)C[C@@H](C)O1 ZINC000538763618 938704701 /nfs/dbraw/zinc/70/47/01/938704701.db2.gz NDOMHDMXHNGBDI-FGZHOGPDSA-N 2 0 423.601 4.372 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(COC2CCOCC2)cc1 ZINC000539052483 938784312 /nfs/dbraw/zinc/78/43/12/938784312.db2.gz IRMPBBBOYYOKCZ-RLWLMLJZSA-N 2 0 408.586 4.382 20 0 HIADRP COc1ccc(Br)cc1C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000539064356 938790079 /nfs/dbraw/zinc/79/00/79/938790079.db2.gz JDOBJMZRXFQXEF-HNNXBMFYSA-N 2 0 407.352 4.249 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)cc1 ZINC000539071092 938792856 /nfs/dbraw/zinc/79/28/56/938792856.db2.gz NQDOFTNDNCBVQD-HSZRJFAPSA-N 2 0 411.977 4.333 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000539092486 938801693 /nfs/dbraw/zinc/80/16/93/938801693.db2.gz BYHGJRYMBDWPMR-CQSZACIVSA-N 2 0 401.473 4.155 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000539200204 938818525 /nfs/dbraw/zinc/81/85/25/938818525.db2.gz CDZPBNKVOVFRAD-FQEVSTJZSA-N 2 0 404.480 4.093 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(CN2CCO[C@H](C)C2)c1)c1nc2ccc(Cl)cc2n1C ZINC000539203816 938818854 /nfs/dbraw/zinc/81/88/54/938818854.db2.gz ZFRZOIWDMUOKEL-SJORKVTESA-N 2 0 412.965 4.298 20 0 HIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]CC(C)C[NH2+][C@@H](C)c2cccc(NC(C)=O)c2)c1 ZINC000539231588 938822689 /nfs/dbraw/zinc/82/26/89/938822689.db2.gz ZDQSRUFBVAXFMF-ROUUACIJSA-N 2 0 410.562 4.241 20 0 HIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000539263257 938829447 /nfs/dbraw/zinc/82/94/47/938829447.db2.gz VCEFFAWUKAILOJ-FQEVSTJZSA-N 2 0 409.574 4.037 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H](NC[C@H]1CC[N@H+](CCc3ccccc3)C1)c1ccccc1O2 ZINC000539378182 938851418 /nfs/dbraw/zinc/85/14/18/938851418.db2.gz YMSOTQGYYREXFN-NOZRDPDXSA-N 3 0 419.613 4.129 20 0 HIADRP CC[C@@H]([NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1ccc2c(c1)OCCO2 ZINC000539393255 938853860 /nfs/dbraw/zinc/85/38/60/938853860.db2.gz LJWNVOAIIKVVJW-RTWAWAEBSA-N 2 0 408.542 4.487 20 0 HIADRP COc1ccc(C)cc1C[NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000539502655 938869430 /nfs/dbraw/zinc/86/94/30/938869430.db2.gz KOHUWJJVVWBXPC-UHFFFAOYSA-N 2 0 407.480 4.064 20 0 HIADRP Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000539543980 938877163 /nfs/dbraw/zinc/87/71/63/938877163.db2.gz BDCVDPRVGXQBEL-UHFFFAOYSA-N 2 0 406.505 4.464 20 0 HIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](CCSc3ccnc4cc(Cl)ccc43)C2)CC1 ZINC000539808865 938938938 /nfs/dbraw/zinc/93/89/38/938938938.db2.gz FOLZWOVNMXQJMK-LJQANCHMSA-N 2 0 419.038 4.081 20 0 HIADRP c1ccc(C[NH+]2CCC[C@]3(CC[N@@H+](Cc4ccccc4N4CCOCC4)C3)C2)cc1 ZINC000539832423 938951389 /nfs/dbraw/zinc/95/13/89/938951389.db2.gz VGRYMKLIKXCZSG-SANMLTNESA-N 2 0 405.586 4.011 20 0 HIADRP Cc1ccc(-n2cc(C[N@H+]3CC[C@H](N4CC[NH+](C(C)C)CC4)C3)c(C(C)(C)C)n2)cc1 ZINC000539862940 938960373 /nfs/dbraw/zinc/96/03/73/938960373.db2.gz OKSLNKZNEXMWSB-DEOSSOPVSA-N 2 0 423.649 4.079 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)N3CCC[N@@H+](C4CCCC4)CC3)c2)CC1 ZINC000539871031 938962638 /nfs/dbraw/zinc/96/26/38/938962638.db2.gz BANGDUADEARBGA-UHFFFAOYSA-N 2 0 412.622 4.443 20 0 HIADRP CN(c1ccccc1C[N@H+](CCc1ccccc1)[C@H]1CCOC1)C1CC[NH+](C)CC1 ZINC000539911451 938976917 /nfs/dbraw/zinc/97/69/17/938976917.db2.gz OLHWVDQNDNQGSO-VWLOTQADSA-N 2 0 407.602 4.051 20 0 HIADRP CC[N@H+](CCC1CC[NH+](Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)CC1)CC1CC1 ZINC000539957902 938981251 /nfs/dbraw/zinc/98/12/51/938981251.db2.gz QRPJIVIVHAJPNS-UHFFFAOYSA-N 2 0 424.589 4.182 20 0 HIADRP COC(=O)c1cc2cc(C[N@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)ccc2o1 ZINC000540043987 939047327 /nfs/dbraw/zinc/04/73/27/939047327.db2.gz PBSYYSACSSXKGZ-UHFFFAOYSA-N 2 0 407.514 4.353 20 0 HIADRP Cc1cc2ncc([C@@H](C)[NH2+]Cc3ccccc3C[N@H+](C)Cc3ccco3)c(C)n2n1 ZINC000540085830 939064798 /nfs/dbraw/zinc/06/47/98/939064798.db2.gz SXKWUHNJHPFKCY-GOSISDBHSA-N 2 0 403.530 4.422 20 0 HIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CCN(C(=O)CCc3ccccc3)CC2)CC1 ZINC000540119228 939079871 /nfs/dbraw/zinc/07/98/71/939079871.db2.gz LZGOYNUPSLWUJR-OFVILXPXSA-N 2 0 411.634 4.243 20 0 HIADRP C[C@H]([NH2+]CCc1nc2ccccc2n1C(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000540188793 939113038 /nfs/dbraw/zinc/11/30/38/939113038.db2.gz VLOPJPLVKMNIEY-INIZCTEOSA-N 2 0 402.489 4.265 20 0 HIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]C3CCN(C(=O)CCc4ccccc4)CC3)CC2)C1 ZINC000540192309 939117084 /nfs/dbraw/zinc/11/70/84/939117084.db2.gz DHKVIPDLNBRQMU-OFVILXPXSA-N 2 0 411.634 4.243 20 0 HIADRP Cc1cc([C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C2CC2)ccc1F ZINC000540317658 939191675 /nfs/dbraw/zinc/19/16/75/939191675.db2.gz ADJYCXDKVXAYTB-DEOSSOPVSA-N 2 0 409.549 4.201 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1ccccc1C(F)(F)F)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000540442336 939251831 /nfs/dbraw/zinc/25/18/31/939251831.db2.gz RSDOUWOTJYGZCZ-LNLFQRSKSA-N 2 0 419.491 4.135 20 0 HIADRP Cc1ccc([C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C2CCCC2)o1 ZINC000540501908 939279134 /nfs/dbraw/zinc/27/91/34/939279134.db2.gz WSLDGJSATKOGMB-XMMPIXPASA-N 2 0 409.574 4.435 20 0 HIADRP C[C@@H](Nc1cccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000540790288 939373400 /nfs/dbraw/zinc/37/34/00/939373400.db2.gz YWVJBPSUPHYUAE-QHAWAJNXSA-N 2 0 411.590 4.409 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc(Br)ccc1F ZINC000540988144 939425641 /nfs/dbraw/zinc/42/56/41/939425641.db2.gz HEQCFPTXANSBEH-KSSFIOAISA-N 2 0 407.327 4.006 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)CC3 ZINC000540988041 939425884 /nfs/dbraw/zinc/42/58/84/939425884.db2.gz FPXXQTRCLQSPLT-FCHUYYIVSA-N 2 0 403.570 4.080 20 0 HIADRP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)CCCO2 ZINC000540989240 939426325 /nfs/dbraw/zinc/42/63/25/939426325.db2.gz OZLGOGKKDCIARW-SIKLNZKXSA-N 2 0 400.950 4.219 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccccc1OC(F)(F)F ZINC000540991045 939426742 /nfs/dbraw/zinc/42/67/42/939426742.db2.gz WZUVRKGDUYPSBL-VQIMIIECSA-N 2 0 408.464 4.393 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]C2CC(c3ccccc3F)C2)c1)C1CCOCC1 ZINC000541247317 939487490 /nfs/dbraw/zinc/48/74/90/939487490.db2.gz RBIONIQVHJEQFT-UHFFFAOYSA-N 2 0 412.549 4.351 20 0 HIADRP C[C@@H]1C[NH+](CCOc2ccc(CC[NH2+][C@@H]3CCC(=O)Nc4ccccc43)cc2)C[C@H]1C ZINC000541564475 939556055 /nfs/dbraw/zinc/55/60/55/939556055.db2.gz RFBZAEVDQAFTPX-YOSAUDMPSA-N 2 0 421.585 4.259 20 0 HIADRP C[C@H]1CCN(C(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000541572522 939558058 /nfs/dbraw/zinc/55/80/58/939558058.db2.gz PYPFSGHCHRVZAR-QHCPKHFHSA-N 2 0 419.613 4.412 20 0 HIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000541661260 939593580 /nfs/dbraw/zinc/59/35/80/939593580.db2.gz SXCKVNPKYLWZRY-IBGZPJMESA-N 2 0 405.542 4.304 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000541744097 939618857 /nfs/dbraw/zinc/61/88/57/939618857.db2.gz BONAREYISDIUOA-YMPZKCBVSA-N 2 0 406.636 4.324 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(F)c(F)c1 ZINC000541913421 939652157 /nfs/dbraw/zinc/65/21/57/939652157.db2.gz JWWPTSFQRMHVOD-NZQKXSOJSA-N 2 0 415.528 4.149 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(Br)c(F)c1 ZINC000541917408 939653718 /nfs/dbraw/zinc/65/37/18/939653718.db2.gz NAYBGZJTHWSGCX-KDOFPFPSSA-N 2 0 407.327 4.006 20 0 HIADRP FC(F)(F)c1ccc(N2CCC([NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)nc1 ZINC000541930043 939656778 /nfs/dbraw/zinc/65/67/78/939656778.db2.gz CUYBGWQYCNEQJR-UHFFFAOYSA-N 2 0 410.528 4.456 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000542477657 939829858 /nfs/dbraw/zinc/82/98/58/939829858.db2.gz ONHWXRARZDNNKO-UXHICEINSA-N 2 0 410.558 4.321 20 0 HIADRP CC(C)(CNC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CCc2ccccc2C1 ZINC000542503495 939833681 /nfs/dbraw/zinc/83/36/81/939833681.db2.gz XOPJLSTYDWJVMT-UHFFFAOYSA-N 2 0 419.613 4.242 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000542670426 939853044 /nfs/dbraw/zinc/85/30/44/939853044.db2.gz FVSCLNMZVPNFMR-YMPZKCBVSA-N 2 0 406.636 4.182 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc(Cl)ccc1OC(F)F ZINC000542850165 939863074 /nfs/dbraw/zinc/86/30/74/939863074.db2.gz UPOUJFNLGXDZNP-KBXCAEBGSA-N 2 0 410.892 4.359 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000543007672 939894641 /nfs/dbraw/zinc/89/46/41/939894641.db2.gz LMSAJFSSEBIAFF-UHFFFAOYSA-N 2 0 406.659 4.327 20 0 HIADRP COC(=O)COc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000543403959 940053763 /nfs/dbraw/zinc/05/37/63/940053763.db2.gz IINZOJLTGYBBGS-PMACEKPBSA-N 2 0 410.558 4.321 20 0 HIADRP Cc1ccc([C@H](CNC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)[NH+]2CCCC2)o1 ZINC000543431469 940062423 /nfs/dbraw/zinc/06/24/23/940062423.db2.gz JDRFXFOQALSOML-QFIPXVFZSA-N 2 0 409.574 4.143 20 0 HIADRP Brc1cnc(C[NH2+]CCCCC[NH+]2CCCCC2)c(Br)c1 ZINC000543446770 940066130 /nfs/dbraw/zinc/06/61/30/940066130.db2.gz QCLVIFYTUPIZPB-UHFFFAOYSA-N 2 0 419.205 4.352 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000543776863 940183420 /nfs/dbraw/zinc/18/34/20/940183420.db2.gz PGPXBLNFFGJUQQ-DEOSSOPVSA-N 2 0 408.492 4.411 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(F)cc1OC(F)F ZINC000543778049 940184022 /nfs/dbraw/zinc/18/40/22/940184022.db2.gz RUHNORGRXZOMTI-BEFAXECRSA-N 2 0 408.464 4.235 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+]([C@@H]2CCc3ccc(Cl)cc32)CC1 ZINC000544071107 940317550 /nfs/dbraw/zinc/31/75/50/940317550.db2.gz NLMLXOGBUMSBSQ-JOCHJYFZSA-N 2 0 403.998 4.032 20 0 HIADRP Fc1cc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)ccc1OCC(F)(F)F ZINC000544598649 940487742 /nfs/dbraw/zinc/48/77/42/940487742.db2.gz IRJZMPSKEMGEQV-UHFFFAOYSA-N 2 0 418.475 4.091 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(COC2CCOCC2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483858 941107844 /nfs/dbraw/zinc/10/78/44/941107844.db2.gz KNXUBLIFVWAQEL-OFVILXPXSA-N 2 0 408.586 4.382 20 0 HIADRP C[C@H]1CC[N@H+](CCOc2ccc(NC(=O)c3ccc(C[NH+]4CCCC4)cc3)cc2)C1 ZINC000549060400 941150536 /nfs/dbraw/zinc/15/05/36/941150536.db2.gz LOFTZRBBXHEULE-FQEVSTJZSA-N 2 0 407.558 4.255 20 0 HIADRP Cc1cc2ncn(C[C@H](O)C[NH2+]Cc3ccc(C[N@H+]4CCC[C@H](C)C4)cc3)c2cc1C ZINC000549192106 941170043 /nfs/dbraw/zinc/17/00/43/941170043.db2.gz SJGYWFIOLRQOHI-YADARESESA-N 2 0 420.601 4.036 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000549380449 941184283 /nfs/dbraw/zinc/18/42/83/941184283.db2.gz SWWMIJRZIMYCAW-MHZLTWQESA-N 2 0 417.597 4.411 20 0 HIADRP Cc1ccc(C[NH+]2CCC(CC[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c(-c2cnn(C)c2)c1 ZINC000549401649 941186425 /nfs/dbraw/zinc/18/64/25/941186425.db2.gz RMIOSQUBVDHWJN-NHCUHLMSSA-N 2 0 410.606 4.107 20 0 HIADRP C[C@@H](c1ccc(F)cc1)N1CC[C@@H]([N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)C1=O ZINC000549536971 941198560 /nfs/dbraw/zinc/19/85/60/941198560.db2.gz PSUOUPOHQCKOEP-YADARESESA-N 2 0 424.564 4.121 20 0 HIADRP C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000549582958 941200422 /nfs/dbraw/zinc/20/04/22/941200422.db2.gz MNOJTYQLVYINOK-OAQYLSRUSA-N 2 0 421.585 4.434 20 0 HIADRP COc1ccccc1/C=C\C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550263813 941305739 /nfs/dbraw/zinc/30/57/39/941305739.db2.gz XEHBADBXBJIASX-LZCXRCMXSA-N 2 0 406.570 4.227 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCc3sc(Br)cc32)CC1 ZINC000551063124 941402905 /nfs/dbraw/zinc/40/29/05/941402905.db2.gz KGJAZFLDHLJEJG-SFHVURJKSA-N 2 0 421.404 4.244 20 0 HIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551264487 941438918 /nfs/dbraw/zinc/43/89/18/941438918.db2.gz ZVFYMHYDLCRNKA-ZODMCCGTSA-N 2 0 408.586 4.281 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cc(F)ccc2N2CCOCC2)CC1 ZINC000551267891 941439984 /nfs/dbraw/zinc/43/99/84/941439984.db2.gz XANIWIASTHKBLB-UHFFFAOYSA-N 2 0 411.565 4.195 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000551273338 941440940 /nfs/dbraw/zinc/44/09/40/941440940.db2.gz VXSJCGKBJOFMJR-VRKOAZSQSA-N 2 0 423.576 4.378 20 0 HIADRP C[NH+]1CCCC[C@H]1CCSc1nnc(SCC[C@@H]2CCCC[N@H+]2C)s1 ZINC000551363147 941461567 /nfs/dbraw/zinc/46/15/67/941461567.db2.gz QKGVVGMHDVPIMN-HOTGVXAUSA-N 2 0 400.683 4.471 20 0 HIADRP CC[C@H](C(=O)N(C)C[C@@H]1CC[NH+](Cc2ccc(C)s2)C1)[N@H+](C)Cc1ccccc1 ZINC000552133761 941590974 /nfs/dbraw/zinc/59/09/74/941590974.db2.gz ROVZJDOPVNHAJW-JTHBVZDNSA-N 2 0 413.631 4.247 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)C[C@@H]1C ZINC000552168934 941596092 /nfs/dbraw/zinc/59/60/92/941596092.db2.gz WLFILLDRZGJXSG-NZQKXSOJSA-N 2 0 400.611 4.298 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]C4CCN(Cc5ccccn5)CC4)[C@H]3C2)cc1 ZINC000552255748 941615273 /nfs/dbraw/zinc/61/52/73/941615273.db2.gz STZSYRJJWZJCBC-YGPDHOBYSA-N 2 0 418.629 4.326 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1nc(-c2cccc(Cl)c2)no1 ZINC000552571907 941710298 /nfs/dbraw/zinc/71/02/98/941710298.db2.gz VOGPWOHTNBAAIQ-DYESRHJHSA-N 2 0 410.949 4.433 20 0 HIADRP O=C([C@H]1CCCC[N@@H+]1C1CCCC1)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000554151511 942051281 /nfs/dbraw/zinc/05/12/81/942051281.db2.gz FVNWATPHRAFCRJ-XMMPIXPASA-N 2 0 409.618 4.298 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(NC2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)c1 ZINC000554404459 942128623 /nfs/dbraw/zinc/12/86/23/942128623.db2.gz YTZHBVBZDYWNPV-XXBNENTESA-N 2 0 400.611 4.422 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1c(Cl)cccc1Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554537826 942165240 /nfs/dbraw/zinc/16/52/40/942165240.db2.gz QEKQCYMCAGZHRB-UHOSZYNNSA-N 2 0 423.384 4.233 20 0 HIADRP C[C@@H]([NH2+]C1CCN(C(=O)CCc2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554858694 942294123 /nfs/dbraw/zinc/29/41/23/942294123.db2.gz UOPQYXCOCPCHLW-RDGATRHJSA-N 2 0 419.613 4.110 20 0 HIADRP COc1cc(CN2C[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)ccc1OC(F)F ZINC000554962005 942335202 /nfs/dbraw/zinc/33/52/02/942335202.db2.gz YRACNISAUYBTQF-UXHICEINSA-N 2 0 402.485 4.251 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cscc3C(F)(F)F)CC2)CC1 ZINC000555093684 942383596 /nfs/dbraw/zinc/38/35/96/942383596.db2.gz YDOAKGVDSPYWNA-UHFFFAOYSA-N 2 0 403.558 4.395 20 0 HIADRP Fc1ccc(/C=C/C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c(F)c1 ZINC000555612621 942669538 /nfs/dbraw/zinc/66/95/38/942669538.db2.gz WLOMNVXEKIWVSQ-SNXGKTBFSA-N 2 0 412.524 4.496 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1F ZINC000556234188 942824418 /nfs/dbraw/zinc/82/44/18/942824418.db2.gz VMOGMJHNHNLPGY-KNQAVFIVSA-N 2 0 412.549 4.414 20 0 HIADRP C[NH+](C)[C@H]1CCN(c2ccc(NC3CCC([N@H+](C)Cc4ccccc4)CC3)nc2)C1 ZINC000556253016 942826994 /nfs/dbraw/zinc/82/69/94/942826994.db2.gz HQNQKIAZCNRMOS-IWAAJCSBSA-N 2 0 407.606 4.077 20 0 HIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000556608096 942912920 /nfs/dbraw/zinc/91/29/20/942912920.db2.gz KQSAMAHKOOASSV-ZJSXRUAMSA-N 3 0 407.602 4.302 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCNC(=O)NC[C@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000556637580 942923141 /nfs/dbraw/zinc/92/31/41/942923141.db2.gz ALNQIOHSBGRDCT-BLIXFSHQSA-N 2 0 424.992 4.036 20 0 HIADRP Cc1ccc(C[N@H+]2CC[C@@H](CN(C)C(=O)c3ccc(C[NH+]4CCCC4)cc3)C2)s1 ZINC000556827935 942936037 /nfs/dbraw/zinc/93/60/37/942936037.db2.gz ZGYRBBABKLAHRZ-NRFANRHFSA-N 2 0 411.615 4.246 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1ccc2ccccc2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000558482500 943571116 /nfs/dbraw/zinc/57/11/16/943571116.db2.gz DFLBOAAGCNZDRL-KSNOWIBYSA-N 2 0 404.554 4.080 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1ccc2ccccc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000558482497 943571197 /nfs/dbraw/zinc/57/11/97/943571197.db2.gz DFLBOAAGCNZDRL-AMDXRBSFSA-N 2 0 404.554 4.080 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N(C)C[C@H]2CC[N@H+](Cc3ccc(C)s3)C2)cc1 ZINC000560483594 944236501 /nfs/dbraw/zinc/23/65/01/944236501.db2.gz KWFCSZIOWKULGD-OAQYLSRUSA-N 2 0 413.631 4.492 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCCC2)cc1)N1CCN(c2cc[nH+]c3ccccc32)CC1 ZINC000560489484 944238336 /nfs/dbraw/zinc/23/83/36/944238336.db2.gz OABMVQBZCHZKRZ-UHFFFAOYSA-N 2 0 414.553 4.183 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cccc(OCC(F)(F)F)c3)cc2)CC1 ZINC000561288433 944540284 /nfs/dbraw/zinc/54/02/84/944540284.db2.gz LBUYUASFODXYLB-UHFFFAOYSA-N 2 0 408.464 4.391 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H](c2ccc(F)c(C)c2)C2CC2)CC1 ZINC000561371100 944565042 /nfs/dbraw/zinc/56/50/42/944565042.db2.gz FIJXVRZMOWTOLQ-SANMLTNESA-N 2 0 423.576 4.264 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1ccc(Cl)c(Br)c1 ZINC000564123215 945388904 /nfs/dbraw/zinc/38/89/04/945388904.db2.gz GRRUESXAINDPSH-UHFFFAOYSA-N 2 0 412.759 4.118 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)C1 ZINC000564506203 945634173 /nfs/dbraw/zinc/63/41/73/945634173.db2.gz QRSVTDYQUCOSIJ-JWQCQUIFSA-N 2 0 421.972 4.375 20 0 HIADRP CC(C)[N@@H+](C)C[C@@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000564590644 945691619 /nfs/dbraw/zinc/69/16/19/945691619.db2.gz NHYYIJZWJKGNFP-FJXZYEQHSA-N 2 0 421.029 4.282 20 0 HIADRP CSc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1F ZINC000566587403 946049534 /nfs/dbraw/zinc/04/95/34/946049534.db2.gz HKIDVBJRIFWYLE-OXQOHEQNSA-N 2 0 415.578 4.096 20 0 HIADRP Fc1ccc([C@H]2CC[NH+](CC3(C[N@H+]4CC[C@H](c5ccc(F)cc5)C4)COC3)C2)cc1 ZINC000566994371 946206121 /nfs/dbraw/zinc/20/61/21/946206121.db2.gz WUBOUBONGWWVTB-VXKWHMMOSA-N 2 0 412.524 4.260 20 0 HIADRP CCc1[nH+]c2ccccc2c(N2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)c1C ZINC000567072285 946232652 /nfs/dbraw/zinc/23/26/52/946232652.db2.gz RCFYWKOHIQPERZ-UHFFFAOYSA-N 2 0 410.606 4.026 20 0 HIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)CC2 ZINC000567273165 946286455 /nfs/dbraw/zinc/28/64/55/946286455.db2.gz ZFXNUYMMFINCOE-IBGZPJMESA-N 2 0 418.379 4.260 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000568017957 946444923 /nfs/dbraw/zinc/44/49/23/946444923.db2.gz YHPZPIFDFPEYNH-RBBKRZOGSA-N 2 0 408.590 4.289 20 0 HIADRP CN1CC[NH+](CC2CC[NH+](CC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)CC1 ZINC000568933434 946767054 /nfs/dbraw/zinc/76/70/54/946767054.db2.gz KWWLMVYAVHHDAX-UHFFFAOYSA-N 2 0 413.556 4.056 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1-c1noc([C@@]2(F)CC[N@@H+](C(C)(C)C)C2)n1 ZINC000569860697 947022662 /nfs/dbraw/zinc/02/26/62/947022662.db2.gz AMICQBSOTDTAPB-JOCHJYFZSA-N 2 0 404.530 4.126 20 0 HIADRP C[C@@H]1C[N@H+](CC(Cc2ccccc2)Cc2ccccc2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000570559603 947298453 /nfs/dbraw/zinc/29/84/53/947298453.db2.gz IZCYHWLTJZPRIA-KCWPFWIISA-N 2 0 405.630 4.046 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](c1sccc1Br)C1CCCCC1 ZINC000574386740 948429796 /nfs/dbraw/zinc/42/97/96/948429796.db2.gz HCWDCFXZJDKZMW-MAUKXSAKSA-N 2 0 414.457 4.358 20 0 HIADRP COc1cc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc(OC)c1OCC(F)F ZINC000574481685 948454605 /nfs/dbraw/zinc/45/46/05/948454605.db2.gz ULGLUBRCWBEMPV-DOTOQJQBSA-N 2 0 412.521 4.090 20 0 HIADRP C[N@@H+]1CC[C@@H]2[C@@H](CCCN2Cc2csc(-c3cccc(Br)c3)n2)C1 ZINC000574558974 948472555 /nfs/dbraw/zinc/47/25/55/948472555.db2.gz QFNQLYMKCAKHCL-MAUKXSAKSA-N 2 0 406.393 4.489 20 0 HIADRP COC[C@]1(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)OCCc2ccccc21 ZINC000574946470 948562595 /nfs/dbraw/zinc/56/25/95/948562595.db2.gz IFFQUFAOHJEPLD-RSMFLLDRSA-N 2 0 408.586 4.134 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000575058070 948582832 /nfs/dbraw/zinc/58/28/32/948582832.db2.gz WSUXLAQKUNCCSH-JOCHJYFZSA-N 2 0 416.407 4.156 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3C[C@@H]4c5ccccc5[C@H](OCC5CC5)[C@@H]4C3)c2)CC1 ZINC001164975182 722171556 /nfs/dbraw/zinc/17/15/56/722171556.db2.gz HUCCNYMLULUTOI-MZKUHISZSA-N 2 0 419.569 4.256 20 0 HIADRP CC[NH+]1CCN(c2ccc(NC(=O)C[NH2+][C@H](C)c3cccc4ccccc43)cc2)CC1 ZINC000007242991 845294252 /nfs/dbraw/zinc/29/42/52/845294252.db2.gz MUWASTWKHKDCOO-HXUWFJFHSA-N 2 0 416.569 4.271 20 0 HIADRP Brc1cc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc2c1OCO2 ZINC000015594472 846069310 /nfs/dbraw/zinc/06/93/10/846069310.db2.gz NJPLSMDNBUXMIS-UHFFFAOYSA-N 2 0 417.347 4.454 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000025507638 846989424 /nfs/dbraw/zinc/98/94/24/846989424.db2.gz OVCNJAJDWAHAER-JOCHJYFZSA-N 2 0 419.613 4.110 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CCC([NH+]3CCCCC3)CC2)C1 ZINC000045788416 848729072 /nfs/dbraw/zinc/72/90/72/848729072.db2.gz IOFVHGHDNVBXPX-NRFANRHFSA-N 2 0 412.622 4.078 20 0 HIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)c1 ZINC000046836867 848944402 /nfs/dbraw/zinc/94/44/02/848944402.db2.gz MZASRZLWBGVBRB-UHFFFAOYSA-N 2 0 411.553 4.345 20 0 HIADRP CC(C)[NH+]1CCC(NC(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)CC1 ZINC000047884432 849132412 /nfs/dbraw/zinc/13/24/12/849132412.db2.gz SJFGOPPVQXBMOS-UHFFFAOYSA-N 2 0 408.590 4.087 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 ZINC000048717132 849258576 /nfs/dbraw/zinc/25/85/76/849258576.db2.gz SUVYECLBUNUZNV-UHFFFAOYSA-N 2 0 418.463 4.121 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC[C@@H]2C)CC1 ZINC000056846068 850499618 /nfs/dbraw/zinc/49/96/18/850499618.db2.gz CSQHRLDXNNDGCK-NRFANRHFSA-N 2 0 414.638 4.323 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3cccc(OC(F)F)c3)CC2)c1 ZINC000060947009 851255089 /nfs/dbraw/zinc/25/50/89/851255089.db2.gz WPBLDKYDORCMFJ-UHFFFAOYSA-N 2 0 403.517 4.288 20 0 HIADRP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000437037892 862228278 /nfs/dbraw/zinc/22/82/78/862228278.db2.gz JWJCVYHERJWOJG-DNQXCXABSA-N 2 0 423.576 4.018 20 0 HIADRP Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000061308038 851343858 /nfs/dbraw/zinc/34/38/58/851343858.db2.gz KGGCAEMSYQUYCD-UHFFFAOYSA-N 2 0 409.599 4.392 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000061522766 851394586 /nfs/dbraw/zinc/39/45/86/851394586.db2.gz NHWDHTJCISXFKJ-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC000061855996 851461004 /nfs/dbraw/zinc/46/10/04/851461004.db2.gz MUAQXUPYMRZIJK-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)CC1 ZINC000061867434 851462809 /nfs/dbraw/zinc/46/28/09/851462809.db2.gz YDXBHKZEEIORQP-QFIPXVFZSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC[C@@H](c3ccsc3)[NH+](C)C)cc2)C1 ZINC000061868674 851464511 /nfs/dbraw/zinc/46/45/11/851464511.db2.gz XFSICNWKCDANDI-GCJKJVERSA-N 2 0 414.619 4.082 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCCCC2)cc1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000063393168 851675624 /nfs/dbraw/zinc/67/56/24/851675624.db2.gz ANHISFQREWKNLB-UHFFFAOYSA-N 2 0 412.622 4.491 20 0 HIADRP CC(C)(C)c1ncc(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)s1 ZINC000063521987 851707460 /nfs/dbraw/zinc/70/74/60/851707460.db2.gz SBMTWQMUVHTZKE-UHFFFAOYSA-N 2 0 400.636 4.128 20 0 HIADRP C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000065936496 852325155 /nfs/dbraw/zinc/32/51/55/852325155.db2.gz FYLHQECMQLUJQH-UHFFFAOYSA-N 2 0 413.993 4.142 20 0 HIADRP CCc1ccc([C@@H](CNC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)[NH+](C)C)cc1 ZINC000071913250 852429579 /nfs/dbraw/zinc/42/95/79/852429579.db2.gz MDOHLVQVPSJNLV-NHCUHLMSSA-N 2 0 414.619 4.050 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NCC2([NH+]3CCSCC3)CCCC2)cc1)C(C)C ZINC000110120818 853062451 /nfs/dbraw/zinc/06/24/51/853062451.db2.gz JKSCEFFOJBYQBZ-UHFFFAOYSA-N 2 0 403.636 4.008 20 0 HIADRP C[C@@H](CNC(=O)[C@@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000110913338 853167438 /nfs/dbraw/zinc/16/74/38/853167438.db2.gz JNHJJGBENUSWFD-FCHUYYIVSA-N 2 0 407.602 4.139 20 0 HIADRP O=C(Nc1cccc(C[NH+]2CCSCC2)c1)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000138625721 853392877 /nfs/dbraw/zinc/39/28/77/853392877.db2.gz BALYCSYTUXNALU-UHFFFAOYSA-N 2 0 409.599 4.474 20 0 HIADRP O=C(NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000140064473 853431900 /nfs/dbraw/zinc/43/19/00/853431900.db2.gz CXVYQQLPXBKRQH-NRFANRHFSA-N 2 0 411.615 4.376 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc(C(=O)N[C@H](C)CC)c2)CC1 ZINC000236802989 853924840 /nfs/dbraw/zinc/92/48/40/853924840.db2.gz QEZXFRGEQMUZCR-OAQYLSRUSA-N 2 0 422.617 4.037 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)CC1 ZINC000236838321 853927627 /nfs/dbraw/zinc/92/76/27/853927627.db2.gz IWDDOLRBBZJQCU-UHFFFAOYSA-N 2 0 423.630 4.108 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1 ZINC000236943360 853940476 /nfs/dbraw/zinc/94/04/76/853940476.db2.gz YXZGKEHOOYAJAX-UHFFFAOYSA-N 2 0 418.029 4.076 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2ccc(-c3cccc(Br)c3)s2)CC1 ZINC000236977554 853945431 /nfs/dbraw/zinc/94/54/31/853945431.db2.gz FSSGKGIXJFDLIZ-MRXNPFEDSA-N 2 0 422.436 4.293 20 0 HIADRP CCOc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)cc1OC ZINC000237014185 853951534 /nfs/dbraw/zinc/95/15/34/853951534.db2.gz YAMHGYMAVQHBKY-GOSISDBHSA-N 2 0 415.553 4.226 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+]Cc2ccc(-c3ccc(Br)cc3)s2)CC1 ZINC000237172561 853975581 /nfs/dbraw/zinc/97/55/81/853975581.db2.gz LSEFDSJBHXXSGC-UHFFFAOYSA-N 2 0 422.436 4.295 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1OC(C)C ZINC000237216349 853984316 /nfs/dbraw/zinc/98/43/16/853984316.db2.gz ZKWOQCNSRJIMIY-BGYRXZFFSA-N 2 0 412.574 4.381 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2cc(Cl)ccc2OCc2cccnc2)C[C@@H](C)O1 ZINC000237403167 854024450 /nfs/dbraw/zinc/02/44/50/854024450.db2.gz PYXPRRAZTSFRTN-RTBURBONSA-N 2 0 417.981 4.293 20 0 HIADRP Cc1nn(Cc2ccccc2Cl)c(C)c1C[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000237403664 854024743 /nfs/dbraw/zinc/02/47/43/854024743.db2.gz RIQJEJSIQGHOFK-QZTJIDSGSA-N 2 0 419.013 4.181 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(Cl)c1OC ZINC000237441112 854033977 /nfs/dbraw/zinc/03/39/77/854033977.db2.gz UZTGHOONSDUUBM-CALCHBBNSA-N 2 0 418.965 4.256 20 0 HIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]CCCC[N@@H+]1CCC[C@@H]1CO ZINC000237708822 854079924 /nfs/dbraw/zinc/07/99/24/854079924.db2.gz OYUQGJFCGOCBOB-XMMPIXPASA-N 2 0 418.585 4.174 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(OC[C@@H]3CCCO3)cc2)C[C@H](C)O1 ZINC000237777993 854095661 /nfs/dbraw/zinc/09/56/61/854095661.db2.gz WLTDNLNDXIFNIK-UZINWLIJSA-N 2 0 424.585 4.143 20 0 HIADRP O=c1[nH]c2ccccc2cc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000238163529 854149764 /nfs/dbraw/zinc/14/97/64/854149764.db2.gz XTJKCSHMYRYPAQ-UHFFFAOYSA-N 2 0 405.542 4.101 20 0 HIADRP CCc1cc(NCc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c2ccccc2[nH+]1 ZINC000301769082 854462275 /nfs/dbraw/zinc/46/22/75/854462275.db2.gz CSJREKFGJHTNBG-FQEVSTJZSA-N 2 0 402.542 4.107 20 0 HIADRP Cc1[nH+]c2ccccc2c(NCc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c1C ZINC000302084255 854528770 /nfs/dbraw/zinc/52/87/70/854528770.db2.gz MTJKHYIUHWHZAC-OAQYLSRUSA-N 2 0 402.542 4.161 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NC[C@@H](c1cccc(OC)c1)[NH+]1CCCC1)c1ccccc1 ZINC000303306579 854863279 /nfs/dbraw/zinc/86/32/79/854863279.db2.gz ZVNQNCDUNPJWOL-BJKOFHAPSA-N 2 0 409.574 4.031 20 0 HIADRP CC(C)[NH+]1CCN(c2ccc(C(=O)NCC(C)(C)[NH2+][C@@H](C)c3ccccc3)cc2)CC1 ZINC000303432533 854933718 /nfs/dbraw/zinc/93/37/18/854933718.db2.gz XEQFEDLWBIIGBJ-NRFANRHFSA-N 2 0 422.617 4.076 20 0 HIADRP O=C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000303520424 855007648 /nfs/dbraw/zinc/00/76/48/855007648.db2.gz UZZNPCHUMDETFF-QYIJMHBESA-N 2 0 417.597 4.210 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)N(C)Cc2nc3ccccc3s2)CC1 ZINC000303564511 855043252 /nfs/dbraw/zinc/04/32/52/855043252.db2.gz LTSRRKWKBLNHSD-GOSISDBHSA-N 2 0 416.635 4.087 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCC[NH+]2Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303767634 855185429 /nfs/dbraw/zinc/18/54/29/855185429.db2.gz QBLJLAMIMFVEIG-IEZKXTBUSA-N 2 0 405.586 4.163 20 0 HIADRP COc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc(Br)c1O ZINC000388633296 855447989 /nfs/dbraw/zinc/44/79/89/855447989.db2.gz ILIXMUBFQZOFQF-YJBOKZPZSA-N 2 0 419.363 4.164 20 0 HIADRP CC(C)(C)OC(=O)NC[C@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390538411 855454814 /nfs/dbraw/zinc/45/48/14/855454814.db2.gz GSMGSDRYZSSJHZ-IMCXTFKOSA-N 2 0 413.606 4.465 20 0 HIADRP CC(C)(C)OC(=O)N1CCC(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000390571058 855456302 /nfs/dbraw/zinc/45/63/02/855456302.db2.gz OMUVDXVQEVQSQQ-NOTZXAQLSA-N 2 0 413.606 4.419 20 0 HIADRP C[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccccc1Br ZINC000397551061 855472894 /nfs/dbraw/zinc/47/28/94/855472894.db2.gz UJDDHJBXOOJCKC-KRWDZBQOSA-N 2 0 403.364 4.127 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000410306150 855918796 /nfs/dbraw/zinc/91/87/96/855918796.db2.gz MAPXRXKOIAYLHK-UHFFFAOYSA-N 2 0 422.617 4.035 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000410314681 855923612 /nfs/dbraw/zinc/92/36/12/855923612.db2.gz NOUOXCXJEAWILB-UHFFFAOYSA-N 2 0 422.617 4.301 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NC[C@H](c3ccccc3)[NH+](C)C)cc2)CC1 ZINC000410340405 855937350 /nfs/dbraw/zinc/93/73/50/855937350.db2.gz YSCXKMBHAFBBRO-XMMPIXPASA-N 2 0 408.590 4.021 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)Nc3cccc(OCC[NH+](C)C)c3)cc2)CC1 ZINC000410344516 855939468 /nfs/dbraw/zinc/93/94/68/855939468.db2.gz LGGOWXVUSJRPQS-UHFFFAOYSA-N 2 0 424.589 4.181 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000410372489 855958039 /nfs/dbraw/zinc/95/80/39/855958039.db2.gz NRJDEZPREKSPMQ-XMMPIXPASA-N 2 0 408.590 4.163 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C[C@@H](C)O1 ZINC000425960571 856018092 /nfs/dbraw/zinc/01/80/92/856018092.db2.gz XVCPTKCGMICMCD-PWHSHALESA-N 2 0 401.982 4.498 20 0 HIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3cc(-c4ccc(F)cc4)no3)CC2)C[C@H](C)O1 ZINC000426778072 856473151 /nfs/dbraw/zinc/47/31/51/856473151.db2.gz UEJVRDDBBAHGEB-ROUUACIJSA-N 2 0 401.526 4.192 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CCCc4ncc(C(F)(F)F)cc43)cc2)CC1 ZINC000427582967 856877952 /nfs/dbraw/zinc/87/79/52/856877952.db2.gz KMMCOWPXXHMPGP-OAQYLSRUSA-N 2 0 418.507 4.015 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CC[C@H](C)[NH+](Cc3ccccc3)CC2)cc1)C1CC1 ZINC000437503723 862856860 /nfs/dbraw/zinc/85/68/60/862856860.db2.gz YKQDNXQOVLDFKG-NRFANRHFSA-N 2 0 405.586 4.408 20 0 HIADRP FC(F)(F)CN1CC[C@H](C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000428216374 857115367 /nfs/dbraw/zinc/11/53/67/857115367.db2.gz FKXXOTDFUKPQNJ-YUMYIRISSA-N 2 0 409.540 4.151 20 0 HIADRP O=C(c1ccoc1)N1CCC([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000428224649 857118115 /nfs/dbraw/zinc/11/81/15/857118115.db2.gz XLCYXKHKXKNEEQ-NQHRYMMQSA-N 2 0 421.585 4.165 20 0 HIADRP CN(C)C(=O)c1cccc(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000428229579 857120257 /nfs/dbraw/zinc/12/02/57/857120257.db2.gz OZGIDQPMDQTTNR-KKUQBAQOSA-N 2 0 419.613 4.211 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000428312804 857148805 /nfs/dbraw/zinc/14/88/05/857148805.db2.gz XCSSMNGKMWOKEF-SQJMNOBHSA-N 2 0 422.617 4.381 20 0 HIADRP O=C(NC[C@@H]1CCC[N@@H+]1C1CCCCC1)NCC1CC[NH+](Cc2cccs2)CC1 ZINC000437653760 862990957 /nfs/dbraw/zinc/99/09/57/862990957.db2.gz UFQJTOGQVHTWDS-NRFANRHFSA-N 2 0 418.651 4.056 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000430642076 858244164 /nfs/dbraw/zinc/24/41/64/858244164.db2.gz UPZXOBRNGVKJCA-ICSRJNTNSA-N 2 0 405.542 4.277 20 0 HIADRP Cc1ccc(OCCC[N@@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)cc1C ZINC000430932553 858374777 /nfs/dbraw/zinc/37/47/77/858374777.db2.gz ZLKRJGYJIXAWGP-UHFFFAOYSA-N 2 0 401.639 4.200 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000431316315 858560387 /nfs/dbraw/zinc/56/03/87/858560387.db2.gz CIKHQUSLXCFKBJ-QFZRFWILSA-N 2 0 423.576 4.207 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000431623181 858696237 /nfs/dbraw/zinc/69/62/37/858696237.db2.gz RYWOFDYNKBYCMQ-ZJSXRUAMSA-N 2 0 414.638 4.097 20 0 HIADRP Cc1cccc(CN(CC[NH+](C)C)C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000431673773 858729799 /nfs/dbraw/zinc/72/97/99/858729799.db2.gz POKCJQMLMORXMO-DHLKQENFSA-N 2 0 422.617 4.121 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000431696605 858744728 /nfs/dbraw/zinc/74/47/28/858744728.db2.gz MAQAITJTIZKGSM-BWKNWUBXSA-N 2 0 420.601 4.135 20 0 HIADRP C[NH+]1CCC(C[NH2+]C2CC(c3cccc(Br)c3)C2)(N2CCCCC2)CC1 ZINC000432423002 859157842 /nfs/dbraw/zinc/15/78/42/859157842.db2.gz HYRDCUCWVLDAQY-UHFFFAOYSA-N 2 0 420.439 4.235 20 0 HIADRP COc1cc(C[NH+](C)C2CCC(OC)CC2)cc(C[N@@H+](C)C2CCC(OC)CC2)c1 ZINC000432835836 859380169 /nfs/dbraw/zinc/38/01/69/859380169.db2.gz QQLSWLWHZRCFNP-UHFFFAOYSA-N 2 0 418.622 4.474 20 0 HIADRP C[C@@H](c1nc(-c2cccnc2)no1)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433074856 859510830 /nfs/dbraw/zinc/51/08/30/859510830.db2.gz JEKWBGLQEPKJLX-IBGZPJMESA-N 2 0 403.530 4.181 20 0 HIADRP Fc1ccc(-c2noc(CN3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)n2)cc1 ZINC000433186730 859558869 /nfs/dbraw/zinc/55/88/69/859558869.db2.gz GGPFJUAZJSNGGT-UHFFFAOYSA-N 2 0 406.505 4.364 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)[C@@H]2CCCC[NH+]2C2CCCC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000433368631 859660180 /nfs/dbraw/zinc/66/01/80/859660180.db2.gz UOEBDDXJKMSGDH-WTNAPCKOSA-N 2 0 421.988 4.385 20 0 HIADRP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCC(F)(c2ccccc2)CC1 ZINC000434494163 860371935 /nfs/dbraw/zinc/37/19/35/860371935.db2.gz NQYCBYCYIJNFCT-NRFANRHFSA-N 2 0 423.576 4.117 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000437794748 863112113 /nfs/dbraw/zinc/11/21/13/863112113.db2.gz FHSAZZKDCOVGFH-LJQANCHMSA-N 2 0 408.546 4.466 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000437794744 863112960 /nfs/dbraw/zinc/11/29/60/863112960.db2.gz FHSAZZKDCOVGFH-IBGZPJMESA-N 2 0 408.546 4.466 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(Cl)c1OC(C)C ZINC000438495460 863915414 /nfs/dbraw/zinc/91/54/14/863915414.db2.gz VXWCTJPMEDVLTF-KRWDZBQOSA-N 2 0 410.990 4.007 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N1CCCc2ccccc21 ZINC000439593939 864915712 /nfs/dbraw/zinc/91/57/12/864915712.db2.gz HKTAIXQKPQBPIU-FQEVSTJZSA-N 2 0 417.553 4.369 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)Nc1ccc(Cl)cn1 ZINC000439599589 864922689 /nfs/dbraw/zinc/92/26/89/864922689.db2.gz SZZJLGKIJDDPPP-MRXNPFEDSA-N 2 0 412.921 4.077 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N(C)Cc1cccc(F)c1 ZINC000439599694 864922987 /nfs/dbraw/zinc/92/29/87/864922987.db2.gz WUSVBOMVLVUQAC-IBGZPJMESA-N 2 0 423.532 4.187 20 0 HIADRP Cc1ccccc1CNC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000439600966 864923324 /nfs/dbraw/zinc/92/33/24/864923324.db2.gz YPEQVTPVZPETQP-HXUWFJFHSA-N 2 0 405.542 4.015 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC[NH+]([C@H](C)c3ccncc3)CC2)cc1)C1CC1 ZINC000439739419 865070576 /nfs/dbraw/zinc/07/05/76/865070576.db2.gz MUTUHSCVTLQCPO-LJQANCHMSA-N 2 0 406.574 4.021 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1)c1ccccc1 ZINC000440183459 865409111 /nfs/dbraw/zinc/40/91/11/865409111.db2.gz GGKGDYOSYSAUNC-UXHICEINSA-N 2 0 423.605 4.036 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC1CC[NH+]([C@H](C)c2ccncc2)CC1)c1ccccc1 ZINC000440183461 865409152 /nfs/dbraw/zinc/40/91/52/865409152.db2.gz GGKGDYOSYSAUNC-WOJBJXKFSA-N 2 0 423.605 4.036 20 0 HIADRP Cc1ccc(NC2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)cc1NC(=O)CC[NH+](C)C ZINC000468044926 881872577 /nfs/dbraw/zinc/87/25/77/881872577.db2.gz NUERZSAMWMJSPC-XXBNENTESA-N 2 0 400.611 4.340 20 0 HIADRP CSc1ccccc1[C@H](C)[NH2+][C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000440615823 865840862 /nfs/dbraw/zinc/84/08/62/865840862.db2.gz CPBVJKUJHYSSFX-RBUKOAKNSA-N 2 0 411.615 4.228 20 0 HIADRP CC(C)[NH+]1CCC(N2CC[NH+](CC/C=C/c3ccc(Br)cc3)CC2)CC1 ZINC000441057572 866134270 /nfs/dbraw/zinc/13/42/70/866134270.db2.gz QUPFFIDOIZIQBV-HWKANZROSA-N 2 0 420.439 4.343 20 0 HIADRP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CC[C@@H](C)[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000441273070 866347933 /nfs/dbraw/zinc/34/79/33/866347933.db2.gz WEBHVOOTVIQANF-IIBYNOLFSA-N 2 0 411.512 4.077 20 0 HIADRP c1cc(C[N@@H+]2CCC[C@H]([C@H]3CCOC3)C2)ccc1C[NH+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441274687 866348819 /nfs/dbraw/zinc/34/88/19/866348819.db2.gz HBHMWEYOVAACHI-ASDGIDEWSA-N 2 0 412.618 4.184 20 0 HIADRP Cc1ccccc1[C@H](OC[C@H](O)C[N@H+](C)CC[C@H]1CCCC[NH+]1C)c1ccccc1 ZINC000441364257 866432111 /nfs/dbraw/zinc/43/21/11/866432111.db2.gz ZACFCDUQCDNCID-DGWZTRNLSA-N 2 0 410.602 4.268 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2Cc3[nH]c4ccccc4c3C2)cc1OC ZINC000442711975 867642512 /nfs/dbraw/zinc/64/25/12/867642512.db2.gz FUUURONKRBBZJB-IBGZPJMESA-N 2 0 407.558 4.154 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[C@@H](c4ccc(C(F)(F)F)cc4)C3)cn2)CC1 ZINC000442713415 867642913 /nfs/dbraw/zinc/64/29/13/867642913.db2.gz WPEXANNTOVDWRN-TZIWHRDSSA-N 2 0 418.507 4.278 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[C@H](c4ccc(C(F)(F)F)cc4)C3)cn2)CC1 ZINC000442713411 867643046 /nfs/dbraw/zinc/64/30/46/867643046.db2.gz WPEXANNTOVDWRN-FPOVZHCZSA-N 2 0 418.507 4.278 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H]3CC[C@@H](c4ccc(C(F)(F)F)cc4)C3)ccn2)CC1 ZINC000442722701 867648519 /nfs/dbraw/zinc/64/85/19/867648519.db2.gz VZODQMHGDLUXFM-TZIWHRDSSA-N 2 0 418.507 4.278 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@@H]3Cc4[nH]c5ccccc5c4C3)CC2)c1 ZINC000442722706 867648597 /nfs/dbraw/zinc/64/85/97/867648597.db2.gz WALYOJKEFBLAAR-NRFANRHFSA-N 2 0 402.586 4.136 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H]3CC[C@H](c4ccc(C(F)(F)F)cc4)C3)ccn2)CC1 ZINC000442722697 867648761 /nfs/dbraw/zinc/64/87/61/867648761.db2.gz VZODQMHGDLUXFM-FPOVZHCZSA-N 2 0 418.507 4.278 20 0 HIADRP C[C@@H](c1nc(-c2ccc(N3CCC[N@H+](C)CC3)c(Cl)c2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000443199365 867871272 /nfs/dbraw/zinc/87/12/72/867871272.db2.gz DHVXCVCHGNLUKW-ZACQAIPSSA-N 2 0 417.985 4.466 20 0 HIADRP CC[NH+](CC)CCOc1ccc(-c2noc([C@H](C)[NH+]3[C@H](C)CC[C@H]3C)n2)cc1OC ZINC000443201177 867872856 /nfs/dbraw/zinc/87/28/56/867872856.db2.gz HQPNVTDTVXQHHM-KURKYZTESA-N 2 0 416.566 4.400 20 0 HIADRP C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443596926 868151022 /nfs/dbraw/zinc/15/10/22/868151022.db2.gz BYOWZHWAXJQTLD-GOSISDBHSA-N 2 0 407.549 4.072 20 0 HIADRP C[C@H](Cc1ccc(F)cc1)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000468381708 882325159 /nfs/dbraw/zinc/32/51/59/882325159.db2.gz IOVCHZDGCZROOE-LJQANCHMSA-N 2 0 400.538 4.036 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cncn2Cc2ccccc2)CC1 ZINC000445806826 869833088 /nfs/dbraw/zinc/83/30/88/869833088.db2.gz BHYMQAAMIGXURW-HXUWFJFHSA-N 2 0 421.564 4.063 20 0 HIADRP O=C(C[NH2+][C@@H]1CCC[C@H]1c1ccccc1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000445987015 869951321 /nfs/dbraw/zinc/95/13/21/869951321.db2.gz AIQOVFVSMBGHAR-XZOQPEGZSA-N 2 0 409.599 4.100 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)Nc1ccccc1CC[NH+](C)C ZINC000446577617 870487688 /nfs/dbraw/zinc/48/76/88/870487688.db2.gz WIKOJJRQXSSLAU-HXUWFJFHSA-N 2 0 408.590 4.487 20 0 HIADRP COc1ccc([C@@H](CNC(=O)Nc2ccccc2CC[NH+](C)C)[NH+]2CCCCC2)cc1 ZINC000446577070 870488224 /nfs/dbraw/zinc/48/82/24/870488224.db2.gz JTNJTYIMZWJSFD-XMMPIXPASA-N 2 0 424.589 4.148 20 0 HIADRP COc1ccccc1[C@H](CNC(=O)Nc1ccccc1CC[NH+](C)C)[NH+]1CCCCC1 ZINC000446589549 870498170 /nfs/dbraw/zinc/49/81/70/870498170.db2.gz KXZIRVSTYWKXPB-QHCPKHFHSA-N 2 0 424.589 4.148 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000446756275 870668328 /nfs/dbraw/zinc/66/83/28/870668328.db2.gz GKHDNOGEHIKTKU-IFXJQAMLSA-N 2 0 414.819 4.169 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)CCCS2 ZINC000446935520 870845249 /nfs/dbraw/zinc/84/52/49/870845249.db2.gz FWNIBFZABLQNHZ-QHCPKHFHSA-N 2 0 412.599 4.369 20 0 HIADRP COc1ccc(C)cc1NC(=O)[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000447032579 870906734 /nfs/dbraw/zinc/90/67/34/870906734.db2.gz ZEUGFDSBMQBHEA-DEOSSOPVSA-N 2 0 407.558 4.147 20 0 HIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)c2ccccc21 ZINC000447584906 871488662 /nfs/dbraw/zinc/48/86/62/871488662.db2.gz HJQRLUYACKZKNI-LOSJGSFVSA-N 2 0 405.586 4.486 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)N3CC[C@@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)c2)CC1 ZINC000448208189 872103287 /nfs/dbraw/zinc/10/32/87/872103287.db2.gz FQGIEXUQWKKFHO-UKILVPOCSA-N 2 0 424.633 4.077 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCCCC2)cc1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000448409302 872361584 /nfs/dbraw/zinc/36/15/84/872361584.db2.gz FECUIFLFWAVQLX-QPPBQGQZSA-N 2 0 410.606 4.196 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(C)[C@H]1CC[N@H+](CC)C[C@@H]1C)c1ccccc1Cl ZINC000448462324 872422587 /nfs/dbraw/zinc/42/25/87/872422587.db2.gz SGYGCGMOEQBDGW-YYWHXJBOSA-N 2 0 409.018 4.095 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@H](C)C3)cc2)[C@H](C)C1 ZINC000448462624 872426796 /nfs/dbraw/zinc/42/67/96/872426796.db2.gz VPJOABIXFURGEH-WHLIWEHUSA-N 2 0 414.638 4.036 20 0 HIADRP CC[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccc(Cl)c1F ZINC000461105527 874026089 /nfs/dbraw/zinc/02/60/89/874026089.db2.gz XQXMVHNJFGBHSP-RXVVDRJESA-N 2 0 417.956 4.417 20 0 HIADRP Cc1ccc(N[C@@H]2C[C@H](C)C[N@@H+](Cc3ccccc3)C2)cc1NC(=O)CC[NH+](C)C ZINC000468686294 882811427 /nfs/dbraw/zinc/81/14/27/882811427.db2.gz UUJTXZILAQEQJT-WMZHIEFXSA-N 2 0 408.590 4.208 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)N1C[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000461435173 874486251 /nfs/dbraw/zinc/48/62/51/874486251.db2.gz VXRQFFVTEMANDU-NHCUHLMSSA-N 2 0 417.553 4.089 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000462012364 875130789 /nfs/dbraw/zinc/13/07/89/875130789.db2.gz UJBNTHIGVVLWBW-UHFFFAOYSA-N 2 0 419.569 4.275 20 0 HIADRP c1ccc(CC[N@@H+]2CC[C@@H](CNC3C[C@H]4CC[C@@H](C3)[NH+]4Cc3ccccc3)C2)cc1 ZINC000463291189 876350403 /nfs/dbraw/zinc/35/04/03/876350403.db2.gz MKTHMPWFBCPJTC-ULORGUQGSA-N 2 0 403.614 4.336 20 0 HIADRP Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)c(-n2cc(Cl)cn2)n1 ZINC000468994326 883060461 /nfs/dbraw/zinc/06/04/61/883060461.db2.gz QQHCJPLRCFBBSH-AKIFATBCSA-N 2 0 421.976 4.229 20 0 HIADRP C[N@H+](C[C@@H](O)COc1cccc2ccccc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464843172 878115887 /nfs/dbraw/zinc/11/58/87/878115887.db2.gz QWVSMVVRDPIBSS-LADGPHEKSA-N 2 0 404.554 4.033 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)[NH+]2CCCC2)o1 ZINC000503342920 912319575 /nfs/dbraw/zinc/31/95/75/912319575.db2.gz LILROMNKICBWCQ-YADHBBJMSA-N 2 0 416.610 4.023 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNC(=O)N(C)CC[C@H]2CCCC[NH+]2C)C1 ZINC000465540516 879002386 /nfs/dbraw/zinc/00/23/86/879002386.db2.gz LLJQDRMXEFCOHR-ZFGGDYGUSA-N 2 0 414.638 4.180 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N(C)CC[C@H]1CCCC[NH+]1C ZINC000465571751 879046513 /nfs/dbraw/zinc/04/65/13/879046513.db2.gz OCUIPHMGPJWNMS-NFBKMPQASA-N 2 0 400.611 4.077 20 0 HIADRP CC[NH+]1CCC(CCNC(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)CC1 ZINC000465585010 879064575 /nfs/dbraw/zinc/06/45/75/879064575.db2.gz JYIJYBOCKFRBDP-UHFFFAOYSA-N 2 0 422.617 4.336 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@H]2CCC[NH+](C)[C@@H]2c2cccs2)c1 ZINC000465818515 879444095 /nfs/dbraw/zinc/44/40/95/879444095.db2.gz UJENEOBKUQHAFH-IRLDBZIGSA-N 2 0 414.619 4.082 20 0 HIADRP CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)NC[C@H]1CCC[NH+](C)[C@H]1c1cccs1 ZINC000465871810 879523858 /nfs/dbraw/zinc/52/38/58/879523858.db2.gz JHYWUTFUWASBOB-SFHLNBCPSA-N 2 0 406.640 4.085 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC000503451634 912473210 /nfs/dbraw/zinc/47/32/10/912473210.db2.gz KZPSMEQBDWXQNG-DEOSSOPVSA-N 2 0 414.638 4.326 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(C)c(NC(=O)CC[NH+](C)C)c2)cc1)C(C)C ZINC000466244235 879956750 /nfs/dbraw/zinc/95/67/50/879956750.db2.gz HHYFSMMWOYMNFK-UHFFFAOYSA-N 2 0 424.589 4.368 20 0 HIADRP Cc1ccc(NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)cc1NC(=O)CC[NH+](C)C ZINC000466276896 880015092 /nfs/dbraw/zinc/01/50/92/880015092.db2.gz KOESXQCIKBRKQM-UHFFFAOYSA-N 2 0 422.573 4.123 20 0 HIADRP O=C(Nc1ccccc1)c1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000466935578 880704340 /nfs/dbraw/zinc/70/43/40/880704340.db2.gz KKLXCZUXADFIGY-UHFFFAOYSA-N 2 0 407.558 4.016 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccnn3-c3ccccc3)CC2)cc1 ZINC000467331894 881080495 /nfs/dbraw/zinc/08/04/95/881080495.db2.gz DZAWMLLUQFZHFZ-HXUWFJFHSA-N 2 0 404.558 4.444 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CCS2 ZINC000467422238 881210352 /nfs/dbraw/zinc/21/03/52/881210352.db2.gz ZJOVUSCPFSVAAN-KKSFZXQISA-N 2 0 415.578 4.474 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2cnn(C(C)C)c2C)CC1 ZINC000469240265 883338767 /nfs/dbraw/zinc/33/87/67/883338767.db2.gz PTQIYXKLGWMHOT-MSOLQXFVSA-N 2 0 401.574 4.465 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)[C@@H]1c1cccs1 ZINC000469732962 883891290 /nfs/dbraw/zinc/89/12/90/883891290.db2.gz FXKWKFZFKWWGRA-PGRDOPGGSA-N 2 0 406.555 4.122 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000469742110 883897376 /nfs/dbraw/zinc/89/73/76/883897376.db2.gz NNLPTEGQQNUBJZ-ZZYHAFTGSA-N 2 0 405.586 4.169 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@@H]([NH+]2CCCCC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000503723963 912810374 /nfs/dbraw/zinc/81/03/74/912810374.db2.gz HFVPURVVGLFEND-IFMALSPDSA-N 2 0 400.611 4.166 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N(CC[NH+](C)C)Cc1ccccc1F)c1ccccc1 ZINC000503707470 912805121 /nfs/dbraw/zinc/80/51/21/912805121.db2.gz IVYZKJDNRWWOFU-IBGZPJMESA-N 2 0 414.569 4.028 20 0 HIADRP CC[N@H+](CC(=O)NC1CC[NH+](CC)CC1)[C@H](C)c1ccc(-c2cccc(OC)c2)cc1 ZINC000470153429 884423821 /nfs/dbraw/zinc/42/38/21/884423821.db2.gz YOAZLEPAASFUIG-HXUWFJFHSA-N 2 0 423.601 4.346 20 0 HIADRP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1oc2ccccc2c1C[NH+](C)C ZINC000470546379 884955648 /nfs/dbraw/zinc/95/56/48/884955648.db2.gz LJRHPTUAQOWPMP-HXUWFJFHSA-N 2 0 405.542 4.089 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N(C)[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000470674319 885105113 /nfs/dbraw/zinc/10/51/13/885105113.db2.gz LBBZCGWUMQQQQQ-DEOSSOPVSA-N 2 0 423.601 4.144 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N(C)[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000470737994 885196439 /nfs/dbraw/zinc/19/64/39/885196439.db2.gz RRPHPRRRRJGSEV-VWLOTQADSA-N 2 0 422.617 4.333 20 0 HIADRP CN(C(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470752790 885217821 /nfs/dbraw/zinc/21/78/21/885217821.db2.gz BEVRMITWQGYOMU-LOSJGSFVSA-N 2 0 420.601 4.130 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(Br)c1 ZINC000512375538 921114138 /nfs/dbraw/zinc/11/41/38/921114138.db2.gz UFWOKRJNPUWJAO-UHFFFAOYSA-N 2 0 419.363 4.221 20 0 HIADRP O=C(CC[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1)Nc1ccccc1C(F)(F)F ZINC000471006611 885506582 /nfs/dbraw/zinc/50/65/82/885506582.db2.gz NNQNXCJJSSRFDK-KDURUIRLSA-N 2 0 417.475 4.098 20 0 HIADRP Cc1c([C@@H](C)[NH2+][C@@H](C)CCN2CC[NH+](C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000471592751 886303829 /nfs/dbraw/zinc/30/38/29/886303829.db2.gz GPHWMTRWZSHZMM-JKSUJKDBSA-N 2 0 424.420 4.164 20 0 HIADRP C[C@H](CCCCN1C(=O)c2ccccc2C1=O)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000471618995 886335770 /nfs/dbraw/zinc/33/57/70/886335770.db2.gz LQYZZPZRSVLFIU-HSALFYBXSA-N 2 0 411.590 4.084 20 0 HIADRP C[N@@H+]1CC[C@H](NC(=O)Nc2ccc(OCC[NH+]3CCCCC3)cc2)[C@H]1c1ccccc1 ZINC000471929857 886722255 /nfs/dbraw/zinc/72/22/55/886722255.db2.gz NRCGJBUWBWXBRQ-BJKOFHAPSA-N 2 0 422.573 4.118 20 0 HIADRP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000472144505 886942440 /nfs/dbraw/zinc/94/24/40/886942440.db2.gz RYWWLTRNBCDXOB-UHFFFAOYSA-N 2 0 411.434 4.230 20 0 HIADRP CC[NH+]1CCN(c2cccc(NC(=O)NCC(C)(C)[NH2+][C@@H](C)c3ccccc3)c2)CC1 ZINC000473828504 888662075 /nfs/dbraw/zinc/66/20/75/888662075.db2.gz JRSJSXUOOYKXNQ-FQEVSTJZSA-N 2 0 423.605 4.079 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCN(c3ccc(Cl)cc3Cl)C2)[C@H](C)C1 ZINC000474425398 889289296 /nfs/dbraw/zinc/28/92/96/889289296.db2.gz JDLYMSQBXOCNBU-KPFFTGBYSA-N 2 0 414.421 4.299 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)[C@H](C)C1 ZINC000474425400 889289420 /nfs/dbraw/zinc/28/94/20/889289420.db2.gz JDLYMSQBXOCNBU-POAQFYNOSA-N 2 0 414.421 4.299 20 0 HIADRP CCOC(=O)C1(C)CCC([NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)CC1 ZINC000474594755 889463403 /nfs/dbraw/zinc/46/34/03/889463403.db2.gz BLOMCKSBPAZNAR-UHFFFAOYSA-N 2 0 402.579 4.009 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000474815449 889667642 /nfs/dbraw/zinc/66/76/42/889667642.db2.gz YNMKRVGKAHLPMF-IAGOWNOFSA-N 2 0 416.635 4.005 20 0 HIADRP Cc1cc(Br)cn2c(C[NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)cnc12 ZINC000475275242 890172299 /nfs/dbraw/zinc/17/22/99/890172299.db2.gz ARAKPNIIDWPSSK-GOSISDBHSA-N 2 0 413.363 4.017 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NC2CC[NH+](C3CCCCC3)CC2)[C@@H]1c1cccs1 ZINC000475997098 890921148 /nfs/dbraw/zinc/92/11/48/890921148.db2.gz ULVCVTWFSVLXSK-XMSQKQJNSA-N 2 0 418.651 4.227 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NC2CC[NH+](C3CCCCC3)CC2)[C@H]1c1cccs1 ZINC000475997096 890921536 /nfs/dbraw/zinc/92/15/36/890921536.db2.gz ULVCVTWFSVLXSK-GCJKJVERSA-N 2 0 418.651 4.227 20 0 HIADRP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000477038022 891962187 /nfs/dbraw/zinc/96/21/87/891962187.db2.gz YYGKPNLDPVYRFG-UHFFFAOYSA-N 2 0 417.597 4.411 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(N3CCC([NH+](C)C)CC3)cn2)cc1)C(C)C ZINC000478321756 893553159 /nfs/dbraw/zinc/55/31/59/893553159.db2.gz IDVBGVBKMGEOKG-UHFFFAOYSA-N 2 0 423.605 4.095 20 0 HIADRP C[C@H](Cc1ccc(Br)cc1)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000479254930 894520364 /nfs/dbraw/zinc/52/03/64/894520364.db2.gz OAPDZYARGCVKKL-QGZVFWFLSA-N 2 0 417.391 4.127 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](C)c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000479267376 894539068 /nfs/dbraw/zinc/53/90/68/894539068.db2.gz SZQRJFRSCOFVHD-UONOGXRCSA-N 2 0 422.333 4.145 20 0 HIADRP C[C@H](C[NH2+][C@@H](c1ccccc1)c1ccc(Br)cc1)CN1CC[NH+](C)CC1 ZINC000479269306 894542706 /nfs/dbraw/zinc/54/27/06/894542706.db2.gz KIPRULGLERJUSE-GCJKJVERSA-N 2 0 416.407 4.012 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479273607 894548788 /nfs/dbraw/zinc/54/87/88/894548788.db2.gz FJTQNXPMCUBPND-UONOGXRCSA-N 2 0 422.333 4.145 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccccc1)c1ccc(Br)cc1 ZINC000479298927 894584079 /nfs/dbraw/zinc/58/40/79/894584079.db2.gz WYELCMBPHRLNAR-FGZHOGPDSA-N 2 0 417.391 4.365 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)NC2CC[NH+](C3CCCC3)CC2)CC1 ZINC000479352588 894648422 /nfs/dbraw/zinc/64/84/22/894648422.db2.gz WXGUYNFYXIAYGS-UHFFFAOYSA-N 2 0 412.622 4.125 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC000479365703 894666383 /nfs/dbraw/zinc/66/63/83/894666383.db2.gz UIEPTKMSOXGDPO-NOZRDPDXSA-N 2 0 424.633 4.077 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3cc(Br)ccc32)CC1 ZINC000479383591 894684712 /nfs/dbraw/zinc/68/47/12/894684712.db2.gz CWEUYENKTWQGRR-NJDAHSKKSA-N 2 0 407.396 4.184 20 0 HIADRP C[C@H]([NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(N2CCCC2=O)c1 ZINC000479486291 894808257 /nfs/dbraw/zinc/80/82/57/894808257.db2.gz HQEYCIWXQNZGLE-IJNIYJAUSA-N 2 0 409.496 4.269 20 0 HIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000479767584 895069113 /nfs/dbraw/zinc/06/91/13/895069113.db2.gz JTKNZZUOHGDMNT-HZPDHXFCSA-N 2 0 422.415 4.499 20 0 HIADRP COCCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000480238558 895649278 /nfs/dbraw/zinc/64/92/78/895649278.db2.gz DMVYUFBMKAXJJJ-ACRUOGEOSA-N 2 0 412.574 4.172 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480241042 895651554 /nfs/dbraw/zinc/65/15/54/895651554.db2.gz MZHVRYSYWDDQRF-QRVBRYPASA-N 2 0 421.585 4.376 20 0 HIADRP COc1cc(F)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)cc1OC ZINC000480247233 895658270 /nfs/dbraw/zinc/65/82/70/895658270.db2.gz ZSQGOZCJWFTPQQ-BZSNNMDCSA-N 2 0 416.537 4.303 20 0 HIADRP COc1cc(F)c([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1OC ZINC000480247235 895658763 /nfs/dbraw/zinc/65/87/63/895658763.db2.gz ZSQGOZCJWFTPQQ-KSZLIROESA-N 2 0 416.537 4.303 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccc(COCC(F)(F)F)cc1 ZINC000480363269 895769087 /nfs/dbraw/zinc/76/90/87/895769087.db2.gz LWICBIHQBVXXIM-DYESRHJHSA-N 2 0 407.480 4.161 20 0 HIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C[C@H](C(C)C)N3CC[NH+](C)CC3)s2)cc1 ZINC000480542880 895903740 /nfs/dbraw/zinc/90/37/40/895903740.db2.gz UUODFVGGKAYGKF-DYESRHJHSA-N 2 0 416.635 4.050 20 0 HIADRP FC(F)(F)COc1ccc(CC[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)cn1 ZINC000480668534 896033404 /nfs/dbraw/zinc/03/34/04/896033404.db2.gz SXYMEVBUONYIBB-NJDAHSKKSA-N 2 0 419.491 4.065 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)[C@@H](c1ccccc1)N1CCOCC1 ZINC000480671148 896034474 /nfs/dbraw/zinc/03/44/74/896034474.db2.gz BBZPTHDAFZXVFA-YKSBVNFPSA-N 2 0 413.631 4.012 20 0 HIADRP COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000480724792 896084533 /nfs/dbraw/zinc/08/45/33/896084533.db2.gz WGAHREPNHVEEBG-OAQYLSRUSA-N 2 0 416.997 4.372 20 0 HIADRP C[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1cccc(OCc2ccccc2)c1 ZINC000480723473 896085232 /nfs/dbraw/zinc/08/52/32/896085232.db2.gz ZHCWCSSTQCBZSE-OAQYLSRUSA-N 2 0 416.569 4.263 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)c3cc(Cl)ccc3OC(F)F)cn2)CC1 ZINC000480733344 896093272 /nfs/dbraw/zinc/09/32/72/896093272.db2.gz SVEVMKLWUFSPSD-HNNXBMFYSA-N 2 0 424.923 4.329 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1ccc(OC)c(OC)c1 ZINC000480743558 896105722 /nfs/dbraw/zinc/10/57/22/896105722.db2.gz VKMJZNLQXUNYFP-HSZRJFAPSA-N 2 0 411.590 4.082 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](C)c2sc(-c3ccc(OC)cc3)nc2C)CC1 ZINC000480765577 896128562 /nfs/dbraw/zinc/12/85/62/896128562.db2.gz ALANAXYBZLLRQR-SFHVURJKSA-N 2 0 416.635 4.195 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000480778793 896144770 /nfs/dbraw/zinc/14/47/70/896144770.db2.gz LEJXVZQIPOAJRN-HSZRJFAPSA-N 2 0 403.973 4.380 20 0 HIADRP O=C(NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000480791056 896159137 /nfs/dbraw/zinc/15/91/37/896159137.db2.gz PVRGVMSRUUMPAL-IBGZPJMESA-N 2 0 403.998 4.075 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCCOc3c(Br)cccc32)c1 ZINC000481318310 896669850 /nfs/dbraw/zinc/66/98/50/896669850.db2.gz GLCXNVHTGDQTPU-HXUWFJFHSA-N 2 0 419.363 4.393 20 0 HIADRP COc1ccc(C2(C[NH2+][C@@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C)CCOCC2)cc1 ZINC000481557087 896928074 /nfs/dbraw/zinc/92/80/74/896928074.db2.gz LCOQYFWKWPILBV-PXDATVDWSA-N 2 0 408.586 4.244 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000481716328 897108198 /nfs/dbraw/zinc/10/81/98/897108198.db2.gz KIMBIONVXDNJRN-GJZUVCINSA-N 2 0 406.618 4.458 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000481731782 897125604 /nfs/dbraw/zinc/12/56/04/897125604.db2.gz DNDZBKDJBBYZAY-NVQXNPDNSA-N 2 0 406.618 4.458 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C)CC2)cc1 ZINC000481734974 897129738 /nfs/dbraw/zinc/12/97/38/897129738.db2.gz LLEQIOZYJFUORX-WXVAWEFUSA-N 3 0 421.629 4.407 20 0 HIADRP C[C@H]1C[C@H](N(C)C(=O)NCCC[NH+](Cc2ccccc2)Cc2ccccc2)CC[N@@H+]1C ZINC000481776406 897160610 /nfs/dbraw/zinc/16/06/10/897160610.db2.gz IICAAANVCPFZKS-WIOPSUGQSA-N 2 0 422.617 4.203 20 0 HIADRP COc1ccc(-c2ccncc2)cc1C[NH+]1CCC(C[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000482007923 897404822 /nfs/dbraw/zinc/40/48/22/897404822.db2.gz QJICPIWKUHQOJW-PMACEKPBSA-N 2 0 409.574 4.078 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)cc1F ZINC000482257498 897739655 /nfs/dbraw/zinc/73/96/55/897739655.db2.gz DAQVOPZDEPPKOD-SFHVURJKSA-N 2 0 416.537 4.175 20 0 HIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CC1CC[NH+](CCN(C)C)CC1 ZINC000482347463 897857196 /nfs/dbraw/zinc/85/71/96/897857196.db2.gz CXZWLNCGOZMNQP-INIZCTEOSA-N 2 0 404.599 4.182 20 0 HIADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 ZINC000482347681 897858528 /nfs/dbraw/zinc/85/85/28/897858528.db2.gz YAOMACLQNIQMKY-IBGZPJMESA-N 2 0 421.651 4.070 20 0 HIADRP COc1ccc(Cc2nc(C)c([C@H](C)[NH2+]CCC3CC[NH+](C)CC3)s2)cc1OC ZINC000482351687 897864824 /nfs/dbraw/zinc/86/48/24/897864824.db2.gz ZJAFRUKFWMNXQZ-INIZCTEOSA-N 2 0 417.619 4.442 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(OCc2nccn2C)cc1 ZINC000482445362 898008062 /nfs/dbraw/zinc/00/80/62/898008062.db2.gz JGJGQKXGRQTZLF-JTHBVZDNSA-N 2 0 418.585 4.214 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482453314 898020611 /nfs/dbraw/zinc/02/06/11/898020611.db2.gz NNBZEQOPCOTIKX-MRXNPFEDSA-N 2 0 408.377 4.036 20 0 HIADRP CC(C)Sc1ccc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3ncccn3)CC2)cc1 ZINC000482460536 898032207 /nfs/dbraw/zinc/03/22/07/898032207.db2.gz QCNGRQNJMUTSIV-HXUWFJFHSA-N 2 0 413.635 4.230 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2ccc(OCc3ccc(F)cc3)cc2)CC1 ZINC000482495908 898075113 /nfs/dbraw/zinc/07/51/13/898075113.db2.gz LHMCHKIPBWNLJM-NHCUHLMSSA-N 2 0 413.581 4.329 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2ccc(OCc3ccc(F)cc3)cc2)CC1 ZINC000482495910 898076049 /nfs/dbraw/zinc/07/60/49/898076049.db2.gz LHMCHKIPBWNLJM-SFTDATJTSA-N 2 0 413.581 4.329 20 0 HIADRP CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(OC)c(OC)c1 ZINC000482536912 898123583 /nfs/dbraw/zinc/12/35/83/898123583.db2.gz QNPXJAWBUYHZPY-DYESRHJHSA-N 2 0 415.553 4.397 20 0 HIADRP CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(OC)c(OC)c1 ZINC000482536918 898123620 /nfs/dbraw/zinc/12/36/20/898123620.db2.gz QNPXJAWBUYHZPY-UWJYYQICSA-N 2 0 415.553 4.397 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccc(N2CCCC2=O)c1 ZINC000482537552 898125379 /nfs/dbraw/zinc/12/53/79/898125379.db2.gz NTSQOGMXXRDCBM-OALUTQOASA-N 2 0 424.564 4.116 20 0 HIADRP C[C@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(-c2ccccc2Br)s1 ZINC000482555049 898145515 /nfs/dbraw/zinc/14/55/15/898145515.db2.gz JAENIMASJBWTRD-HOTGVXAUSA-N 2 0 422.436 4.464 20 0 HIADRP C[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(-c2ccccc2Br)s1 ZINC000482555050 898147121 /nfs/dbraw/zinc/14/71/21/898147121.db2.gz JAENIMASJBWTRD-HZPDHXFCSA-N 2 0 422.436 4.464 20 0 HIADRP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000482645554 898249874 /nfs/dbraw/zinc/24/98/74/898249874.db2.gz ZBMHPVXQEDJCHA-OXQOHEQNSA-N 2 0 414.619 4.123 20 0 HIADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c2ccsc2S1 ZINC000482652377 898255269 /nfs/dbraw/zinc/25/52/69/898255269.db2.gz RCCWFWWUXLWJMR-ZAAXVRCTSA-N 2 0 415.628 4.161 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000482890319 898507579 /nfs/dbraw/zinc/50/75/79/898507579.db2.gz VVLLHXXFJUAUGU-MOPGFXCFSA-N 2 0 403.567 4.153 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000482955807 898585411 /nfs/dbraw/zinc/58/54/11/898585411.db2.gz DPAYVNAUSKDSMU-UHFFFAOYSA-N 2 0 407.602 4.399 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(F)c(Br)c2)[C@H](C)C1 ZINC000483123139 898810254 /nfs/dbraw/zinc/81/02/54/898810254.db2.gz DJARNAQPDZFGSF-VCBZYWHSSA-N 2 0 401.364 4.376 20 0 HIADRP O=C([C@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000483140894 898820774 /nfs/dbraw/zinc/82/07/74/898820774.db2.gz DZRUOWLJIHKCLV-OZXSUGGESA-N 2 0 409.618 4.156 20 0 HIADRP C[C@H]([NH2+][C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483191368 898849282 /nfs/dbraw/zinc/84/92/82/898849282.db2.gz FJGZZQUCYMBCCV-HKUYNNGSSA-N 2 0 419.516 4.158 20 0 HIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1cc(Br)ccc1F ZINC000483516405 899177596 /nfs/dbraw/zinc/17/75/96/899177596.db2.gz GXPXDWDWSURXRD-MRXNPFEDSA-N 2 0 412.391 4.189 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](c2cccs2)[NH+]2CCC(C)CC2)C[C@@H]1C ZINC000483518621 899179894 /nfs/dbraw/zinc/17/98/94/899179894.db2.gz MYIFGNCHWWFXTQ-SLFFLAALSA-N 2 0 406.640 4.035 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C[C@@H]1C ZINC000483691498 899349395 /nfs/dbraw/zinc/34/93/95/899349395.db2.gz JQXSMJDRXHSZOV-RDPSFJRHSA-N 2 0 422.617 4.429 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)C[C@@H]1C ZINC000483697254 899354002 /nfs/dbraw/zinc/35/40/02/899354002.db2.gz DZZCQXHWOBLYQO-JTAQYXEDSA-N 2 0 400.611 4.075 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)cc1 ZINC000483713313 899371350 /nfs/dbraw/zinc/37/13/50/899371350.db2.gz RWHCJBSTEUZVHI-RBUKOAKNSA-N 2 0 403.592 4.009 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)CC2 ZINC000483720430 899379049 /nfs/dbraw/zinc/37/90/49/899379049.db2.gz DTVCKHQLKFMWHF-NRFANRHFSA-N 2 0 419.491 4.243 20 0 HIADRP Cc1nc2c(s1)[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)CCC2 ZINC000483739982 899401078 /nfs/dbraw/zinc/40/10/78/899401078.db2.gz HAYUWRQPROCEJU-KRWDZBQOSA-N 2 0 424.536 4.389 20 0 HIADRP C[C@H]1C[C@@H](N(C)C(=O)NC2CC[NH+](C3CCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000483994638 899634042 /nfs/dbraw/zinc/63/40/42/899634042.db2.gz QRBLKZLWCVNKQX-RDPSFJRHSA-N 2 0 412.622 4.088 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000484031258 899662864 /nfs/dbraw/zinc/66/28/64/899662864.db2.gz IBVXAVNOTXSLAY-PXDATVDWSA-N 2 0 422.617 4.238 20 0 HIADRP C[C@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(Oc2ccc(Br)cc2)cc1 ZINC000484167926 899786597 /nfs/dbraw/zinc/78/65/97/899786597.db2.gz CAMVZIQRCUSPPK-INIZCTEOSA-N 2 0 419.363 4.349 20 0 HIADRP CC[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cccc(Br)c1 ZINC000484301448 899863357 /nfs/dbraw/zinc/86/33/57/899863357.db2.gz AXDMULGLJNDRJI-LJQANCHMSA-N 2 0 424.427 4.117 20 0 HIADRP C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000484491088 899982528 /nfs/dbraw/zinc/98/25/28/899982528.db2.gz IYHSDXNXBQRIRF-CYBMUJFWSA-N 2 0 411.434 4.401 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000484490234 899982535 /nfs/dbraw/zinc/98/25/35/899982535.db2.gz XHTIPJSYAPULFK-YLJYHZDGSA-N 2 0 415.965 4.177 20 0 HIADRP COc1ccc([C@@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1NC(C)=O ZINC000484498823 899989593 /nfs/dbraw/zinc/98/95/93/899989593.db2.gz FGWUEAMALIDOOO-BBRCJUOPSA-N 2 0 409.574 4.461 20 0 HIADRP CCOc1ccccc1NC(=O)CC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000485347947 900639386 /nfs/dbraw/zinc/63/93/86/900639386.db2.gz NAWKVCBMYACIJC-VWNXMTODSA-N 2 0 421.585 4.400 20 0 HIADRP C[C@H](NC(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000485398664 900696243 /nfs/dbraw/zinc/69/62/43/900696243.db2.gz BYRVPEPVJIBVJM-TUSQITKMSA-N 2 0 420.601 4.033 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CC[C@H]2[C@H](CCC[NH+]2C)C1)C1CCCCC1 ZINC000485614852 900872342 /nfs/dbraw/zinc/87/23/42/900872342.db2.gz OSCMXJNVCBVYEP-VWNXMTODSA-N 2 0 412.622 4.077 20 0 HIADRP C[NH+](C)Cc1ccccc1C(=O)N1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000485693891 900944177 /nfs/dbraw/zinc/94/41/77/900944177.db2.gz KQNKUWIFNYRHKG-UHFFFAOYSA-N 2 0 419.491 4.115 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000486188319 901373174 /nfs/dbraw/zinc/37/31/74/901373174.db2.gz GKXKOERLLWUVHW-SQJMNOBHSA-N 2 0 405.586 4.313 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N[C@@H](C)[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000486325042 901502245 /nfs/dbraw/zinc/50/22/45/901502245.db2.gz UEKYQQVXTWGDIO-ZNDGRNAPSA-N 2 0 420.601 4.032 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486386140 901550759 /nfs/dbraw/zinc/55/07/59/901550759.db2.gz GUQMVEVWIMTZLO-RDGATRHJSA-N 3 0 407.602 4.161 20 0 HIADRP C[NH+](C)Cc1ccccc1C(=O)N[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000488548548 902879143 /nfs/dbraw/zinc/87/91/43/902879143.db2.gz LWAIWIRGTOUOIH-IZZNHLLZSA-N 2 0 413.565 4.146 20 0 HIADRP Cc1cc(C)c(NC(=O)CCC[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)c(C)c1 ZINC000506017979 914695414 /nfs/dbraw/zinc/69/54/14/914695414.db2.gz QMRUWLUNVVLLIW-UHFFFAOYSA-N 2 0 415.622 4.155 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000489529733 903440081 /nfs/dbraw/zinc/44/00/81/903440081.db2.gz VPSJECLQBFDVOK-NQHRYMMQSA-N 2 0 420.601 4.033 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000489842836 903625572 /nfs/dbraw/zinc/62/55/72/903625572.db2.gz WRMVHWGPDFLBLA-PUHATCMVSA-N 2 0 424.589 4.016 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](c2ccccc2)c2ccccn2)[C@H](c2ccccc2)C1 ZINC000490119835 903776792 /nfs/dbraw/zinc/77/67/92/903776792.db2.gz QKGJLBIFQRSKHP-IZZNHLLZSA-N 2 0 400.570 4.139 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000490172703 903810633 /nfs/dbraw/zinc/81/06/33/903810633.db2.gz QCMCKQUSZHNBLO-PGRDOPGGSA-N 2 0 416.407 4.154 20 0 HIADRP CSc1cccc([C@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491005977 904366136 /nfs/dbraw/zinc/36/61/36/904366136.db2.gz LISXZXIGHUNKDO-QHCPKHFHSA-N 2 0 419.585 4.393 20 0 HIADRP CCc1ccc([C@H]([NH2+]CCC2CC[NH+](C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000491018987 904371360 /nfs/dbraw/zinc/37/13/60/904371360.db2.gz JCFSVQKSFPFXLA-DEOSSOPVSA-N 2 0 414.615 4.063 20 0 HIADRP COc1ccc([C@H]([NH2+]CC2CC[NH+](CCO)CC2)c2ccccc2Cl)c(C)c1 ZINC000491046572 904393548 /nfs/dbraw/zinc/39/35/48/904393548.db2.gz ADKPACINLVCQPI-QHCPKHFHSA-N 2 0 402.966 4.040 20 0 HIADRP CSc1cccc([C@@H]([NH2+]C[C@H](C)CN2CC[NH+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491058947 904402428 /nfs/dbraw/zinc/40/24/28/904402428.db2.gz JEBRDPDKSAGAIU-GAJHUEQPSA-N 2 0 419.585 4.249 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H](O)COCc2ccccc2Cl)CC1 ZINC000491075421 904412590 /nfs/dbraw/zinc/41/25/90/904412590.db2.gz MIHAJBLMDKYXHG-HSZRJFAPSA-N 2 0 416.993 4.062 20 0 HIADRP C[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[N@H+](C)CCCN1CC[NH+](C)CC1 ZINC000492786231 904905366 /nfs/dbraw/zinc/90/53/66/904905366.db2.gz XPXQFOMICUQHRA-CQSZACIVSA-N 2 0 411.434 4.355 20 0 HIADRP COc1ccc([C@@H]([NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000493012146 904989155 /nfs/dbraw/zinc/98/91/55/904989155.db2.gz YHDDSNHKMZYCLM-VWLOTQADSA-N 2 0 407.602 4.325 20 0 HIADRP Cc1cc([C@@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2ccccc2Cl)ccc1F ZINC000493062936 905006296 /nfs/dbraw/zinc/00/62/96/905006296.db2.gz VCGBVDPEDIWVSU-HSZRJFAPSA-N 2 0 403.973 4.493 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+][C@H](c2ccc(Cl)cc2)c2ccc(C(F)(F)F)cc2)CC1 ZINC000493252843 905069087 /nfs/dbraw/zinc/06/90/87/905069087.db2.gz XBWGQYJWMHPGHW-IBGZPJMESA-N 2 0 412.883 4.495 20 0 HIADRP CC[NH+]1CCC(CC[NH2+][C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000493276010 905074839 /nfs/dbraw/zinc/07/48/39/905074839.db2.gz FEPQZLZQOQZPFB-HSZRJFAPSA-N 2 0 418.578 4.030 20 0 HIADRP O=C(C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000493503042 905140515 /nfs/dbraw/zinc/14/05/15/905140515.db2.gz MHNHATJFRCUVAS-LADGPHEKSA-N 2 0 423.626 4.175 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)CC1 ZINC000493543887 905155083 /nfs/dbraw/zinc/15/50/83/905155083.db2.gz KIBAFHBNVUVPBK-JYFHCDHNSA-N 2 0 419.613 4.077 20 0 HIADRP Cc1nn(-c2ccccc2)cc1C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000512388092 921124824 /nfs/dbraw/zinc/12/48/24/921124824.db2.gz RZFBHKMCLQWPRL-UHFFFAOYSA-N 2 0 403.574 4.001 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CC(c3ccc(Br)cc3)C2)[C@@H](C)C1 ZINC000493892940 905250882 /nfs/dbraw/zinc/25/08/82/905250882.db2.gz APQWSWARTWNLMG-KSCTXSPISA-N 2 0 409.412 4.422 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]C(c2ccccc2)c2ccccc2)cc1 ZINC000494050812 905387707 /nfs/dbraw/zinc/38/77/07/905387707.db2.gz TYQXRVPLGXYDFY-UHFFFAOYSA-N 2 0 413.565 4.391 20 0 HIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]C1CC[NH+]([C@H]3CCCC[C@H]3O)CC1)CC2 ZINC000494647883 905881191 /nfs/dbraw/zinc/88/11/91/905881191.db2.gz NIZTWHFVYDHEFM-HSALFYBXSA-N 2 0 407.396 4.102 20 0 HIADRP CCOc1c(Cl)cccc1C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000494981596 906146741 /nfs/dbraw/zinc/14/67/41/906146741.db2.gz UETWKTMAIWCILE-UHFFFAOYSA-N 2 0 408.030 4.367 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H](C[C@@H]3CCOC3)c3ccc(F)cc3)cc2)CC1 ZINC000495090533 906230462 /nfs/dbraw/zinc/23/04/62/906230462.db2.gz IKMYSOJQONLVRT-SQJMNOBHSA-N 2 0 412.549 4.040 20 0 HIADRP CC[N@H+](CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)[C@H](C)Cc1ccsc1 ZINC000495250750 906338104 /nfs/dbraw/zinc/33/81/04/906338104.db2.gz QWGQBVPOEIMMLQ-GOSISDBHSA-N 2 0 417.644 4.189 20 0 HIADRP C[C@H]([NH2+]C1CCN(CCc2ccc(F)cc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495416398 906438136 /nfs/dbraw/zinc/43/81/36/906438136.db2.gz ZMYQNNAQNZJLLK-XUZZJYLKSA-N 2 0 409.593 4.333 20 0 HIADRP COc1cccc([C@@H]2[C@H]([NH2+][C@@H](C)c3ccc(OCC[NH+](C)C)cc3)CCN2C2CC2)c1 ZINC000495419472 906439640 /nfs/dbraw/zinc/43/96/40/906439640.db2.gz BOSKTOMYAAADFQ-AFWDCEBSSA-N 2 0 423.601 4.264 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](Cc3ccccc3)c3ccccc3)cn2)CC1 ZINC000495529936 906496997 /nfs/dbraw/zinc/49/69/97/906496997.db2.gz LUBVHGXGYTXFQU-RUZDIDTESA-N 2 0 400.570 4.297 20 0 HIADRP CC(C)n1nccc1NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000495549266 906503074 /nfs/dbraw/zinc/50/30/74/906503074.db2.gz VCLCOPZPWOXMLP-ZCNNSNEGSA-N 2 0 411.594 4.059 20 0 HIADRP Cn1cc(-c2ccccc2C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000512612949 921261041 /nfs/dbraw/zinc/26/10/41/921261041.db2.gz QPVBNRKEBIGQOF-DNRSQYFGSA-N 2 0 400.570 4.477 20 0 HIADRP O=C(C1CCC1)N(CCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)C1CC1 ZINC000512641951 921270717 /nfs/dbraw/zinc/27/07/17/921270717.db2.gz LJNZZGLHIDGWHQ-PZUNEJSGSA-N 2 0 409.618 4.058 20 0 HIADRP CCC(CC)C(=O)N1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000512653442 921276022 /nfs/dbraw/zinc/27/60/22/921276022.db2.gz FJDUPPAUMPTTFY-PZUNEJSGSA-N 2 0 411.634 4.304 20 0 HIADRP C[C@H](NC(=O)N1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000512694367 921289532 /nfs/dbraw/zinc/28/95/32/921289532.db2.gz OEJGABUWBBERLP-FUDKSRODSA-N 2 0 418.670 4.326 20 0 HIADRP C[C@H](NC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512695302 921290289 /nfs/dbraw/zinc/29/02/89/921290289.db2.gz SUMPUBDXOSEWAV-RBBKRZOGSA-N 2 0 412.622 4.490 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCNC(=O)NCc1ccccc1C[NH+]1CCCCCC1 ZINC000497717543 907219529 /nfs/dbraw/zinc/21/95/29/907219529.db2.gz RMWLDAXFDFNCOV-NRFANRHFSA-N 2 0 400.611 4.126 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(CC[NH+](C)C)Cc2ccc(F)c(F)c2)cc1)C1CC1 ZINC000497884141 907358473 /nfs/dbraw/zinc/35/84/73/907358473.db2.gz WBDSYOKADVYDOU-UHFFFAOYSA-N 2 0 415.528 4.153 20 0 HIADRP CCC[C@H]([NH2+]C(C)C)C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000498377844 907867247 /nfs/dbraw/zinc/86/72/47/907867247.db2.gz OFJZBDIASXYSCO-YSIASYRMSA-N 2 0 413.528 4.371 20 0 HIADRP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000498588939 908040875 /nfs/dbraw/zinc/04/08/75/908040875.db2.gz QBKFQDDQNAGFPI-SANMLTNESA-N 2 0 424.633 4.091 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)N[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)C[C@H]1C ZINC000498671869 908102732 /nfs/dbraw/zinc/10/27/32/908102732.db2.gz PFPYWQBTBWIEST-JSOTWZDUSA-N 2 0 422.564 4.003 20 0 HIADRP COc1cccc(N2CC[C@H](C[NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499161358 908516936 /nfs/dbraw/zinc/51/69/36/908516936.db2.gz LRLKZLRLWZRFBX-YQIMAOPZSA-N 2 0 405.586 4.307 20 0 HIADRP CN1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@H]1c1ccc(F)c(F)c1 ZINC000499196755 908551351 /nfs/dbraw/zinc/55/13/51/908551351.db2.gz WNYRMJQNNKXQQQ-NEWSNEBISA-N 2 0 411.540 4.495 20 0 HIADRP O[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)COc1cccc(Cl)c1Cl ZINC000513053994 921510535 /nfs/dbraw/zinc/51/05/35/921510535.db2.gz ZEBFDQHCPUECIW-QGZVFWFLSA-N 2 0 401.378 4.120 20 0 HIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000500442241 909860642 /nfs/dbraw/zinc/86/06/42/909860642.db2.gz SMOGZBNAXQCMAF-RKCQOLGWSA-N 2 0 404.476 4.465 20 0 HIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000500442239 909861189 /nfs/dbraw/zinc/86/11/89/909861189.db2.gz SMOGZBNAXQCMAF-GUOCTKQSSA-N 2 0 404.476 4.465 20 0 HIADRP C[C@@H](NC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1)[C@H](c1ccccc1)[NH+](C)C ZINC000500574465 909938715 /nfs/dbraw/zinc/93/87/15/909938715.db2.gz NSKRQYCACNEXRG-SDXIKQIGSA-N 2 0 400.611 4.020 20 0 HIADRP Brc1ccc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)s1 ZINC000513114454 921560196 /nfs/dbraw/zinc/56/01/96/921560196.db2.gz BVQAPFDDFJGYMO-UHFFFAOYSA-N 2 0 408.409 4.203 20 0 HIADRP C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501019871 910238806 /nfs/dbraw/zinc/23/88/06/910238806.db2.gz AYGNYVUEBFXJLA-WIYYLYMNSA-N 2 0 412.603 4.044 20 0 HIADRP CC(C)N(Cc1ccccc1)C(=O)[C@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501043782 910256555 /nfs/dbraw/zinc/25/65/55/910256555.db2.gz GJLIODDVUOCUIE-NRFANRHFSA-N 2 0 408.590 4.056 20 0 HIADRP COC(=O)c1sc2ccccc2c1C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501064545 910273058 /nfs/dbraw/zinc/27/30/58/910273058.db2.gz XQTQOYGMUYJITD-UHFFFAOYSA-N 2 0 409.555 4.431 20 0 HIADRP C[C@H](C(=O)Nc1ccc(F)cc1Cl)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501064359 910273173 /nfs/dbraw/zinc/27/31/73/910273173.db2.gz VXNNPDXTUSRAEQ-OAHLLOKOSA-N 2 0 404.917 4.050 20 0 HIADRP C[NH+](C)CCCC1CCN(C(=O)NCc2ccccc2C[NH+]2CCCCCC2)CC1 ZINC000501066503 910273338 /nfs/dbraw/zinc/27/33/38/910273338.db2.gz JYRWFUOTFDDITP-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)c2cccs2)CC1 ZINC000501520895 910631366 /nfs/dbraw/zinc/63/13/66/910631366.db2.gz XPSNYYUGRQNFKW-OALUTQOASA-N 2 0 420.648 4.185 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2cccc(Cl)c2C)CC1 ZINC000501802228 910853378 /nfs/dbraw/zinc/85/33/78/910853378.db2.gz FFSWHECAQFTSQF-GOSISDBHSA-N 2 0 410.002 4.046 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](c2cc(F)cc(Br)c2)C2CC2)CC1 ZINC000502005633 910973919 /nfs/dbraw/zinc/97/39/19/910973919.db2.gz OZNFJHIMPBOVJV-HXUWFJFHSA-N 2 0 412.391 4.045 20 0 HIADRP C[C@H]1C[N@H+](CCOc2ccc(CC[NH2+][C@@H]3CCCC34CCOCC4)cc2)C[C@H]1C ZINC000502395397 911379614 /nfs/dbraw/zinc/37/96/14/911379614.db2.gz VJRQFQGHTYAABX-ZFGGDYGUSA-N 2 0 400.607 4.135 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)C1 ZINC000502509579 911514058 /nfs/dbraw/zinc/51/40/58/911514058.db2.gz LJZBHAGFKAALAK-KRPFDRHASA-N 2 0 412.622 4.164 20 0 HIADRP CC(C)[C@H]([NH2+][C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000502562521 911566060 /nfs/dbraw/zinc/56/60/60/911566060.db2.gz HDDXAOHPUXMQLR-DVECYGJZSA-N 2 0 411.565 4.282 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)NCc3ccc(C[NH+]4CCCC4)cc3)CC2)CC1 ZINC000502668616 911709994 /nfs/dbraw/zinc/70/99/94/911709994.db2.gz MXUKQSAJWORZKI-UHFFFAOYSA-N 2 0 412.622 4.125 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)CCCC1)c1ccccc1 ZINC000503107487 912074491 /nfs/dbraw/zinc/07/44/91/912074491.db2.gz MSCMTNNNIOOUCZ-IFMALSPDSA-N 2 0 424.589 4.379 20 0 HIADRP CN(c1ccccc1C[NH+]1CCC(C(=O)c2ccccc2)CC1)C1CC[NH+](C)CC1 ZINC000506712594 915389761 /nfs/dbraw/zinc/38/97/61/915389761.db2.gz ZWDINSYSMZCIEB-UHFFFAOYSA-N 2 0 405.586 4.312 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506913737 915713848 /nfs/dbraw/zinc/71/38/48/915713848.db2.gz FQGVQMKUTZTZOX-FGZHOGPDSA-N 2 0 414.638 4.323 20 0 HIADRP Cc1ccc(C[N@@H+](CC(=O)Nc2cccc(C[NH+]3CCSCC3)c2)C(C)C)s1 ZINC000506957241 915764124 /nfs/dbraw/zinc/76/41/24/915764124.db2.gz NZJUOSYFSPBZDY-UHFFFAOYSA-N 2 0 417.644 4.454 20 0 HIADRP COc1ccc(C)cc1C1(C[NH2+]C2CCN(CCC(F)(F)F)CC2)CCOCC1 ZINC000507457370 916226958 /nfs/dbraw/zinc/22/69/58/916226958.db2.gz BHFOPNBQPCOJFW-UHFFFAOYSA-N 2 0 414.512 4.058 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)C[C@H](C)O1 ZINC000507872140 916712722 /nfs/dbraw/zinc/71/27/22/916712722.db2.gz DZOCNDRLJNBNRC-LFDKBHOUSA-N 2 0 416.606 4.286 20 0 HIADRP C[NH+](C)Cc1ccc(-c2noc([C@H]3C[N@H+](Cc4ccccc4)CCC3(F)F)n2)cc1 ZINC000507994469 916835118 /nfs/dbraw/zinc/83/51/18/916835118.db2.gz GGSJGERVOWYDBK-HXUWFJFHSA-N 2 0 412.484 4.423 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)c1ccc(C[NH+]2CCSCC2)cc1)c1ccccc1 ZINC000508477295 917261742 /nfs/dbraw/zinc/26/17/42/917261742.db2.gz NSSGPVYMBIKGJE-HSZRJFAPSA-N 2 0 411.615 4.048 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CNc1[nH+]ccn1Cc1ccc(Br)cc1 ZINC000508493240 917278212 /nfs/dbraw/zinc/27/82/12/917278212.db2.gz ZPRLFBWSURUMKD-UHFFFAOYSA-N 2 0 423.318 4.195 20 0 HIADRP COc1cccc([C@@H]2[C@H]([NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CCN2C2CC2)c1 ZINC000508696299 917457200 /nfs/dbraw/zinc/45/72/00/917457200.db2.gz JLBLCDKXWHZDNR-KQCYOHNVSA-N 2 0 419.613 4.473 20 0 HIADRP COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000508698610 917460332 /nfs/dbraw/zinc/46/03/32/917460332.db2.gz PIEPAXZTLRIPRF-MDNUFGMLSA-N 2 0 423.601 4.030 20 0 HIADRP COc1ccc([C@H](CN[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)cc1 ZINC000508714408 917475508 /nfs/dbraw/zinc/47/55/08/917475508.db2.gz HBGQDZNIZCBGCK-CVJWPJSTSA-N 2 0 407.602 4.332 20 0 HIADRP CCc1noc(-c2ccc(CC[NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)cc2)n1 ZINC000508715664 917477070 /nfs/dbraw/zinc/47/70/70/917477070.db2.gz DVOKSQKVIVZJQP-AUSIDOKSSA-N 2 0 404.558 4.342 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2nc3cc(Br)ccc3o2)CC1 ZINC000508965044 917721529 /nfs/dbraw/zinc/72/15/29/917721529.db2.gz KTPVFTFGLCZTGY-UHFFFAOYSA-N 2 0 424.383 4.161 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N1CC[C@H](C[NH+](C)CC2CC2)C1)c1ccc(Cl)cc1 ZINC000509040468 917793751 /nfs/dbraw/zinc/79/37/51/917793751.db2.gz SETMHHRIJRJXMZ-DENIHFKCSA-N 2 0 421.029 4.096 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+]Cc2ccc(-c3ccccc3Br)cc2)CC1 ZINC000509472420 918119549 /nfs/dbraw/zinc/11/95/49/918119549.db2.gz RQSHITCTKVVSTP-UHFFFAOYSA-N 2 0 416.407 4.232 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N(CC)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000509578378 918227891 /nfs/dbraw/zinc/22/78/91/918227891.db2.gz QGYFWRYXCRVJOM-KSEOMHKRSA-N 2 0 412.578 4.015 20 0 HIADRP C[C@H]1C[C@@H](CCNC(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)C[NH+]1Cc1ccccc1 ZINC000509793846 918400186 /nfs/dbraw/zinc/40/01/86/918400186.db2.gz YCXKABLFZDFVKF-AOHZBQACSA-N 2 0 414.638 4.098 20 0 HIADRP C[C@H]1C[C@@H](CCNC(=O)c2ccc(C[NH+]3CCCC3)cc2)C[N@@H+]1Cc1ccccc1 ZINC000510099408 918663486 /nfs/dbraw/zinc/66/34/86/918663486.db2.gz OLXQLVMEHUGYBH-XUZZJYLKSA-N 2 0 405.586 4.313 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000510401346 918874703 /nfs/dbraw/zinc/87/47/03/918874703.db2.gz YTABSERACFGSNM-UHFFFAOYSA-N 2 0 409.505 4.028 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCCCC2)[NH+]2CCCC2)o1 ZINC000510463538 918919378 /nfs/dbraw/zinc/91/93/78/918919378.db2.gz SNJDGHWRAFKXSH-HSZRJFAPSA-N 2 0 424.589 4.210 20 0 HIADRP C[C@H](NC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000510492968 918940830 /nfs/dbraw/zinc/94/08/30/918940830.db2.gz SPARTXZMUMXBDH-NZQKXSOJSA-N 2 0 412.622 4.125 20 0 HIADRP Cc1ccccc1[C@@H]([C@@H](C)NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000510547593 918992356 /nfs/dbraw/zinc/99/23/56/918992356.db2.gz OZOUEUDVSYZGEM-ZJSXRUAMSA-N 2 0 407.602 4.405 20 0 HIADRP CN(C(=O)c1oc2ccccc2c1C[NH+](C)C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000510772050 919230886 /nfs/dbraw/zinc/23/08/86/919230886.db2.gz BCWYTFWAPXSAIS-UHFFFAOYSA-N 2 0 405.542 4.231 20 0 HIADRP O=C(Nc1ccccc1)N1CC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000511025784 919598282 /nfs/dbraw/zinc/59/82/82/919598282.db2.gz FXDHREUFJXMSMA-BELIEFIBSA-N 2 0 418.585 4.183 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)C(=O)N1CCc2sccc2C1 ZINC000511027591 919602264 /nfs/dbraw/zinc/60/22/64/919602264.db2.gz IMSYJVZVFFLOCC-LJQANCHMSA-N 2 0 411.615 4.043 20 0 HIADRP C[NH+](C)CC[C@@H]([NH2+]C1CCC(NC(=O)COc2ccc(Cl)cc2)CC1)C(C)(C)C ZINC000511047902 919638167 /nfs/dbraw/zinc/63/81/67/919638167.db2.gz ZYXYHAKJNPXDDK-GZNCHQMQSA-N 2 0 424.029 4.102 20 0 HIADRP C[NH+](C)Cc1ccc(CNC(=O)c2cccc(C[N@H+](C)Cc3ccccc3)c2)cc1 ZINC000511107330 919714420 /nfs/dbraw/zinc/71/44/20/919714420.db2.gz MGVQDJSGEAQCIN-UHFFFAOYSA-N 2 0 401.554 4.310 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511294362 919890061 /nfs/dbraw/zinc/89/00/61/919890061.db2.gz QUYXOVQDSMEQOF-PMACEKPBSA-N 2 0 416.610 4.182 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)CC1 ZINC000511416710 920028916 /nfs/dbraw/zinc/02/89/16/920028916.db2.gz FVKMNJYIXNIMHF-VWPQPMDRSA-N 2 0 412.622 4.164 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000511661386 920327399 /nfs/dbraw/zinc/32/73/99/920327399.db2.gz CKOAYYOVIFRABY-UHFFFAOYSA-N 2 0 415.553 4.002 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2ccc3occc3c2)CC1 ZINC000512059589 920827952 /nfs/dbraw/zinc/82/79/52/920827952.db2.gz SALIZWPQUCLJEB-UHFFFAOYSA-N 2 0 403.448 4.493 20 0 HIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)C1 ZINC000512129641 920877746 /nfs/dbraw/zinc/87/77/46/920877746.db2.gz LNACRBMNUURKMV-UONOGXRCSA-N 2 0 405.892 4.397 20 0 HIADRP O=C(CC[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1)Nc1ccc(Cl)cc1F ZINC000512245063 921002002 /nfs/dbraw/zinc/00/20/02/921002002.db2.gz PDTYLTXDQYMUFJ-HSZRJFAPSA-N 2 0 415.940 4.406 20 0 HIADRP O=C(CC[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1)Nc1ccc(Cl)cc1F ZINC000512245070 921002184 /nfs/dbraw/zinc/00/21/84/921002184.db2.gz PDTYLTXDQYMUFJ-QHCPKHFHSA-N 2 0 415.940 4.406 20 0 HIADRP C[C@@H]1C[C@@H](CC[NH2+][C@@H](C(=O)NC2CC2)c2ccc(F)cc2)C[N@@H+]1Cc1ccccc1 ZINC000512323587 921073463 /nfs/dbraw/zinc/07/34/63/921073463.db2.gz CYVHJMJDBUIPSF-DRMXPCRNSA-N 2 0 409.549 4.036 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512327251 921077562 /nfs/dbraw/zinc/07/75/62/921077562.db2.gz CSOQJPAZSKEBBC-QRVBRYPASA-N 2 0 406.014 4.320 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512332042 921080876 /nfs/dbraw/zinc/08/08/76/921080876.db2.gz MUYGMLYIAQDVCE-BRWVUGGUSA-N 2 0 422.411 4.409 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(Br)cc1 ZINC000513456965 921822318 /nfs/dbraw/zinc/82/23/18/921822318.db2.gz GVMWPOPLJGIICW-NHCUHLMSSA-N 2 0 403.364 4.257 20 0 HIADRP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(-c4cccc(Cl)c4Cl)o3)C2)CC1 ZINC000513507949 921855232 /nfs/dbraw/zinc/85/52/32/921855232.db2.gz JOLIUUJPLHEKCL-MRXNPFEDSA-N 2 0 408.373 4.465 20 0 HIADRP Cc1ccc(NC(=O)COc2ccc(CC[NH2+][C@@H]3CC[N@@H+](C)[C@@H]4CCC[C@@H]43)cc2)cc1 ZINC000513703492 922023447 /nfs/dbraw/zinc/02/34/47/922023447.db2.gz WKCQJVGEAZAZQP-UBFVSLLYSA-N 2 0 421.585 4.017 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NCC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000514026707 922348865 /nfs/dbraw/zinc/34/88/65/922348865.db2.gz KFGZHCVIWQNDMW-UHFFFAOYSA-N 2 0 422.617 4.240 20 0 HIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(NC(=O)CCCOc3ccccc3)cc2)[C@@H]2CCC[C@H]21 ZINC000514094646 922418861 /nfs/dbraw/zinc/41/88/61/922418861.db2.gz NSEUPSXHXVSNHZ-CCDWMCETSA-N 2 0 421.585 4.447 20 0 HIADRP CCOc1c(OC)cc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cc1OC ZINC000514096568 922421832 /nfs/dbraw/zinc/42/18/32/922421832.db2.gz WZDNOIPKWOMHGE-UHFFFAOYSA-N 2 0 412.574 4.447 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccc(OC)c(OC)c2C)CC1 ZINC000514100225 922426312 /nfs/dbraw/zinc/42/63/12/922426312.db2.gz UIHRMFFNVWONSI-FQEVSTJZSA-N 2 0 411.590 4.001 20 0 HIADRP CCC1(CC)[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C[C@@H]1OC ZINC000515316305 923045294 /nfs/dbraw/zinc/04/52/94/923045294.db2.gz UVJIPWHYELDQLE-ZLNRFVROSA-N 2 0 400.607 4.099 20 0 HIADRP CCOc1ccc(NC(=O)[C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000515521763 923153203 /nfs/dbraw/zinc/15/32/03/923153203.db2.gz UUBATNOLASUJMC-VQTJNVASSA-N 2 0 409.574 4.434 20 0 HIADRP COc1ccc(NC(=O)[C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000515523503 923153528 /nfs/dbraw/zinc/15/35/28/923153528.db2.gz QNQDPUVNNRUFIC-AQNXPRMDSA-N 2 0 409.574 4.290 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(=O)Nc1ccc(F)cc1F ZINC000515756204 923329664 /nfs/dbraw/zinc/32/96/64/923329664.db2.gz QPBTZOIEFPYKOP-IRXDYDNUSA-N 2 0 401.501 4.314 20 0 HIADRP CC(C)(C)[NH+]1CCC(NC(=O)NC[C@@H](c2ccccc2Cl)[NH+]2CCCC2)CC1 ZINC000515818620 923370829 /nfs/dbraw/zinc/37/08/29/923370829.db2.gz PURUKMPJSLJELB-FQEVSTJZSA-N 2 0 407.002 4.039 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)c1ccccc1Cl ZINC000515817822 923371710 /nfs/dbraw/zinc/37/17/10/923371710.db2.gz CZANJMHZMBKMTL-FQEVSTJZSA-N 2 0 409.018 4.285 20 0 HIADRP CC(C)Oc1ccc([C@@H](CNC(=O)c2cccc(C[NH+]3CCCC3)c2)[NH+](C)C)cc1 ZINC000515862586 923397400 /nfs/dbraw/zinc/39/74/00/923397400.db2.gz MJWDDNHWILDGLA-XMMPIXPASA-N 2 0 409.574 4.102 20 0 HIADRP CC(C)Oc1ccc([C@H](CNC(=O)c2cccc(C[NH+]3CCCC3)c2)[NH+](C)C)cc1 ZINC000515862584 923397898 /nfs/dbraw/zinc/39/78/98/923397898.db2.gz MJWDDNHWILDGLA-DEOSSOPVSA-N 2 0 409.574 4.102 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@H]2CCCNc3ccccc32)CC1 ZINC000516116568 923553112 /nfs/dbraw/zinc/55/31/12/923553112.db2.gz NUZXCAGSKLCWLL-NRFANRHFSA-N 2 0 418.507 4.494 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)C1CC[NH+](Cc2ccccc2)CC1)c1cccc(OC)c1 ZINC000516674411 923838829 /nfs/dbraw/zinc/83/88/29/923838829.db2.gz HPUZWHFIXYQHHF-VWLOTQADSA-N 2 0 423.601 4.107 20 0 HIADRP COc1cc(C[NH2+]CC2(SC)CC[NH+](C)CC2)ccc1OCc1cccs1 ZINC000516819430 923904262 /nfs/dbraw/zinc/90/42/62/923904262.db2.gz MVXLUHJXFHSXIG-UHFFFAOYSA-N 2 0 406.617 4.253 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cccc(OC(F)F)c2)CC1 ZINC000517545319 924256528 /nfs/dbraw/zinc/25/65/28/924256528.db2.gz KAVZKTWVXJOAJM-INIZCTEOSA-N 2 0 407.480 4.420 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2csc(-c3ccccc3)n2)[C@@H](c2ccccc2)C1 ZINC000518269469 927126121 /nfs/dbraw/zinc/12/61/21/927126121.db2.gz BLMCOQBEOIIEKQ-HSZRJFAPSA-N 2 0 406.599 4.279 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000518285646 927144242 /nfs/dbraw/zinc/14/42/42/927144242.db2.gz YEBFSNFERQKMFU-NRFANRHFSA-N 2 0 404.558 4.038 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)c2ccccc2)CC1 ZINC000518363414 927221640 /nfs/dbraw/zinc/22/16/40/927221640.db2.gz FTDCNIRWZIRGFO-VXKWHMMOSA-N 2 0 414.619 4.123 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000518632079 927391219 /nfs/dbraw/zinc/39/12/19/927391219.db2.gz YCCMBWCNZQURMG-QPPBQGQZSA-N 2 0 412.622 4.221 20 0 HIADRP COc1ccccc1NC(=O)C[C@@H](C)[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000519674981 928046496 /nfs/dbraw/zinc/04/64/96/928046496.db2.gz VDXMWCXPKXIWOG-IRLDBZIGSA-N 2 0 409.574 4.304 20 0 HIADRP COc1ccccc1NC(=O)C[C@H](C)[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000519674982 928046832 /nfs/dbraw/zinc/04/68/32/928046832.db2.gz VDXMWCXPKXIWOG-RBBKRZOGSA-N 2 0 409.574 4.304 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNC(=O)N2CCC[NH+](C(C)(C)C)CC2)C1 ZINC000520215387 928394414 /nfs/dbraw/zinc/39/44/14/928394414.db2.gz KUYLZZJUXDZIHA-OYRHEFFESA-N 2 0 414.638 4.180 20 0 HIADRP O=C(Nc1cccc(C[NH+]2CCCCC2)c1)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000520531150 928622408 /nfs/dbraw/zinc/62/24/08/928622408.db2.gz QXIMECWXCURQNR-UHFFFAOYSA-N 2 0 409.599 4.474 20 0 HIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C(=O)Nc2ccc(OC)cc2)c2ccccc2)CC1 ZINC000520791152 928820432 /nfs/dbraw/zinc/82/04/32/928820432.db2.gz CQONUPQYEBOOQX-DEOSSOPVSA-N 2 0 409.574 4.429 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(Cc2ccncc2)C[C@@H]2CCC[NH+]2CC)cc1)C(C)C ZINC000521881585 929530711 /nfs/dbraw/zinc/53/07/11/929530711.db2.gz HJUGLCHSVPLSHJ-VWLOTQADSA-N 2 0 422.617 4.439 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1)c1ccccc1 ZINC000521907343 929550063 /nfs/dbraw/zinc/55/00/63/929550063.db2.gz VYHDNJRIJLHNPZ-XMMPIXPASA-N 2 0 408.590 4.165 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC000521907120 929550219 /nfs/dbraw/zinc/55/02/19/929550219.db2.gz JOTMSPBIUSZMKE-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCc2ccccc2C[N@@H+](C)C(C)C)[NH+]2CCCC2)cc1 ZINC000521992216 929615365 /nfs/dbraw/zinc/61/53/65/929615365.db2.gz DGTDKIPVOORCTP-RUZDIDTESA-N 2 0 422.617 4.472 20 0 HIADRP C[NH+](C)CCCOc1cccc(NC(=O)[C@H]2CCC[N@H+](Cc3cccc(F)c3)C2)c1 ZINC000524692490 929801545 /nfs/dbraw/zinc/80/15/45/929801545.db2.gz JPKAFSKZGGWREJ-FQEVSTJZSA-N 2 0 413.537 4.007 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NCc1ccccc1C[NH+]1CCCC1 ZINC000524884495 929872046 /nfs/dbraw/zinc/87/20/46/929872046.db2.gz JVOYTZODEABOMY-JOCHJYFZSA-N 2 0 420.601 4.088 20 0 HIADRP C[C@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1cc2ccccc2s1 ZINC000527194352 930609590 /nfs/dbraw/zinc/60/95/90/930609590.db2.gz HJMUYNDXWKEQMI-SFHVURJKSA-N 2 0 407.583 4.464 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000530664751 930791394 /nfs/dbraw/zinc/79/13/94/930791394.db2.gz YNBQQYXFOMVVQP-UHFFFAOYSA-N 2 0 401.982 4.035 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3cnc(-c4ccccc4)[nH]3)CC2)c1 ZINC000530774207 930820617 /nfs/dbraw/zinc/82/06/17/930820617.db2.gz VHPNUKNMDPRDTN-UHFFFAOYSA-N 2 0 403.574 4.077 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000530969216 930871793 /nfs/dbraw/zinc/87/17/93/930871793.db2.gz NGYHUPWOFGKWFE-QPPBQGQZSA-N 2 0 420.601 4.118 20 0 HIADRP O=C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCCC[NH+]1Cc1ccccc1 ZINC000531057357 930899919 /nfs/dbraw/zinc/89/99/19/930899919.db2.gz RMSINVSXIXDSDV-VGPBXHGJSA-N 2 0 417.597 4.353 20 0 HIADRP c1[nH]nc2c1cccc2C[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000531213429 930967776 /nfs/dbraw/zinc/96/77/76/930967776.db2.gz FQEPUJUJSLQEQV-UHFFFAOYSA-N 2 0 411.553 4.175 20 0 HIADRP CCCC(=O)Nc1ccc(C[NH2+]Cc2ccccc2N2CC[NH+](CCC)CC2)cc1 ZINC000531532238 931095134 /nfs/dbraw/zinc/09/51/34/931095134.db2.gz PLCFUZDCLXWDNH-UHFFFAOYSA-N 2 0 408.590 4.247 20 0 HIADRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2ccc(OCc3c(F)cccc3Cl)cc2)CC1 ZINC000531610069 931124522 /nfs/dbraw/zinc/12/45/22/931124522.db2.gz KSTIHOFFOQQYSJ-UHFFFAOYSA-N 2 0 420.956 4.383 20 0 HIADRP C[NH+](C)CCC1CC[NH+](CC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000531643536 931137326 /nfs/dbraw/zinc/13/73/26/931137326.db2.gz USFHEZHWTIBEDC-HXUWFJFHSA-N 2 0 412.405 4.321 20 0 HIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]C[C@H](c2cccc(F)c2)N2CCOCC2)cc1 ZINC000531697145 931161590 /nfs/dbraw/zinc/16/15/90/931161590.db2.gz ZMJQVBSPESLMQN-HOYKHHGWSA-N 2 0 408.521 4.044 20 0 HIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000531989116 931277795 /nfs/dbraw/zinc/27/77/95/931277795.db2.gz DLLRWBUJYVXIHT-GOSISDBHSA-N 2 0 421.614 4.425 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000531989578 931278709 /nfs/dbraw/zinc/27/87/09/931278709.db2.gz NNJFBEHUOIVIGI-KRWDZBQOSA-N 2 0 407.587 4.116 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(OC(F)F)c(OC)c2)CC1 ZINC000532042669 931295324 /nfs/dbraw/zinc/29/53/24/931295324.db2.gz RJDSDNKNZVDMLF-UHFFFAOYSA-N 2 0 419.516 4.118 20 0 HIADRP CC[C@H]([NH2+][C@H](CN1CCN(C)CC1)c1ccccc1)c1cc(Cl)ccc1OC ZINC000532221225 931359470 /nfs/dbraw/zinc/35/94/70/931359470.db2.gz DOKGDEJRDQIBTN-FCHUYYIVSA-N 2 0 401.982 4.378 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+]C3CCC4(CCOCC4)CC3)CC2)cc1 ZINC000532248224 931371406 /nfs/dbraw/zinc/37/14/06/931371406.db2.gz LWOBRQOOAZKQME-UHFFFAOYSA-N 2 0 400.607 4.387 20 0 HIADRP CN(c1ccccc1C[NH2+]CCc1nc(C(C)(C)C)cs1)C1CC[NH+](C)CC1 ZINC000532358732 931407688 /nfs/dbraw/zinc/40/76/88/931407688.db2.gz ZUFGBERHUIJULE-UHFFFAOYSA-N 2 0 400.636 4.303 20 0 HIADRP CC(C)NC(=O)Nc1ccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1 ZINC000532361817 931409199 /nfs/dbraw/zinc/40/91/99/931409199.db2.gz GXNOYYYLGDLSOF-UHFFFAOYSA-N 2 0 423.605 4.037 20 0 HIADRP CN(c1ccccc1C[NH2+]CC1(c2ccccc2)CCOCC1)C1CC[NH+](C)CC1 ZINC000532361859 931409503 /nfs/dbraw/zinc/40/95/03/931409503.db2.gz MEHBGBIPLGWGPY-UHFFFAOYSA-N 2 0 407.602 4.055 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2cc(Cl)cc3cccnc32)cc1 ZINC000532420453 931429752 /nfs/dbraw/zinc/42/97/52/931429752.db2.gz COSPJBDZRQQXHO-UHFFFAOYSA-N 2 0 422.960 4.004 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCSc4ccc(Cl)cc43)cn2)CC1 ZINC000532451685 931440563 /nfs/dbraw/zinc/44/05/63/931440563.db2.gz HNKNOHJDMFIUOJ-LJQANCHMSA-N 2 0 402.995 4.204 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000532451677 931440720 /nfs/dbraw/zinc/44/07/20/931440720.db2.gz JXURWYWZVZUWGO-HOTGVXAUSA-N 2 0 423.388 4.086 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCCOc4c(Cl)cccc43)cc2)CC1 ZINC000532483120 931456326 /nfs/dbraw/zinc/45/63/26/931456326.db2.gz KSUOOZNXEQIIIF-QFIPXVFZSA-N 2 0 400.950 4.300 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000532500691 931463979 /nfs/dbraw/zinc/46/39/79/931463979.db2.gz KXQMTJPJOMBINJ-CQSZACIVSA-N 2 0 407.917 4.056 20 0 HIADRP Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000532727311 931611972 /nfs/dbraw/zinc/61/19/72/931611972.db2.gz DFVUROUMIWABAQ-UHFFFAOYSA-N 2 0 419.411 4.462 20 0 HIADRP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)ccc1OCc1c(C)noc1C ZINC000532985559 931726878 /nfs/dbraw/zinc/72/68/78/931726878.db2.gz UFZIQJWVQPMTCP-OAQYLSRUSA-N 2 0 415.578 4.337 20 0 HIADRP C[N@H+](CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)[C@@H]1CCCc2ccccc21 ZINC000533222044 931813541 /nfs/dbraw/zinc/81/35/41/931813541.db2.gz XMSKZNQRDWTKOX-HSZRJFAPSA-N 2 0 409.599 4.183 20 0 HIADRP O=C(CC[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)N[C@H](c1cccs1)c1ccccc1 ZINC000533293221 931830855 /nfs/dbraw/zinc/83/08/55/931830855.db2.gz CGCNSCAOVLQLEU-QPPBQGQZSA-N 2 0 411.615 4.294 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)[C@H](c2ccccc2)C1 ZINC000534352024 932389611 /nfs/dbraw/zinc/38/96/11/932389611.db2.gz IHAVVLAGXFBEEA-RCXJIHSJSA-N 2 0 407.602 4.123 20 0 HIADRP C[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1nc(-c2ccccc2)no1 ZINC000534818238 932790842 /nfs/dbraw/zinc/79/08/42/932790842.db2.gz PWMKAVIITNRGFD-IBGZPJMESA-N 2 0 419.573 4.160 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cn(-c3ccccc3)nc2-c2ccncc2)CC1 ZINC000535811438 933406843 /nfs/dbraw/zinc/40/68/43/933406843.db2.gz GPBLAMHJPGOBHX-UHFFFAOYSA-N 2 0 403.574 4.487 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)CC1 ZINC000562450015 945079345 /nfs/dbraw/zinc/07/93/45/945079345.db2.gz REUDXQXLNCFOAN-WZDPVOGJSA-N 3 0 420.645 4.008 20 0 HIADRP COc1cc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c(-c2ccccc2)cc1OC ZINC000537619381 938335083 /nfs/dbraw/zinc/33/50/83/938335083.db2.gz BPFOMCMRXUEUPS-UHFFFAOYSA-N 2 0 424.585 4.448 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCc3c2cc(Cl)cc3Br)CC1 ZINC000537956875 938432304 /nfs/dbraw/zinc/43/23/04/938432304.db2.gz JJNDEAGOZWCWFM-IPMKNSEASA-N 2 0 413.787 4.057 20 0 HIADRP CCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cc1OCCC ZINC000537957915 938433650 /nfs/dbraw/zinc/43/36/50/938433650.db2.gz YNCYNNLGOPGDBC-VLCRHTCISA-N 2 0 404.595 4.293 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(Cn3cnc4ccccc43)c2)[C@@H](C)C1 ZINC000537959287 938434644 /nfs/dbraw/zinc/43/46/44/938434644.db2.gz AKMRVRUJCNXVIY-XUZZJYLKSA-N 2 0 420.601 4.311 20 0 HIADRP CSc1ccc([C@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)cc1F ZINC000537968916 938439419 /nfs/dbraw/zinc/43/94/19/938439419.db2.gz DMMRNUHMFCAVON-KRWDZBQOSA-N 2 0 415.578 4.224 20 0 HIADRP Brc1ccc(N2CC[C@H](C[NH2+]C3CC[NH+](C4CCCC4)CC3)C2)cc1 ZINC000537989538 938451661 /nfs/dbraw/zinc/45/16/61/938451661.db2.gz BTOGOUQNPJTITH-QGZVFWFLSA-N 2 0 406.412 4.272 20 0 HIADRP CCc1ccc([C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)C(C)C)cc1 ZINC000538101206 938502460 /nfs/dbraw/zinc/50/24/60/938502460.db2.gz NEIQNFMGMXRAIP-LOSJGSFVSA-N 2 0 407.602 4.433 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)NCc2nc(C)c3ccccc3n2)CC1 ZINC000538210550 938557519 /nfs/dbraw/zinc/55/75/19/938557519.db2.gz KFXQDLPSGLZTAN-QGZVFWFLSA-N 2 0 407.537 4.070 20 0 HIADRP CN(C)c1cc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c2ccccc2n1 ZINC000538293636 938585007 /nfs/dbraw/zinc/58/50/07/938585007.db2.gz KVHYCNRADWSIOB-HSZRJFAPSA-N 2 0 416.569 4.379 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@H](c1ccc3c(c1)OCCO3)C1CC1)c1ccccc1O2 ZINC000538294519 938585471 /nfs/dbraw/zinc/58/54/71/938585471.db2.gz RZZZSNGYVMHRGR-OFVILXPXSA-N 2 0 420.553 4.487 20 0 HIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+]CC1(O)CC[NH+](C(C)C)CC1 ZINC000538412808 938614817 /nfs/dbraw/zinc/61/48/17/938614817.db2.gz AKVNCZWWKBHNAX-UHFFFAOYSA-N 2 0 418.585 4.173 20 0 HIADRP CC(C)[NH+]1CCN(c2cccc(N[C@@H](C)c3ccc(OCC[NH+](C)C)cc3)c2)CC1 ZINC000538548167 938646329 /nfs/dbraw/zinc/64/63/29/938646329.db2.gz GRYUYSQOAPLGIT-NRFANRHFSA-N 2 0 410.606 4.331 20 0 HIADRP CC[N@@H+](Cc1ccc(OCc2noc(C)n2)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538763786 938704724 /nfs/dbraw/zinc/70/47/24/938704724.db2.gz VHFZGNLRLURVJQ-HSZRJFAPSA-N 2 0 420.557 4.301 20 0 HIADRP Brc1ccc2c(c1)[C@H]([NH+]1CCC(OCC[NH+]3CCCC3)CC1)CCC2 ZINC000538781937 938709014 /nfs/dbraw/zinc/70/90/14/938709014.db2.gz GUGVUPOONHYGFX-OAQYLSRUSA-N 2 0 407.396 4.403 20 0 HIADRP O=C(Nc1cccc(CC[NH+]2CCCC2)c1)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000538804939 938717326 /nfs/dbraw/zinc/71/73/26/938717326.db2.gz QKFYZQROCHBZRQ-UHFFFAOYSA-N 2 0 409.599 4.126 20 0 HIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000539043540 938779305 /nfs/dbraw/zinc/77/93/05/938779305.db2.gz VLVXWZOUEUACCY-DYXWJJEUSA-N 2 0 415.603 4.009 20 0 HIADRP Cc1cc(C[C@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)n(-c2ccccc2)n1 ZINC000539048807 938782389 /nfs/dbraw/zinc/78/23/89/938782389.db2.gz VMBAGXQQVWVALS-PZJWPPBQSA-N 2 0 406.574 4.403 20 0 HIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000539071289 938793358 /nfs/dbraw/zinc/79/33/58/938793358.db2.gz IMVSBUDFCQSGAC-OAHLLOKOSA-N 2 0 408.373 4.006 20 0 HIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000539292405 938835017 /nfs/dbraw/zinc/83/50/17/938835017.db2.gz KHHNTWKPEOQFRY-LJQANCHMSA-N 2 0 421.585 4.284 20 0 HIADRP CC1CCN(c2ccc(C[NH2+][C@H]3CC4(CC[NH+](C)CC4)Oc4ccccc43)cn2)CC1 ZINC000539361558 938848802 /nfs/dbraw/zinc/84/88/02/938848802.db2.gz CAJAIJTUUKECCU-QHCPKHFHSA-N 2 0 420.601 4.396 20 0 HIADRP C[C@H]([NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1cccc(N2CCCC2=O)c1 ZINC000539361949 938848849 /nfs/dbraw/zinc/84/88/49/938848849.db2.gz MELFTMLOQISNAW-WMZHIEFXSA-N 2 0 419.569 4.452 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CC1(c3ccccc3)CCOCC1)c1ccccc1O2 ZINC000539363737 938849086 /nfs/dbraw/zinc/84/90/86/938849086.db2.gz RTPSROJTORUVOT-QHCPKHFHSA-N 2 0 406.570 4.313 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000539498305 938868815 /nfs/dbraw/zinc/86/88/15/938868815.db2.gz FCHXERUFZHZCJD-INIZCTEOSA-N 2 0 408.384 4.264 20 0 HIADRP Cc1cc(Br)cc2cc([C@@H]([NH2+]CC3(O)CC[NH+](C)CC3)C(C)C)oc21 ZINC000539546159 938877792 /nfs/dbraw/zinc/87/77/92/938877792.db2.gz HPKATDWGRJZIJI-SFHVURJKSA-N 2 0 409.368 4.247 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@H]2CCCc3c4ccccc4[nH]c32)c1 ZINC000563564056 945216345 /nfs/dbraw/zinc/21/63/45/945216345.db2.gz HMHKUXGNUYTXGQ-DEOSSOPVSA-N 2 0 407.558 4.292 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)c1 ZINC000563564057 945216560 /nfs/dbraw/zinc/21/65/60/945216560.db2.gz HMHKUXGNUYTXGQ-XMMPIXPASA-N 2 0 407.558 4.292 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)N3CCCC[C@@H]([NH+]4CCCC4)C3)c2)CC1 ZINC000539871571 938962659 /nfs/dbraw/zinc/96/26/59/938962659.db2.gz CCTJXBSBWGDJGT-XMMPIXPASA-N 2 0 412.622 4.443 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)C1 ZINC000539875565 938963297 /nfs/dbraw/zinc/96/32/97/938963297.db2.gz SVQHTKVLXKAAOM-JOCHJYFZSA-N 2 0 400.611 4.157 20 0 HIADRP CC(C)N(Cc1ccccc1)C(=O)[C@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540043911 939047048 /nfs/dbraw/zinc/04/70/48/939047048.db2.gz KRKQIQFHTCXAHZ-QFIPXVFZSA-N 2 0 422.617 4.446 20 0 HIADRP CCOc1ccccc1NC(=O)CC[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540048658 939049618 /nfs/dbraw/zinc/04/96/18/939049618.db2.gz YDVHEGRWHULLSR-UHFFFAOYSA-N 2 0 410.562 4.047 20 0 HIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C3CCN([C@@H]4CCC[C@@H]4O)CC3)s2)cc1 ZINC000540160143 939096025 /nfs/dbraw/zinc/09/60/25/939096025.db2.gz JVLGMNKPZRFOCF-RVHYNSKXSA-N 2 0 415.603 4.156 20 0 HIADRP COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000540170848 939101766 /nfs/dbraw/zinc/10/17/66/939101766.db2.gz YJTFJFQQQJJZFN-KRWDZBQOSA-N 2 0 415.965 4.025 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1cccc(C(F)(F)F)c1 ZINC000540173295 939103376 /nfs/dbraw/zinc/10/33/76/939103376.db2.gz MGVSMIVTJJXUES-QGZVFWFLSA-N 2 0 419.491 4.382 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@@H](C)c3nc4ccccc4n3C)CC2)c1 ZINC000540259113 939175597 /nfs/dbraw/zinc/17/55/97/939175597.db2.gz QMLJVSLFSIWGHF-NRFANRHFSA-N 2 0 405.590 4.135 20 0 HIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1nc2ccc(Cl)cc2n1C ZINC000540301327 939187289 /nfs/dbraw/zinc/18/72/89/939187289.db2.gz VRQFRFIXVWSZHG-INIZCTEOSA-N 2 0 400.954 4.060 20 0 HIADRP C[C@@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2ccccc2C1 ZINC000540475597 939267011 /nfs/dbraw/zinc/26/70/11/939267011.db2.gz QJYGWJVLFKAAKO-GBXCKJPGSA-N 2 0 405.586 4.011 20 0 HIADRP C[C@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2ccccc2C1 ZINC000540475602 939267613 /nfs/dbraw/zinc/26/76/13/939267613.db2.gz QJYGWJVLFKAAKO-YKSBVNFPSA-N 2 0 405.586 4.011 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCc1nc(-c3ccncc3)cs1)c1ccccc1O2 ZINC000540500888 939278618 /nfs/dbraw/zinc/27/86/18/939278618.db2.gz CPCFRWWQJCZCGS-HXUWFJFHSA-N 2 0 420.582 4.325 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1cc2cc(Br)ccc2o1 ZINC000540594740 939314447 /nfs/dbraw/zinc/31/44/47/939314447.db2.gz ZQVRKIXJUFSNMC-HNNXBMFYSA-N 2 0 408.384 4.120 20 0 HIADRP C[N@H+](CC(=O)NC1CC[NH+](C2CC2)CC1)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000540676704 939336714 /nfs/dbraw/zinc/33/67/14/939336714.db2.gz YIEIDDWMDKSFDB-LEWJYISDSA-N 2 0 423.523 4.016 20 0 HIADRP C[C@@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000540749929 939358552 /nfs/dbraw/zinc/35/85/52/939358552.db2.gz RKESJADTMIRVQG-HXUWFJFHSA-N 2 0 411.590 4.004 20 0 HIADRP c1ccc(C[N@@H+]2CCC[C@H]2C2CCOCC2)c(C[NH+]2CCC[C@H]2C2CCOCC2)c1 ZINC000540826856 939386509 /nfs/dbraw/zinc/38/65/09/939386509.db2.gz FLKYNEWMAHQREJ-UIOOFZCWSA-N 2 0 412.618 4.469 20 0 HIADRP c1ccc(C[N@@H+]2CCC[C@@H]2C2CCOCC2)c(C[NH+]2CCC[C@@H]2C2CCOCC2)c1 ZINC000540826855 939386560 /nfs/dbraw/zinc/38/65/60/939386560.db2.gz FLKYNEWMAHQREJ-CLJLJLNGSA-N 2 0 412.618 4.469 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000540908568 939415186 /nfs/dbraw/zinc/41/51/86/939415186.db2.gz OAOJJLDQUMDQQU-QFIPXVFZSA-N 2 0 416.407 4.156 20 0 HIADRP CC(C)[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1F ZINC000540988911 939426351 /nfs/dbraw/zinc/42/63/51/939426351.db2.gz KVGRJPZPGOCJOQ-NRFANRHFSA-N 2 0 419.976 4.158 20 0 HIADRP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(-c4cccc(C(F)(F)F)c4)o3)C2)CC1 ZINC000540996846 939427747 /nfs/dbraw/zinc/42/77/47/939427747.db2.gz PURLVHCXRZRJFY-LJQANCHMSA-N 2 0 407.480 4.177 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C(C)(C)COc1ncc(Cl)cc1Cl ZINC000541380817 939501644 /nfs/dbraw/zinc/50/16/44/939501644.db2.gz SEFLEHMKVVTXLO-UHFFFAOYSA-N 2 0 406.317 4.225 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1 ZINC000541389624 939503439 /nfs/dbraw/zinc/50/34/39/939503439.db2.gz RRPLHOLYRCUHFT-HXUWFJFHSA-N 2 0 413.928 4.122 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](c2ccc(F)cc2)c2ccccn2)[C@@H](c2ccccc2)C1 ZINC000541548451 939551348 /nfs/dbraw/zinc/55/13/48/939551348.db2.gz DYCPSSGCZPPZII-CLJLJLNGSA-N 2 0 418.560 4.279 20 0 HIADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)N1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000541574068 939558521 /nfs/dbraw/zinc/55/85/21/939558521.db2.gz HBDINDGJDAZJPA-INIZCTEOSA-N 2 0 413.528 4.295 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc(F)cc(Br)c1 ZINC000541915115 939652730 /nfs/dbraw/zinc/65/27/30/939652730.db2.gz YFCMTTLYIHLFMZ-RTWAWAEBSA-N 2 0 421.354 4.396 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccccc1O2 ZINC000563715870 945264497 /nfs/dbraw/zinc/26/44/97/945264497.db2.gz MGOXIIKRZHDARJ-IBGZPJMESA-N 2 0 405.464 4.221 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC000542670423 939853065 /nfs/dbraw/zinc/85/30/65/939853065.db2.gz FVSCLNMZVPNFMR-ACIOBRDBSA-N 2 0 406.636 4.182 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(C)[C@H](C)C1CC[NH+](C)CC1)c1ccccc1Cl ZINC000542726006 939857211 /nfs/dbraw/zinc/85/72/11/939857211.db2.gz HLBMBOJTPADVDW-DYESRHJHSA-N 2 0 409.018 4.095 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N(C)[C@H](C)C2CC[NH+](C)CC2)c1 ZINC000542743405 939858664 /nfs/dbraw/zinc/85/86/64/939858664.db2.gz VVFDJPBSPZPNCK-HXUWFJFHSA-N 2 0 402.627 4.180 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000542847224 939862626 /nfs/dbraw/zinc/86/26/26/939862626.db2.gz OPYQYGZEHSIJQQ-DENIHFKCSA-N 2 0 400.950 4.300 20 0 HIADRP COc1ccc([C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccc(F)cc2)cc1 ZINC000542848309 939862821 /nfs/dbraw/zinc/86/28/21/939862821.db2.gz XNVNSLYCOXKRLE-AOYPEHQESA-N 2 0 420.528 4.280 20 0 HIADRP CC(C)N(CC[NH+](C)C)C(=O)Nc1ccc(C[N@H+](C[C@H]2CCCCO2)C(C)C)cc1 ZINC000542890958 939865702 /nfs/dbraw/zinc/86/57/02/939865702.db2.gz KSZBGWNCAPIDBW-HSZRJFAPSA-N 2 0 418.626 4.270 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NC[C@H](c2ccc(C)o2)[NH+]2CCCC2)CC1 ZINC000542978336 939890300 /nfs/dbraw/zinc/89/03/00/939890300.db2.gz DFZZBMQOSWNELA-JOCHJYFZSA-N 2 0 418.626 4.269 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000543403965 940053480 /nfs/dbraw/zinc/05/34/80/940053480.db2.gz IINZOJLTGYBBGS-VQTJNVASSA-N 2 0 410.558 4.321 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(OC(F)F)cc1 ZINC000543775254 940182441 /nfs/dbraw/zinc/18/24/41/940182441.db2.gz JJWOAWHNGKARFO-UNMCSNQZSA-N 2 0 404.501 4.486 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000543776963 940183288 /nfs/dbraw/zinc/18/32/88/940183288.db2.gz RASMRMSTQAPQQA-UZLBHIALSA-N 2 0 408.464 4.045 20 0 HIADRP C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000544004620 940293541 /nfs/dbraw/zinc/29/35/41/940293541.db2.gz ZKIBKEVCTDBQOE-CQSZACIVSA-N 2 0 411.443 4.413 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3c(Br)cccc32)CC1 ZINC000544043703 940308519 /nfs/dbraw/zinc/30/85/19/940308519.db2.gz ODUFIXLBYAFLKM-QHAWAJNXSA-N 2 0 407.396 4.184 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCCc3c(Br)cccc32)CC1 ZINC000544043701 940308556 /nfs/dbraw/zinc/30/85/56/940308556.db2.gz ODUFIXLBYAFLKM-PCCBWWKXSA-N 2 0 407.396 4.184 20 0 HIADRP Cc1cc([C@H](C)[NH2+]CC(=O)Nc2cccc(C[NH+]3CCSCC3)c2)c(C)s1 ZINC000544401005 940412528 /nfs/dbraw/zinc/41/25/28/940412528.db2.gz UERIUCNSAKGAIW-INIZCTEOSA-N 2 0 403.617 4.203 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000544404006 940413353 /nfs/dbraw/zinc/41/33/53/940413353.db2.gz VQUHENVXVPAHDT-UHFFFAOYSA-N 2 0 419.613 4.378 20 0 HIADRP CN(c1ccccc1C[NH2+][C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)C1CC[NH+](C)CC1 ZINC000544596865 940487306 /nfs/dbraw/zinc/48/73/06/940487306.db2.gz YGTWPKBHEDBDNE-RCZVLFRGSA-N 2 0 411.565 4.366 20 0 HIADRP c1cncc(C[N@H+]2CCC[C@H](c3nc(-c4cccc(C[NH+]5CCCC5)c4)no3)C2)c1 ZINC000545675574 940580146 /nfs/dbraw/zinc/58/01/46/940580146.db2.gz RLTKCYZQSZXUQL-QFIPXVFZSA-N 2 0 403.530 4.107 20 0 HIADRP COc1ccc(CC[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1OC(F)F ZINC000547504556 941066076 /nfs/dbraw/zinc/06/60/76/941066076.db2.gz OPCBJSLIOAKIJF-YLJYHZDGSA-N 2 0 404.501 4.339 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547827978 941077377 /nfs/dbraw/zinc/07/73/77/941077377.db2.gz VSSPQUKBCVZYRV-RDPSFJRHSA-N 2 0 414.553 4.334 20 0 HIADRP COc1c(Br)cccc1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000548148282 941088769 /nfs/dbraw/zinc/08/87/69/941088769.db2.gz QKKVECRIJHWFKM-UHFFFAOYSA-N 2 0 419.363 4.222 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cc1 ZINC000548186833 941091814 /nfs/dbraw/zinc/09/18/14/941091814.db2.gz OCKKDXIBXWBWTE-JOCHJYFZSA-N 2 0 413.993 4.361 20 0 HIADRP COc1ccccc1[C@H](CNC(=O)c1ccc(C[NH+]2CCCC2)cc1)[NH+]1CCCCC1 ZINC000549414295 941187523 /nfs/dbraw/zinc/18/75/23/941187523.db2.gz CNBFRCZGLVYKNL-DEOSSOPVSA-N 2 0 421.585 4.248 20 0 HIADRP Cc1ccc(C[NH+]2CCSCC2)cc1NC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000549417907 941187971 /nfs/dbraw/zinc/18/79/71/941187971.db2.gz LTMRAFWPSSTCEJ-UHFFFAOYSA-N 2 0 409.599 4.392 20 0 HIADRP Cc1c2cccc(Cl)c2sc1C[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000549733373 941205965 /nfs/dbraw/zinc/20/59/65/941205965.db2.gz DBXCYHMLNSPHJQ-UHFFFAOYSA-N 2 0 415.990 4.444 20 0 HIADRP COc1ccccc1/C=C\C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550263815 941305596 /nfs/dbraw/zinc/30/55/96/941305596.db2.gz XEHBADBXBJIASX-XOOBZCTMSA-N 2 0 406.570 4.227 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CCC([NH+](C)Cc3ccccc3)CC2)[C@@H](C)C1 ZINC000550888029 941379934 /nfs/dbraw/zinc/37/99/34/941379934.db2.gz XITLLLITXRKBOK-MMBJAZKOSA-N 3 0 401.639 4.156 20 0 HIADRP Fc1cc(Br)cc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000550903155 941380714 /nfs/dbraw/zinc/38/07/14/941380714.db2.gz WCEALFBKSLBSIN-UHFFFAOYSA-N 2 0 407.327 4.353 20 0 HIADRP Cc1c([C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cnn1C(C)C ZINC000551264721 941438803 /nfs/dbraw/zinc/43/88/03/941438803.db2.gz MNHSTDGNNYGSSY-NZQKXSOJSA-N 2 0 410.606 4.352 20 0 HIADRP C[NH+]1CCCC[C@H]1CCSc1nnc(SCC[C@H]2CCCC[N@H+]2C)s1 ZINC000551363149 941461491 /nfs/dbraw/zinc/46/14/91/941461491.db2.gz QKGVVGMHDVPIMN-IYBDPMFKSA-N 2 0 400.683 4.471 20 0 HIADRP O=C(C[NH2+][C@@H]1CCCCC[C@@H]1c1ccc(Cl)cc1)NC1CC[NH+](C2CC2)CC1 ZINC000551425229 941476170 /nfs/dbraw/zinc/47/61/70/941476170.db2.gz WUIFCBVYAWTFNV-FGZHOGPDSA-N 2 0 403.998 4.089 20 0 HIADRP COCC[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000551423569 941476260 /nfs/dbraw/zinc/47/62/60/941476260.db2.gz LYRLVZGMSLPPEN-HXUWFJFHSA-N 2 0 402.410 4.077 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3c[nH]nc3-c3cccc(Cl)c3)cc2)CC1 ZINC000551570053 941503896 /nfs/dbraw/zinc/50/38/96/941503896.db2.gz QVBQDMOCFWUJPS-UHFFFAOYSA-N 2 0 410.949 4.493 20 0 HIADRP c1ncn(Cc2ccccc2C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000552033821 941571532 /nfs/dbraw/zinc/57/15/32/941571532.db2.gz UHLPNMCNVJLXIZ-JIMJEQGWSA-N 2 0 415.585 4.107 20 0 HIADRP CCO[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C12CCOCC2 ZINC000552065705 941578031 /nfs/dbraw/zinc/57/80/31/941578031.db2.gz KMTIJZPSWXYEIL-UUFXTFJOSA-N 2 0 412.618 4.241 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]C4CCN(Cc5ccccn5)CC4)[C@@H]3C2)cc1 ZINC000552255747 941615002 /nfs/dbraw/zinc/61/50/02/941615002.db2.gz STZSYRJJWZJCBC-RNJDCESWSA-N 2 0 418.629 4.326 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]C4CCN(Cc5ccccn5)CC4)[C@H]3C2)cc1 ZINC000552255746 941615203 /nfs/dbraw/zinc/61/52/03/941615203.db2.gz STZSYRJJWZJCBC-MSLLRLGPSA-N 2 0 418.629 4.326 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H](c1ccc(Br)cc1)C1CC1 ZINC000554743218 942218208 /nfs/dbraw/zinc/21/82/08/942218208.db2.gz YWNMXNPLIAYKOS-OAQYLSRUSA-N 2 0 418.379 4.416 20 0 HIADRP CN(C)C(=O)c1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[nH]1 ZINC000554937601 942325727 /nfs/dbraw/zinc/32/57/27/942325727.db2.gz LLQSKQMMEZCCIH-AIOONPSKSA-N 2 0 414.981 4.074 20 0 HIADRP c1ccc(COC2CC([NH2+]C[C@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)C2)cc1 ZINC000556232372 942823585 /nfs/dbraw/zinc/82/35/85/942823585.db2.gz FARYEYZHIHZUDZ-IHSPPPAMSA-N 2 0 420.597 4.253 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccccc1N(C)C ZINC000556232442 942823671 /nfs/dbraw/zinc/82/36/71/942823671.db2.gz FXOKQZSSMWJFQI-JTHBVZDNSA-N 2 0 407.602 4.332 20 0 HIADRP CCS(=O)(=O)c1cccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000556880666 942949123 /nfs/dbraw/zinc/94/91/23/942949123.db2.gz SNFUWISBMVBDJX-UHFFFAOYSA-N 2 0 400.588 4.013 20 0 HIADRP Cc1ccc(C[N@H+]2CC[C@@H](CN(C)C(=O)[C@H]3CCC[NH+]3Cc3ccccc3)C2)s1 ZINC000557387385 943096950 /nfs/dbraw/zinc/09/69/50/943096950.db2.gz MYDJFJIIEPNGCY-JTHBVZDNSA-N 2 0 411.615 4.001 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000557639344 943243605 /nfs/dbraw/zinc/24/36/05/943243605.db2.gz FLWCHESBFLHELU-SANMLTNESA-N 2 0 417.553 4.233 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+]([C@H](C)c2ccc(Br)cc2)CC1 ZINC000558416240 943553369 /nfs/dbraw/zinc/55/33/69/943553369.db2.gz ODBVCDCPBZKLMO-QGZVFWFLSA-N 2 0 424.427 4.070 20 0 HIADRP CNC(=O)c1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000558790467 943664309 /nfs/dbraw/zinc/66/43/09/943664309.db2.gz ONIPQMVNWSVHTK-MWWJCJHHSA-N 2 0 411.977 4.403 20 0 HIADRP C[N@H+](CCN(Cc1ccccc1)C(=O)C1CC[NH+](C2CC2)CC1)Cc1ccccc1 ZINC000559018504 943806622 /nfs/dbraw/zinc/80/66/22/943806622.db2.gz GJYDNDYUBWDMMN-UHFFFAOYSA-N 2 0 405.586 4.022 20 0 HIADRP c1ccc([C@H](C[C@H]2CCOC2)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc1 ZINC000559147367 943853813 /nfs/dbraw/zinc/85/38/13/943853813.db2.gz VRNUCBDUAMSZMU-BVAGGSTKSA-N 2 0 407.602 4.346 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(CNC(=O)[C@@H]2C[NH+](C(C)(C)C)C[C@H]2C(F)(F)F)c1 ZINC000559713999 944034885 /nfs/dbraw/zinc/03/48/85/944034885.db2.gz JJINSSVIARIUBA-RTBURBONSA-N 2 0 413.528 4.052 20 0 HIADRP Oc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CCC2 ZINC000559892596 944077153 /nfs/dbraw/zinc/07/71/53/944077153.db2.gz YFOODILEYSPRQK-RDGATRHJSA-N 2 0 406.570 4.288 20 0 HIADRP CCc1ccccc1NC(=O)C[C@@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000560268600 944214150 /nfs/dbraw/zinc/21/41/50/944214150.db2.gz ZDDSLIKBGILCPV-LJQANCHMSA-N 2 0 409.574 4.229 20 0 HIADRP C[NH+](CCCC[N@@H+](C)C[C@H]1OCCc2ccccc21)C[C@H]1OCCc2ccccc21 ZINC000560331527 944227130 /nfs/dbraw/zinc/22/71/30/944227130.db2.gz FCEKMVAHKVAOJS-CLJLJLNGSA-N 2 0 408.586 4.258 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000560678432 944291105 /nfs/dbraw/zinc/29/11/05/944291105.db2.gz VZZFIZUFBKGRNH-UHFFFAOYSA-N 2 0 417.597 4.411 20 0 HIADRP CC1CC[NH+](Cc2ccc(NC(=O)C3CC[NH+]([C@H]4CCSC4)CC3)cc2)CC1 ZINC000561162278 944491513 /nfs/dbraw/zinc/49/15/13/944491513.db2.gz NCDFJZCKXQJUGT-QFIPXVFZSA-N 2 0 401.620 4.075 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000561297680 944543049 /nfs/dbraw/zinc/54/30/49/944543049.db2.gz HPIXHGAJVHNYTP-NHCUHLMSSA-N 2 0 418.507 4.278 20 0 HIADRP C[C@H]1CCCC[NH+]1CCC(=O)Nc1cccc(NC(=O)CC[N@H+]2CCCC[C@@H]2C)c1 ZINC000562025716 944900028 /nfs/dbraw/zinc/90/00/28/944900028.db2.gz YPTFZRLRYMHIIG-PMACEKPBSA-N 2 0 414.594 4.093 20 0 HIADRP Cc1ccc([C@H]([NH2+]CCCCC[NH+]2CCCC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000564311577 945511305 /nfs/dbraw/zinc/51/13/05/945511305.db2.gz FYGLZNIUSZRZHS-DEOSSOPVSA-N 2 0 414.615 4.344 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000564367586 945533742 /nfs/dbraw/zinc/53/37/42/945533742.db2.gz DFQWLPOHXHACSR-IBGZPJMESA-N 2 0 408.571 4.313 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)C1 ZINC000564506206 945635070 /nfs/dbraw/zinc/63/50/70/945635070.db2.gz QRSVTDYQUCOSIJ-RPBOFIJWSA-N 2 0 421.972 4.375 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]C2CCC3(CCCO3)CC2)CC1 ZINC000564622500 945712906 /nfs/dbraw/zinc/71/29/06/945712906.db2.gz VPDXNFIXPZNBHK-UHFFFAOYSA-N 2 0 411.512 4.039 20 0 HIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000564757570 945750792 /nfs/dbraw/zinc/75/07/92/945750792.db2.gz QTLFKRITOLORIR-CYVLTUHYSA-N 2 0 409.540 4.458 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000565974838 945950868 /nfs/dbraw/zinc/95/08/68/945950868.db2.gz YCWHAVGALRIECW-JOCHJYFZSA-N 2 0 410.949 4.144 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000566996705 946208057 /nfs/dbraw/zinc/20/80/57/946208057.db2.gz LLJVFOMKMYDOOB-UZLBHIALSA-N 2 0 420.395 4.134 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@@H](C[NH+](C)C)c1ccc(Cl)cc1 ZINC000567068918 946231506 /nfs/dbraw/zinc/23/15/06/946231506.db2.gz CFBBFOCSZIATOE-KRWDZBQOSA-N 2 0 413.949 4.223 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000568017958 946443503 /nfs/dbraw/zinc/44/35/03/946443503.db2.gz YHPZPIFDFPEYNH-UNMCSNQZSA-N 2 0 408.590 4.289 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc1Br ZINC000568796002 946695133 /nfs/dbraw/zinc/69/51/33/946695133.db2.gz LCIDQKIYPCQSOC-HNNXBMFYSA-N 2 0 422.367 4.034 20 0 HIADRP CC(C)Cc1ccc([C@@H](CNC(=O)c2ccc(Cn3ccnc3)cc2)[NH+](C)C)cc1 ZINC000569163133 946828765 /nfs/dbraw/zinc/82/87/65/946828765.db2.gz BMXXSSCPBJOFES-XMMPIXPASA-N 2 0 404.558 4.163 20 0 HIADRP C(CC[NH+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1)CC[N@@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000569746378 946971662 /nfs/dbraw/zinc/97/16/62/946971662.db2.gz LGUHIPURUAEXLH-MLCQCVOFSA-N 2 0 402.623 4.224 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccccc2N2CCO[C@@H](C)C2)C1 ZINC000570587590 947304359 /nfs/dbraw/zinc/30/43/59/947304359.db2.gz ZQUZNOSFKMWPHW-VXKWHMMOSA-N 2 0 407.602 4.433 20 0 HIADRP O=C(NCCC[NH+]1CCCC1)C1CC[NH+](Cc2ccc(-c3ccccc3)cc2F)CC1 ZINC000572324435 947885160 /nfs/dbraw/zinc/88/51/60/947885160.db2.gz ZHZUMBKBVXNCNO-UHFFFAOYSA-N 2 0 423.576 4.307 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H]2CCC[C@H](c3ccnn3C)C2)CC1 ZINC000572330912 947886561 /nfs/dbraw/zinc/88/65/61/947886561.db2.gz ICRVIAKTPKZHGX-ZJOUEHCJSA-N 2 0 413.585 4.078 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](c1sccc1Br)C1CCCCC1 ZINC000574386741 948430283 /nfs/dbraw/zinc/43/02/83/948430283.db2.gz HCWDCFXZJDKZMW-QAPCUYQASA-N 2 0 414.457 4.358 20 0 HIADRP CC(C)Oc1cc[nH+]c(N2CCC(F)(F)[C@@]3(CC[N@H+](Cc4ccccn4)C3)C2)c1 ZINC001164908943 721709862 /nfs/dbraw/zinc/70/98/62/721709862.db2.gz ZTDPIKKESTYJHI-OAQYLSRUSA-N 2 0 402.489 4.002 20 0 HIADRP CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CC[NH+](CCOc3ccccc3)CC2)nc1 ZINC001165043959 721961835 /nfs/dbraw/zinc/96/18/35/721961835.db2.gz AWQGBCQCZCMNCO-DEOSSOPVSA-N 2 0 408.590 4.220 20 0 HIADRP Cc1cccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000030907279 847795315 /nfs/dbraw/zinc/79/53/15/847795315.db2.gz CSYWSANBENMCIY-JOCHJYFZSA-N 2 0 400.570 4.481 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000030907235 847795566 /nfs/dbraw/zinc/79/55/66/847795566.db2.gz SSTYLZUGDZIAGI-NRFANRHFSA-N 2 0 416.569 4.181 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3c[nH]nc3-c3ccccc3)CC2)c1 ZINC000042202263 848300355 /nfs/dbraw/zinc/30/03/55/848300355.db2.gz NOXWFWMJMDMNGZ-UHFFFAOYSA-N 2 0 403.574 4.077 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)Nc2cccc(C[NH+](C)C)c2)c2cccs2)CC1 ZINC000044292087 848540151 /nfs/dbraw/zinc/54/01/51/848540151.db2.gz AFDHTEMIKWHOEQ-FQEVSTJZSA-N 2 0 400.592 4.404 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCC([NH+]3CCCCC3)CC2)cc1 ZINC000045778269 848726563 /nfs/dbraw/zinc/72/65/63/848726563.db2.gz HFWCBWWXABFAPW-OAQYLSRUSA-N 2 0 412.622 4.221 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000047777566 849109675 /nfs/dbraw/zinc/10/96/75/849109675.db2.gz PMKQBBFCPCYNNA-RBUKOAKNSA-N 2 0 416.591 4.004 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2c[nH]nc2-c2ccc(F)cc2)C[C@@H](C)O1 ZINC000048816734 849270433 /nfs/dbraw/zinc/27/04/33/849270433.db2.gz YEMJKIGFCVWQSQ-QZTJIDSGSA-N 2 0 408.521 4.115 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)c1cccs1 ZINC000056764408 850472077 /nfs/dbraw/zinc/47/20/77/850472077.db2.gz NQVPEZHDSHZYJU-HXUWFJFHSA-N 2 0 400.592 4.201 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2ccccc2C[NH+]2CCC(C)CC2)CC1 ZINC000056846038 850500263 /nfs/dbraw/zinc/50/02/63/850500263.db2.gz DEBLAGDOJRZESD-UHFFFAOYSA-N 2 0 414.638 4.180 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC[C@H]2C)CC1 ZINC000056846067 850500625 /nfs/dbraw/zinc/50/06/25/850500625.db2.gz CSQHRLDXNNDGCK-OAQYLSRUSA-N 2 0 414.638 4.323 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)c3cccc(C[NH+]4CCCC4)c3)cc2)CC1 ZINC000059951831 851027600 /nfs/dbraw/zinc/02/76/00/851027600.db2.gz XDKKBEVFUXQDRX-UHFFFAOYSA-N 2 0 405.586 4.444 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NC[C@@H](c3ccccc3)[NH+](C)C)cc2)CC1 ZINC000060954475 851257204 /nfs/dbraw/zinc/25/72/04/851257204.db2.gz YSCXKMBHAFBBRO-DEOSSOPVSA-N 2 0 408.590 4.021 20 0 HIADRP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000437037888 862227805 /nfs/dbraw/zinc/22/78/05/862227805.db2.gz JWJCVYHERJWOJG-BJKOFHAPSA-N 2 0 423.576 4.018 20 0 HIADRP CC[NH+](CC)Cc1cccc(NC(=S)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000063149096 851621344 /nfs/dbraw/zinc/62/13/44/851621344.db2.gz VHJFWNYNJHEOEW-UHFFFAOYSA-N 2 0 410.631 4.479 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1CC[NH+](CC2CCCC2)CC1)c1ccsc1 ZINC000063407952 851681191 /nfs/dbraw/zinc/68/11/91/851681191.db2.gz IRPMORWMPRMKKS-NRFANRHFSA-N 2 0 406.640 4.085 20 0 HIADRP Cc1c2ccccc2sc1C(=O)C(C(=S)NC1CC[NH+](C)CC1)[n+]1ccccc1 ZINC000063441742 851690792 /nfs/dbraw/zinc/69/07/92/851690792.db2.gz VWJHOJLIJWUCGF-UHFFFAOYSA-O 2 0 424.615 4.120 20 0 HIADRP CCc1cc[n+](C(C(=O)c2ccc(C(C)C)cc2)C(=S)NC2CC[NH+](C)CC2)cc1 ZINC000063441598 851691390 /nfs/dbraw/zinc/69/13/90/851691390.db2.gz ZJPDNXFDSQCQKD-UHFFFAOYSA-O 2 0 424.634 4.283 20 0 HIADRP O=C(NCCC[NH2+]C1CCCCC1)NCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000064237994 851855103 /nfs/dbraw/zinc/85/51/03/851855103.db2.gz XLJLYJBTYFBMIP-UHFFFAOYSA-N 2 0 400.611 4.174 20 0 HIADRP COc1ccc([C@@H](CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccccc2)[NH+]2CCCCC2)cc1 ZINC000072015392 852466929 /nfs/dbraw/zinc/46/69/29/852466929.db2.gz IZOSNSQLILUUIK-LOSJGSFVSA-N 2 0 421.585 4.003 20 0 HIADRP c1cn(-c2ccc(C[NH2+]Cc3cn(-c4ccccc4)nc3-c3ccncc3)cc2)cn1 ZINC000236584846 853900349 /nfs/dbraw/zinc/90/03/49/853900349.db2.gz JLRJYMZWFWBKFK-UHFFFAOYSA-N 2 0 406.493 4.410 20 0 HIADRP c1[nH]nc2cc(C[NH2+]Cc3ccccc3C[NH+]3CCN(c4ccccc4)CC3)ccc12 ZINC000236745181 853918424 /nfs/dbraw/zinc/91/84/24/853918424.db2.gz OUQWDIUPVOLXOB-UHFFFAOYSA-N 2 0 411.553 4.175 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccccc2OCC(F)(F)F)CC1 ZINC000236803670 853924651 /nfs/dbraw/zinc/92/46/51/853924651.db2.gz FWPPUHNBJJVHNY-UHFFFAOYSA-N 2 0 421.507 4.450 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)[C@@H](C)C1 ZINC000236866850 853930915 /nfs/dbraw/zinc/93/09/15/853930915.db2.gz RBLDDLAZENAVDK-PXNSSMCTSA-N 2 0 424.511 4.118 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2c(Cl)n(-c3ccccc3)nc2C(C)C)CC1 ZINC000236952809 853941540 /nfs/dbraw/zinc/94/15/40/853941540.db2.gz MKAKVBWJCBWMAP-LJQANCHMSA-N 2 0 418.029 4.012 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000236984603 853947634 /nfs/dbraw/zinc/94/76/34/853947634.db2.gz VROGLOPDAXKFHX-HNNXBMFYSA-N 2 0 420.916 4.380 20 0 HIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2cc(Cl)ccc2OC[C@@H]2CCCO2)ccc1F ZINC000237063190 853958714 /nfs/dbraw/zinc/95/87/14/853958714.db2.gz XDQZBYALDSGIRQ-FQEVSTJZSA-N 2 0 406.929 4.388 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2ccc(-c3cccc(F)c3)s2)cc1 ZINC000237177645 853976229 /nfs/dbraw/zinc/97/62/29/853976229.db2.gz KFEBBERFQCLULP-UHFFFAOYSA-N 2 0 411.546 4.135 20 0 HIADRP Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000237403580 854024613 /nfs/dbraw/zinc/02/46/13/854024613.db2.gz QKOSJPXMJITHGH-IAGOWNOFSA-N 2 0 422.976 4.011 20 0 HIADRP C[C@@H](C[NH2+]Cc1ccc(-c2ccccc2Br)s1)CN1CC[NH+](C)CC1 ZINC000237410473 854026766 /nfs/dbraw/zinc/02/67/66/854026766.db2.gz FPTBQXTXEIAVBS-INIZCTEOSA-N 2 0 422.436 4.151 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccccc2Br)C[C@@H](C)O1 ZINC000237412997 854026993 /nfs/dbraw/zinc/02/69/93/854026993.db2.gz MPBYHFFLVULCGK-IAGOWNOFSA-N 2 0 403.364 4.348 20 0 HIADRP C[C@H](C[NH2+]Cc1ccc(-c2cccc(Br)c2)s1)CN1CC[NH+](C)CC1 ZINC000237580012 854058762 /nfs/dbraw/zinc/05/87/62/854058762.db2.gz YQIZQISIROEXOB-MRXNPFEDSA-N 2 0 422.436 4.151 20 0 HIADRP Cc1noc(C)c1C[NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000237612907 854062914 /nfs/dbraw/zinc/06/29/14/854062914.db2.gz ICGJTYZIGBJDNZ-UHFFFAOYSA-N 2 0 410.484 4.002 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccccc2Br)C[C@H](C)O1 ZINC000237623558 854063517 /nfs/dbraw/zinc/06/35/17/854063517.db2.gz MPBYHFFLVULCGK-IRXDYDNUSA-N 2 0 403.364 4.348 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Br)cc2F)C[C@H](C)O1 ZINC000237621361 854063533 /nfs/dbraw/zinc/06/35/33/854063533.db2.gz LQKIMEXRZKFYGC-HOTGVXAUSA-N 2 0 421.354 4.487 20 0 HIADRP Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000237775947 854094924 /nfs/dbraw/zinc/09/49/24/854094924.db2.gz GOHLYCFKTSNCAY-PMACEKPBSA-N 2 0 404.558 4.284 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3c[nH]nc3-c3ccc(F)cc3)CC2)c1 ZINC000237855785 854108171 /nfs/dbraw/zinc/10/81/71/854108171.db2.gz WFHQGYMHAHGLOB-UHFFFAOYSA-N 2 0 421.564 4.216 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cc(-c4ccccc4)cs3)c2)C1 ZINC000237939797 854122818 /nfs/dbraw/zinc/12/28/18/854122818.db2.gz KAVIBVCZOGZHAJ-QFIPXVFZSA-N 2 0 419.594 4.402 20 0 HIADRP Cc1[nH+]c2ccc(Br)cc2c(NC2CC[NH+]([C@@H]3CCOC3)CC2)c1C ZINC000301873742 854481588 /nfs/dbraw/zinc/48/15/88/854481588.db2.gz LMPGLIYIJRYUCC-QGZVFWFLSA-N 2 0 404.352 4.279 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2CNc2cc[nH+]c3cc(C(F)(F)F)ccc23)C1 ZINC000302067692 854525585 /nfs/dbraw/zinc/52/55/85/854525585.db2.gz WTFDVWBKAQRZOS-GOSISDBHSA-N 2 0 401.432 4.432 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC000303135686 854778748 /nfs/dbraw/zinc/77/87/48/854778748.db2.gz AEGPQJCJMFTYSE-XMMPIXPASA-N 2 0 414.638 4.182 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1)c1ccccc1 ZINC000303249601 854835536 /nfs/dbraw/zinc/83/55/36/854835536.db2.gz MSKHEYPZRQLHTH-UGKGYDQZSA-N 2 0 411.565 4.283 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)[NH+]2CCCC2)o1 ZINC000303623612 855083573 /nfs/dbraw/zinc/08/35/73/855083573.db2.gz DOUCMQVIJGALDX-REWPJTCUSA-N 2 0 424.589 4.250 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NCC(C)(C)[N@@H+]2CCC[C@H](C)C2)CC1 ZINC000303647569 855103305 /nfs/dbraw/zinc/10/33/05/855103305.db2.gz JNLNIBQGPPTCNC-VQTJNVASSA-N 2 0 400.611 4.022 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000303689605 855135044 /nfs/dbraw/zinc/13/50/44/855135044.db2.gz MGQIXLLWXMHNDH-URXFXBBRSA-N 2 0 405.586 4.240 20 0 HIADRP CC(C)(C)OC(=O)N1CCC[C@H]([NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000309710184 855364196 /nfs/dbraw/zinc/36/41/96/855364196.db2.gz JAAARKXARXPWCX-XUZZJYLKSA-N 2 0 401.595 4.278 20 0 HIADRP C[C@@H]([NH2+]CC1CCN(C(=O)OC(C)(C)C)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000393945850 855469104 /nfs/dbraw/zinc/46/91/04/855469104.db2.gz QOOZLZHDBGGVTL-KNQAVFIVSA-N 2 0 401.595 4.134 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1 ZINC000410312686 855921618 /nfs/dbraw/zinc/92/16/18/855921618.db2.gz VDWKTGMAYKJBQG-UHFFFAOYSA-N 2 0 422.617 4.033 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)N[C@@H](C[NH+]2CCCC2)c2ccccc2)CC1 ZINC000410321258 855926572 /nfs/dbraw/zinc/92/65/72/855926572.db2.gz ALJFKDSALOFRPI-VWLOTQADSA-N 2 0 420.601 4.096 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)CC1 ZINC000410330804 855933484 /nfs/dbraw/zinc/93/34/84/855933484.db2.gz QCIREKNDIVPKPP-NHCUHLMSSA-N 2 0 414.638 4.017 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@H](c2ccccc2)[NH+](C)C)cc1 ZINC000410344082 855939219 /nfs/dbraw/zinc/93/92/19/855939219.db2.gz HIXXEGFBWFDCQK-HYBUGGRVSA-N 2 0 408.590 4.163 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)CC1 ZINC000410346933 855941874 /nfs/dbraw/zinc/94/18/74/855941874.db2.gz XXECVUSNXAVMNN-UHFFFAOYSA-N 2 0 414.638 4.182 20 0 HIADRP C[C@H]1CCC[NH+](Cc2ccc(CNC(=O)NCCCC[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000410357903 855947939 /nfs/dbraw/zinc/94/79/39/855947939.db2.gz GLNFJVYNMUOCJT-VXKWHMMOSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@H](c2ccccc2)[NH+](C)C)C1 ZINC000410367107 855955229 /nfs/dbraw/zinc/95/52/29/855955229.db2.gz JJCSDSPKMQOZEP-GBXCKJPGSA-N 2 0 408.590 4.021 20 0 HIADRP CC[C@H](CNC(=O)NCc1ccccc1C[N@H+](C)C(C)C)[NH+]1CCc2ccccc2C1 ZINC000410394509 855970664 /nfs/dbraw/zinc/97/06/64/855970664.db2.gz YUFIAPURBIGTCX-RUZDIDTESA-N 2 0 422.617 4.163 20 0 HIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3cc(-c4ccc(F)cc4)no3)CC2)C[C@@H](C)O1 ZINC000426778071 856472999 /nfs/dbraw/zinc/47/29/99/856472999.db2.gz UEJVRDDBBAHGEB-QZTJIDSGSA-N 2 0 401.526 4.192 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000428645624 857287719 /nfs/dbraw/zinc/28/77/19/857287719.db2.gz ZNKBAYAWPLPLTA-WIOPSUGQSA-N 2 0 419.613 4.316 20 0 HIADRP C[C@@H]([NH2+]C/C=C/C[NH2+][C@@H](C)[C@H]1OCCc2sccc21)[C@@H]1OCCc2sccc21 ZINC000429124959 857521776 /nfs/dbraw/zinc/52/17/76/857521776.db2.gz XQOWHFFXKUUUQA-GHLWTNBRSA-N 2 0 418.628 4.250 20 0 HIADRP c1ccc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c(C[NH+]2CCOC[C@@H](C3CCC3)C2)c1 ZINC000429262585 857580925 /nfs/dbraw/zinc/58/09/25/857580925.db2.gz URJLHBYZVHTLLC-WMPKNSHKSA-N 2 0 412.618 4.184 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)c2ccc(C[NH+]3CCSCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000430628162 858240610 /nfs/dbraw/zinc/24/06/10/858240610.db2.gz OGVDYDPGDPQQFZ-YKSBVNFPSA-N 2 0 423.626 4.018 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)c2oc3ccccc3c2C[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000430642078 858244279 /nfs/dbraw/zinc/24/42/79/858244279.db2.gz UPZXOBRNGVKJCA-UYAOXDASSA-N 2 0 405.542 4.277 20 0 HIADRP O=C(NC[C@H]1CCC[N@@H+]1C1CCCCC1)NC[C@H]1CCC[NH+](Cc2cccs2)C1 ZINC000437664545 863005522 /nfs/dbraw/zinc/00/55/22/863005522.db2.gz DOSBZDOIHQVKRT-TZIWHRDSSA-N 2 0 418.651 4.056 20 0 HIADRP Cc1cccc(CN(CC[NH+](C)C)C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000431673775 858730183 /nfs/dbraw/zinc/73/01/83/858730183.db2.gz POKCJQMLMORXMO-RDGATRHJSA-N 2 0 422.617 4.121 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccco1 ZINC000431697477 858746068 /nfs/dbraw/zinc/74/60/68/858746068.db2.gz IDZALAPNPQKZNV-CEMLEFRQSA-N 2 0 412.578 4.015 20 0 HIADRP COC[C@H]1CCCC[NH+](Cc2cc(C[N@H+]3CCCC[C@H](COC)C3)cc(OC)c2)C1 ZINC000432784019 859358091 /nfs/dbraw/zinc/35/80/91/859358091.db2.gz DUQAEYIIFTZCJP-VXKWHMMOSA-N 2 0 418.622 4.192 20 0 HIADRP C[C@H](C(=O)c1c[nH]c2ncccc12)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433043477 859496947 /nfs/dbraw/zinc/49/69/47/859496947.db2.gz FDZYRISYXHAXMI-LJQANCHMSA-N 2 0 402.542 4.122 20 0 HIADRP COc1cccc(NC(=O)CC[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000433124440 859529728 /nfs/dbraw/zinc/52/97/28/859529728.db2.gz CKABUYZEDYCDQU-UHFFFAOYSA-N 2 0 407.558 4.012 20 0 HIADRP CSc1ccc(NC(=O)C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000433126795 859530888 /nfs/dbraw/zinc/53/08/88/859530888.db2.gz PVDONVHJYWWPHI-UHFFFAOYSA-N 2 0 409.599 4.335 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)N(CC[NH+](C)C)Cc2cccs2)CC1 ZINC000439294606 864719921 /nfs/dbraw/zinc/71/99/21/864719921.db2.gz LSMXXZWETJINPL-IBGZPJMESA-N 2 0 414.619 4.047 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NC2CC[NH+]([C@H](C)c3ccncc3)CC2)cc1 ZINC000439734743 865068099 /nfs/dbraw/zinc/06/80/99/865068099.db2.gz QNOSGLVQBIHSMU-HXUWFJFHSA-N 2 0 408.590 4.269 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCC([NH+]2CCCCC2)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000468030715 881863589 /nfs/dbraw/zinc/86/35/89/881863589.db2.gz RBSYQYVFKQLLSZ-FYYLOGMGSA-N 2 0 414.638 4.412 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000440535716 865807932 /nfs/dbraw/zinc/80/79/32/865807932.db2.gz SLLCICLYNBJYJZ-IZZNHLLZSA-N 2 0 419.613 4.269 20 0 HIADRP CC(C)[NH+]1CCC(N2CC[NH+](CC/C=C\c3ccc(Br)cc3)CC2)CC1 ZINC000441057574 866135208 /nfs/dbraw/zinc/13/52/08/866135208.db2.gz QUPFFIDOIZIQBV-HYXAFXHYSA-N 2 0 420.439 4.343 20 0 HIADRP CC(C)[NH+]1CCC(N2CC[NH+](CCOC(c3ccccc3)c3ccccc3)CC2)CC1 ZINC000441090093 866186166 /nfs/dbraw/zinc/18/61/66/866186166.db2.gz LPDGIFFVFYSVDF-UHFFFAOYSA-N 2 0 421.629 4.283 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1(C)C ZINC000441346395 866417404 /nfs/dbraw/zinc/41/74/04/866417404.db2.gz JQOLGVMICVCHAB-UHFFFAOYSA-N 2 0 418.029 4.074 20 0 HIADRP Cc1ccc([C@H](OC[C@H](O)C[N@H+](C)CC[C@H]2CCCC[NH+]2C)c2ccccc2)cc1 ZINC000441365457 866433875 /nfs/dbraw/zinc/43/38/75/866433875.db2.gz PZLFIQCCZDJUHU-TWJOJJKGSA-N 2 0 410.602 4.268 20 0 HIADRP O=C(CN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)N(Cc1ccccc1)c1ccccc1 ZINC000441401349 866475051 /nfs/dbraw/zinc/47/50/51/866475051.db2.gz MGHCINRITXPMFR-RDGATRHJSA-N 2 0 403.570 4.169 20 0 HIADRP O=C(CN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)N(Cc1ccccc1)c1ccccc1 ZINC000441401346 866475732 /nfs/dbraw/zinc/47/57/32/866475732.db2.gz MGHCINRITXPMFR-RCZVLFRGSA-N 2 0 403.570 4.169 20 0 HIADRP O[C@H](COc1ccc(Oc2ccccc2)cc1)C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441412903 866486133 /nfs/dbraw/zinc/48/61/33/866486133.db2.gz PQWDMFDQNSXLFR-YBXDKENTSA-N 2 0 422.569 4.167 20 0 HIADRP C[C@H](OC[C@@H](O)C[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(Cl)cc1 ZINC000441623156 866720383 /nfs/dbraw/zinc/72/03/83/866720383.db2.gz SVKBSZYIJJJSIJ-LEEZEASISA-N 2 0 416.993 4.232 20 0 HIADRP C[NH+](C)CCC1CC[NH+](Cc2ccnc(-c3ccc(Br)cc3)n2)CC1 ZINC000441916259 866982576 /nfs/dbraw/zinc/98/25/76/866982576.db2.gz DFMFOFQYKQVFHX-UHFFFAOYSA-N 2 0 403.368 4.070 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+][C@H]3CC[C@H](c4ccc(C(F)(F)F)cc4)C3)CC2)CC1 ZINC000442784110 867673651 /nfs/dbraw/zinc/67/36/51/867673651.db2.gz SJPCUJFMEPOYOY-RXVVDRJESA-N 2 0 409.540 4.490 20 0 HIADRP CC[N@H+](Cc1c[nH]c2ccccc12)[C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000442895431 867725942 /nfs/dbraw/zinc/72/59/42/867725942.db2.gz UWQVNJNQCYWKSP-HXUWFJFHSA-N 2 0 418.585 4.159 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c(OCc2cccnc2)c1 ZINC000444005343 868528802 /nfs/dbraw/zinc/52/88/02/868528802.db2.gz WLKBYMGUXCOAOC-UHFFFAOYSA-N 2 0 409.505 4.160 20 0 HIADRP CN(CC1([NH+](C)C)CCC1)C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000446127490 870071740 /nfs/dbraw/zinc/07/17/40/870071740.db2.gz RPAJGVOAJIGKIX-UHFFFAOYSA-N 2 0 400.611 4.077 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@H](c1cccc(C(F)(F)F)c1)[NH+](C)C ZINC000446576790 870487670 /nfs/dbraw/zinc/48/76/70/870487670.db2.gz IGEWZBMZIBWOCZ-HXUWFJFHSA-N 2 0 422.495 4.234 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)Nc2ccccc2CC[NH+](C)C)c2ccccc2)CC1 ZINC000446578095 870489338 /nfs/dbraw/zinc/48/93/38/870489338.db2.gz ZCLXNVUFZSUEAA-DEOSSOPVSA-N 2 0 408.590 4.385 20 0 HIADRP C[C@H](C[NH2+][C@@H](c1ccc(Br)cc1Cl)C1CC1)CN1CC[NH+](C)CC1 ZINC000446817926 870732719 /nfs/dbraw/zinc/73/27/19/870732719.db2.gz LEFSUENMLBQXCD-AUUYWEPGSA-N 2 0 414.819 4.027 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCC(O)CC3)cc1)CCCS2 ZINC000446832244 870747947 /nfs/dbraw/zinc/74/79/47/870747947.db2.gz NUQBWDXNFUWCPE-HSZRJFAPSA-N 2 0 412.599 4.369 20 0 HIADRP COc1ccc([C@H](CCn2cncn2)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1 ZINC000446938553 870848560 /nfs/dbraw/zinc/84/85/60/870848560.db2.gz WYILERGOGDQUMN-IWAAJCSBSA-N 2 0 411.594 4.051 20 0 HIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c2ccccc21 ZINC000447531210 871394461 /nfs/dbraw/zinc/39/44/61/871394461.db2.gz QGMSLAAXSOBIMJ-GVXSCFBNSA-N 2 0 405.586 4.358 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000448221103 872130503 /nfs/dbraw/zinc/13/05/03/872130503.db2.gz WCCLPDYQMJRUGH-NOZRDPDXSA-N 2 0 424.633 4.221 20 0 HIADRP Cc1ccccc1Sc1ccc(C(=O)N(C)CC[N@H+](C)C2CCN(C)CC2)cc1 ZINC000448246894 872164884 /nfs/dbraw/zinc/16/48/84/872164884.db2.gz GPPHZDMQHKOZFR-UHFFFAOYSA-N 2 0 411.615 4.244 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCCCC2)cc1)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000448409303 872362076 /nfs/dbraw/zinc/36/20/76/872362076.db2.gz FECUIFLFWAVQLX-URXFXBBRSA-N 2 0 410.606 4.196 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](CNC(=O)N(C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000448474354 872454709 /nfs/dbraw/zinc/45/47/09/872454709.db2.gz VVVBKTISIVXQKB-JRFVFWCSSA-N 2 0 414.638 4.049 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)[C@@H](C)C1 ZINC000448524015 872515453 /nfs/dbraw/zinc/51/54/53/872515453.db2.gz CYFBAVYLVKSKMZ-ONTIZHBOSA-N 2 0 400.611 4.022 20 0 HIADRP CN1CCC(CNC(=O)c2ccc(OC3CCCCC3)cc2)([NH+]2CCCCC2)CC1 ZINC000460483861 873169401 /nfs/dbraw/zinc/16/94/01/873169401.db2.gz UAPZXLPGKMVAEQ-UHFFFAOYSA-N 2 0 413.606 4.078 20 0 HIADRP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccc(Cl)c1F ZINC000461105525 874024612 /nfs/dbraw/zinc/02/46/12/874024612.db2.gz XQXMVHNJFGBHSP-GHTZIAJQSA-N 2 0 417.956 4.417 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)N1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000461435174 874486163 /nfs/dbraw/zinc/48/61/63/874486163.db2.gz VXRQFFVTEMANDU-RTWAWAEBSA-N 2 0 417.553 4.089 20 0 HIADRP O=C(NC[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccc(C[NH+]2CCCC2)cc1 ZINC000461469245 874525514 /nfs/dbraw/zinc/52/55/14/874525514.db2.gz WCAJIZRMUBUYLV-DEOSSOPVSA-N 2 0 405.586 4.315 20 0 HIADRP Cc1c([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cnn1C(C)(C)C ZINC000468835339 882883293 /nfs/dbraw/zinc/88/32/93/882883293.db2.gz FVZXNUXIINEJGY-SJORKVTESA-N 2 0 401.574 4.249 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)c1)C1CCOCC1 ZINC000462031117 875147696 /nfs/dbraw/zinc/14/76/96/875147696.db2.gz CUEWHMXNXLVWDU-JOCHJYFZSA-N 2 0 414.977 4.087 20 0 HIADRP C[NH+]1CCC(C[NH2+]Cc2c(OC(F)F)ccc3ccccc32)(N2CCCCC2)CC1 ZINC000462733045 875807315 /nfs/dbraw/zinc/80/73/15/875807315.db2.gz GPSVJIQYOBRERS-UHFFFAOYSA-N 2 0 417.544 4.481 20 0 HIADRP CC(=O)NC1CCC([NH2+][C@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)CC1 ZINC000462818649 875858620 /nfs/dbraw/zinc/85/86/20/875858620.db2.gz KCUWMKTZNRCEDT-KXTRFFEISA-N 2 0 403.586 4.416 20 0 HIADRP C[C@@H]1C[C@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)CCN1Cc1ccccc1 ZINC000463074209 876105763 /nfs/dbraw/zinc/10/57/63/876105763.db2.gz AWIDDDGQLFGCAO-AOYPEHQESA-N 2 0 420.645 4.232 20 0 HIADRP COc1ccc(Cn2nc(C)c(C[NH2+]Cc3ccc(C[NH+](C)C)c(F)c3)c2C)cc1 ZINC000463747131 876869947 /nfs/dbraw/zinc/86/99/47/876869947.db2.gz UAHXEODGMYMAFH-UHFFFAOYSA-N 2 0 410.537 4.047 20 0 HIADRP O=C(C[N@@H+]1CC[C@@H](CSc2ccccc2)C1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000464763940 878006395 /nfs/dbraw/zinc/00/63/95/878006395.db2.gz DORGIIOOROOSDO-HSZRJFAPSA-N 2 0 423.626 4.013 20 0 HIADRP C[N@H+](C[C@H](O)COc1ccc(Cl)cc1Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464834863 878096677 /nfs/dbraw/zinc/09/66/77/878096677.db2.gz HNICKRCXKSBKBP-ICSRJNTNSA-N 2 0 423.384 4.187 20 0 HIADRP C[N@H+](C[C@@H](O)COc1c(Cl)cccc1Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464853496 878132661 /nfs/dbraw/zinc/13/26/61/878132661.db2.gz RZGHZVQBJMNUTP-RBUKOAKNSA-N 2 0 423.384 4.187 20 0 HIADRP C[C@H]1CCN(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000465398075 878834563 /nfs/dbraw/zinc/83/45/63/878834563.db2.gz AZVYXGZTMBZECG-JTHBVZDNSA-N 2 0 424.589 4.113 20 0 HIADRP C[C@@H]1CCN(C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000465444451 878876175 /nfs/dbraw/zinc/87/61/75/878876175.db2.gz RDKDLIBNVUASAB-RDGATRHJSA-N 2 0 420.601 4.130 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCc1ccc(C[NH+]3CCCC[C@H]3C)cc1)CC2 ZINC000465554176 879021051 /nfs/dbraw/zinc/02/10/51/879021051.db2.gz TUHAWHCYTZKCEF-HUVFLSCGSA-N 2 0 412.622 4.218 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@]1([NH+](C)C)CCC[C@@H](C)C1 ZINC000465715874 879288435 /nfs/dbraw/zinc/28/84/35/879288435.db2.gz VNOIYGUMXCJUJS-PFATUAPWSA-N 2 0 414.638 4.051 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)[NH+](C)C)cc1 ZINC000465811487 879431348 /nfs/dbraw/zinc/43/13/48/879431348.db2.gz JNMUTRLJBFCCOS-URVUXULASA-N 2 0 414.619 4.042 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000465923920 879586045 /nfs/dbraw/zinc/58/60/45/879586045.db2.gz RVCBPNWMYWMMHI-FYYLOGMGSA-N 2 0 422.617 4.279 20 0 HIADRP CC1CCC([NH+]2CCN(C(=O)NC[C@H]3CCC[N@H+](C)[C@H]3c3cccs3)CC2)CC1 ZINC000466084511 879803238 /nfs/dbraw/zinc/80/32/38/879803238.db2.gz ZUHYLHDONYXEPZ-ZKNLVJASSA-N 2 0 418.651 4.037 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000466507548 880282188 /nfs/dbraw/zinc/28/21/88/880282188.db2.gz XDZGUJNIEOTSQM-CZSZKKDXSA-N 2 0 420.601 4.174 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NCc2ccc(CC[NH+](C)C)cc2)cc1 ZINC000466971898 880773194 /nfs/dbraw/zinc/77/31/94/880773194.db2.gz AUAYGIDKIXMPQD-NRFANRHFSA-N 2 0 422.617 4.165 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)NCc3ccc(CC[NH+](C)C)cc3)cc2)C1 ZINC000466976239 880779641 /nfs/dbraw/zinc/77/96/41/880779641.db2.gz TZOZXTBTBSBLFN-OAQYLSRUSA-N 2 0 422.617 4.022 20 0 HIADRP C[NH+](C)CCc1ccc(CNC(=O)NCc2ccccc2C[NH+]2CCCCCC2)cc1 ZINC000467014263 880817838 /nfs/dbraw/zinc/81/78/38/880817838.db2.gz QYZCGLICESDADQ-UHFFFAOYSA-N 2 0 422.617 4.166 20 0 HIADRP CC[NH+](CC)CCOC1CCN(c2cc(C)[nH+]c3ccc(OC(F)F)cc32)CC1 ZINC000467019403 880821834 /nfs/dbraw/zinc/82/18/34/880821834.db2.gz XWZHXBIXVFMLSQ-UHFFFAOYSA-N 2 0 407.505 4.472 20 0 HIADRP CCN(C(=O)NCc1ccc(CC[NH+](C)C)cc1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000467096577 880859876 /nfs/dbraw/zinc/85/98/76/880859876.db2.gz ZJPHCVPTIHEGER-OFVILXPXSA-N 2 0 422.617 4.158 20 0 HIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000467358140 881120592 /nfs/dbraw/zinc/12/05/92/881120592.db2.gz MDBLWQLZFQPLQZ-QGZVFWFLSA-N 2 0 406.492 4.383 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C(=O)Nc3ccccc3)cc2)[C@@H](C)C1 ZINC000469769260 883943307 /nfs/dbraw/zinc/94/33/07/883943307.db2.gz OHGRMPRDZRQQNM-GBXCKJPGSA-N 2 0 409.574 4.166 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000503766309 912818872 /nfs/dbraw/zinc/81/88/72/912818872.db2.gz RPLUSJZYGPEDDD-NRFANRHFSA-N 2 0 422.617 4.422 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000503936826 912872400 /nfs/dbraw/zinc/87/24/00/912872400.db2.gz MKXJIKLBEIUPDW-UHFFFAOYSA-N 2 0 418.585 4.429 20 0 HIADRP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@H]1CCCC[NH+]1Cc1ccccc1 ZINC000470543710 884950405 /nfs/dbraw/zinc/95/04/05/884950405.db2.gz OCXQAJGHDIPCCN-JWQCQUIFSA-N 2 0 405.586 4.022 20 0 HIADRP CC[C@H](c1ccc(F)cc1)[NH+]1CCC(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1 ZINC000471220345 885793372 /nfs/dbraw/zinc/79/33/72/885793372.db2.gz NIOUYFQAAVBFCC-XMMPIXPASA-N 2 0 411.565 4.237 20 0 HIADRP CCN(C(=O)NC[C@H](c1cccs1)[NH+](C)C)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000471374868 886015720 /nfs/dbraw/zinc/01/57/20/886015720.db2.gz UDZDNRFNOMXPFA-SESVDKBCSA-N 2 0 414.619 4.218 20 0 HIADRP CN(c1ccccc1C[NH2+]CCc1ccccc1OC(F)F)C1CC[NH+](C)CC1 ZINC000471545197 886252578 /nfs/dbraw/zinc/25/25/78/886252578.db2.gz FJKFZUVBIHAFGR-UHFFFAOYSA-N 2 0 403.517 4.151 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000471596433 886310122 /nfs/dbraw/zinc/31/01/22/886310122.db2.gz LKNHTTCWSMEPOV-VQIMIIECSA-N 2 0 419.038 4.457 20 0 HIADRP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000472138342 886931382 /nfs/dbraw/zinc/93/13/82/886931382.db2.gz LYQSRZULQWADDT-VWNXMTODSA-N 2 0 405.586 4.168 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000472378377 887219333 /nfs/dbraw/zinc/21/93/33/887219333.db2.gz COGZBVCUOVDMIP-DEOSSOPVSA-N 2 0 414.638 4.052 20 0 HIADRP C[C@@H](CCNC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)Cc1ccccc1 ZINC000473019688 887844966 /nfs/dbraw/zinc/84/49/66/887844966.db2.gz HJXWLOIICVZWLZ-WIOPSUGQSA-N 2 0 422.617 4.061 20 0 HIADRP c1ccc2c(c1)CO[C@@]21CC[NH+](CCCCC[N@@H+]2CC[C@]3(C2)OCc2ccccc23)C1 ZINC000473154064 887933471 /nfs/dbraw/zinc/93/34/71/887933471.db2.gz ZEBJRFKVQOVLMI-KAYWLYCHSA-N 2 0 418.581 4.420 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)NC2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC000473730887 888509567 /nfs/dbraw/zinc/50/95/67/888509567.db2.gz BHMWYXGADQLQPI-NOTZXAQLSA-N 2 0 400.611 4.123 20 0 HIADRP CCN(C(=O)NCc1cccc(C[NH+](C)C)c1)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473943890 888820353 /nfs/dbraw/zinc/82/03/53/888820353.db2.gz IVQQYCYQBWCORH-HYBUGGRVSA-N 2 0 408.590 4.115 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)C1CCC(F)(F)CC1 ZINC000474053497 888891801 /nfs/dbraw/zinc/89/18/01/888891801.db2.gz PFNMECJTEAZKNA-GOSISDBHSA-N 2 0 410.549 4.480 20 0 HIADRP O=C(NC[C@H]1CCCC[N@H+]1Cc1cccc(Cl)c1)NC1CC([NH+]2CCCCC2)C1 ZINC000474347972 889224502 /nfs/dbraw/zinc/22/45/02/889224502.db2.gz MHPCBFPJJBZLNT-ATKRNPRHSA-N 2 0 419.013 4.011 20 0 HIADRP Brc1ccc(C[NH2+]CCCCC[NH+]2CCCCC2)c(N2CCOCC2)c1 ZINC000474362708 889241204 /nfs/dbraw/zinc/24/12/04/889241204.db2.gz KGFGMIIKAICMFL-UHFFFAOYSA-N 2 0 424.427 4.032 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)cc2-n2cncn2)C1 ZINC000474471774 889335152 /nfs/dbraw/zinc/33/51/52/889335152.db2.gz NUMRWQIYJPCNIF-SFHVURJKSA-N 2 0 409.965 4.442 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)C1CCOCC1 ZINC000474478516 889338307 /nfs/dbraw/zinc/33/83/07/889338307.db2.gz PNFOJACHNGQFJQ-SFHVURJKSA-N 2 0 413.528 4.012 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)[C@@H](C)c3nc4ccccc4s3)cn2)CC1 ZINC000474483210 889342793 /nfs/dbraw/zinc/34/27/93/889342793.db2.gz UCAWZVSMNOHFAM-QZTJIDSGSA-N 2 0 409.603 4.115 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)[C@H](C)c3nc4ccccc4s3)cn2)CC1 ZINC000474483212 889343878 /nfs/dbraw/zinc/34/38/78/889343878.db2.gz UCAWZVSMNOHFAM-ZWKOTPCHSA-N 2 0 409.603 4.115 20 0 HIADRP C[C@@H](CC[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1)OCc1ccccc1 ZINC000475038909 889890566 /nfs/dbraw/zinc/89/05/66/889890566.db2.gz MZCBGJIZLRYZEP-QFIPXVFZSA-N 2 0 401.639 4.110 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475282716 890179876 /nfs/dbraw/zinc/17/98/76/890179876.db2.gz GEPKEWNYGBWEMK-PZJWPPBQSA-N 2 0 413.993 4.189 20 0 HIADRP O=C(NCC1CC[NH+](Cc2cccs2)CC1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000475307016 890219152 /nfs/dbraw/zinc/21/91/52/890219152.db2.gz XHYQVNWLZVQYBM-UHFFFAOYSA-N 2 0 418.651 4.056 20 0 HIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC(NC3CC([NH+]4CCC(C(F)(F)F)CC4)C3)CC2)C1 ZINC000475353762 890278416 /nfs/dbraw/zinc/27/84/16/890278416.db2.gz LGRPHFUPNOSBCH-GXVGGZGZSA-N 2 0 401.561 4.424 20 0 HIADRP C[C@H]1CCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000475994079 890915319 /nfs/dbraw/zinc/91/53/19/890915319.db2.gz AICDKMOBTZBSJB-NRFANRHFSA-N 2 0 412.622 4.090 20 0 HIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000476775939 891750675 /nfs/dbraw/zinc/75/06/75/891750675.db2.gz JIMSEBNJGSCOHX-HHXXYDBFSA-N 2 0 413.528 4.371 20 0 HIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000476775937 891751305 /nfs/dbraw/zinc/75/13/05/891751305.db2.gz JIMSEBNJGSCOHX-AYBZRNKSSA-N 2 0 413.528 4.371 20 0 HIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000476775942 891751496 /nfs/dbraw/zinc/75/14/96/891751496.db2.gz JIMSEBNJGSCOHX-SZVBFZGTSA-N 2 0 413.528 4.371 20 0 HIADRP C[C@H](C(=O)NCCc1c[nH]c2ccccc12)[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000476990646 891915961 /nfs/dbraw/zinc/91/59/61/891915961.db2.gz ADEHUUFJASEDBK-NHCUHLMSSA-N 2 0 424.633 4.192 20 0 HIADRP C[NH+](C)CCOc1ccc(CC[NH2+][C@@H]2CCCc3nn(-c4ccccc4)cc32)cc1 ZINC000479064331 894326720 /nfs/dbraw/zinc/32/67/20/894326720.db2.gz DWOOPJQSDQVQHO-XMMPIXPASA-N 2 0 404.558 4.022 20 0 HIADRP CC[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479069477 894331883 /nfs/dbraw/zinc/33/18/83/894331883.db2.gz YOFVEENBXVUFHF-CXAGYDPISA-N 2 0 422.333 4.145 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccccc1)c1ccc(Br)cc1 ZINC000479298929 894583868 /nfs/dbraw/zinc/58/38/68/894583868.db2.gz WYELCMBPHRLNAR-YADHBBJMSA-N 2 0 417.391 4.365 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CC(C)(C)c3ccc(Br)cc32)CC1 ZINC000479329675 894621071 /nfs/dbraw/zinc/62/10/71/894621071.db2.gz HABIAPIXNRZDHC-FQEVSTJZSA-N 2 0 408.428 4.179 20 0 HIADRP CC[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479340811 894633965 /nfs/dbraw/zinc/63/39/65/894633965.db2.gz DLAXJJKAICXPJX-QGZVFWFLSA-N 2 0 422.333 4.146 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1cc(F)ccc1F ZINC000479394005 894697356 /nfs/dbraw/zinc/69/73/56/894697356.db2.gz NGGWHWJSGSLHOM-QHCPKHFHSA-N 2 0 415.528 4.277 20 0 HIADRP CC1(C)C[C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)c2cc(Br)ccc21 ZINC000479407723 894714257 /nfs/dbraw/zinc/71/42/57/894714257.db2.gz BSDRPKFARAXZRB-SLFFLAALSA-N 2 0 407.396 4.139 20 0 HIADRP CC1(C)C[C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)c2cc(Br)ccc21 ZINC000479407726 894715604 /nfs/dbraw/zinc/71/56/04/894715604.db2.gz BSDRPKFARAXZRB-UFYCRDLUSA-N 2 0 407.396 4.139 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@H](c2ccsc2)[NH+](C)C)CC1 ZINC000479447781 894765160 /nfs/dbraw/zinc/76/51/60/894765160.db2.gz CQISFPHMUMEJRV-WIYYLYMNSA-N 2 0 406.640 4.037 20 0 HIADRP O=C([C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000505253858 913908248 /nfs/dbraw/zinc/90/82/48/913908248.db2.gz JBBVERGDMGAXAP-QHCPKHFHSA-N 2 0 415.597 4.152 20 0 HIADRP Cc1cc(NC(=O)Nc2cccc(C[NH+](C)C)c2)cc(N2CC[NH+](C(C)C)CC2)c1 ZINC000479553555 894852168 /nfs/dbraw/zinc/85/21/68/894852168.db2.gz PUGNKMXAOHHMNH-UHFFFAOYSA-N 2 0 409.578 4.231 20 0 HIADRP CC(C)(CC[NH+]1CCCCCC1)NC(=O)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000480057670 895404604 /nfs/dbraw/zinc/40/46/04/895404604.db2.gz QQQGEBLHDMBKQF-UHFFFAOYSA-N 2 0 403.636 4.010 20 0 HIADRP COc1cccc([C@H](CN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)[NH+]2CCCC2)c1 ZINC000480083152 895441483 /nfs/dbraw/zinc/44/14/83/895441483.db2.gz ORJSVFMXUUPDLW-BYXVTNLJSA-N 2 0 407.602 4.332 20 0 HIADRP C[NH+]1CCN(CCC[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000480159665 895546473 /nfs/dbraw/zinc/54/64/73/895546473.db2.gz DHYLIOLHCNFBTO-GOSISDBHSA-N 2 0 405.011 4.068 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)[C@@H](C)C1 ZINC000480264559 895672157 /nfs/dbraw/zinc/67/21/57/895672157.db2.gz VYOQRNKDZWEXQJ-DHLKQENFSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000480539809 895902103 /nfs/dbraw/zinc/90/21/03/895902103.db2.gz LIIMVZYPLQHFTE-ZDUSSCGKSA-N 2 0 411.434 4.401 20 0 HIADRP Cc1c([C@H](C)[NH2+]C2CCN(CC[NH+](C)C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000480546460 895906945 /nfs/dbraw/zinc/90/69/45/895906945.db2.gz GMPXWKTUDWTBDA-HNNXBMFYSA-N 2 0 424.420 4.164 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000480603657 895967699 /nfs/dbraw/zinc/96/76/99/895967699.db2.gz DZOIPCBWRLOZBZ-LPHOPBHVSA-N 2 0 419.038 4.457 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3CCN(Cc4ccccn4)C[C@@H]3C)cc2)C1 ZINC000480603856 895967762 /nfs/dbraw/zinc/96/77/62/895967762.db2.gz CLBIAALPNGHHAI-TVZXLZGTSA-N 2 0 406.618 4.314 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480614664 895981054 /nfs/dbraw/zinc/98/10/54/895981054.db2.gz VMRVLBJSESFOHQ-RBUKOAKNSA-N 2 0 415.603 4.141 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1ccc(NS(C)(=O)=O)cc1 ZINC000480615728 895982106 /nfs/dbraw/zinc/98/21/06/895982106.db2.gz UQLVENUWUIBCGA-OALUTQOASA-N 2 0 415.603 4.283 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@H]2C)C1 ZINC000480621962 895990095 /nfs/dbraw/zinc/99/00/95/895990095.db2.gz UQNLPBRDFQTAHE-XLGIIRLISA-N 2 0 406.618 4.314 20 0 HIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480630934 896000831 /nfs/dbraw/zinc/00/08/31/896000831.db2.gz LVPVLPSVFRWCIA-RTWAWAEBSA-N 2 0 421.651 4.024 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000480638100 896007706 /nfs/dbraw/zinc/00/77/06/896007706.db2.gz HJGOIEWUYCCRQI-UONOGXRCSA-N 2 0 411.434 4.401 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480641870 896010725 /nfs/dbraw/zinc/01/07/25/896010725.db2.gz MAPAIWUMGUXGCB-ZWKOTPCHSA-N 2 0 418.578 4.454 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480645110 896013882 /nfs/dbraw/zinc/01/38/82/896013882.db2.gz RNPRRXCAESENPR-NRFANRHFSA-N 2 0 421.651 4.024 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+]Cc2cc(Br)c(Cl)s2)c1 ZINC000480664226 896031754 /nfs/dbraw/zinc/03/17/54/896031754.db2.gz MSUDSIYNBKRBLH-UHFFFAOYSA-N 2 0 403.773 4.394 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H](Cc3cccc(F)c3)c3cccc(F)c3)ccn2)CC1 ZINC000480711652 896072477 /nfs/dbraw/zinc/07/24/77/896072477.db2.gz QSSTZLKPUQLKEC-XMMPIXPASA-N 2 0 422.523 4.185 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3ccc(SC)c(OC)c3)cc2)CC1 ZINC000480722322 896082832 /nfs/dbraw/zinc/08/28/32/896082832.db2.gz OVRQOJRAWBMCRA-LJQANCHMSA-N 2 0 413.631 4.405 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000480767353 896128870 /nfs/dbraw/zinc/12/88/70/896128870.db2.gz GXQQVUXQQFBOKM-GOSISDBHSA-N 2 0 400.394 4.214 20 0 HIADRP CC[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1cnn(C)c1 ZINC000480781521 896145973 /nfs/dbraw/zinc/14/59/73/896145973.db2.gz UTEFUFHAOXKNQZ-NRFANRHFSA-N 2 0 423.527 4.082 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccc(OC(F)(F)F)c1 ZINC000480885713 896241546 /nfs/dbraw/zinc/24/15/46/896241546.db2.gz WNKXFFDOWWQVAQ-KRWDZBQOSA-N 2 0 407.480 4.183 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cc(Cl)ccc1OC ZINC000480899639 896254536 /nfs/dbraw/zinc/25/45/36/896254536.db2.gz PYWRESDUQALQPL-JOCHJYFZSA-N 2 0 401.982 4.337 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(-c2ccncc2)cc1 ZINC000480907205 896263460 /nfs/dbraw/zinc/26/34/60/896263460.db2.gz INFIUOIGZBXCCJ-NRFANRHFSA-N 2 0 400.570 4.347 20 0 HIADRP CC(C)(C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccnc1)C[NH+]1CCCC1 ZINC000480927972 896281864 /nfs/dbraw/zinc/28/18/64/896281864.db2.gz OCIBVNLEAQLEOH-UHFFFAOYSA-N 2 0 403.574 4.205 20 0 HIADRP O=C(NCCC[NH+](Cc1ccccc1)Cc1ccccc1)N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000481065898 896387524 /nfs/dbraw/zinc/38/75/24/896387524.db2.gz ZCLSRRBCWRHGOJ-RPBOFIJWSA-N 2 0 420.601 4.005 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCCOc3ccc(Br)cc32)cc1 ZINC000481306479 896653006 /nfs/dbraw/zinc/65/30/06/896653006.db2.gz IBVQCDGGWVNPQB-FQEVSTJZSA-N 2 0 419.363 4.393 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2cccc(CN3CCOCC3)c2)cnn1-c1cc(C)ccc1C ZINC000481311870 896658943 /nfs/dbraw/zinc/65/89/43/896658943.db2.gz LLKFXAQEQCNGKS-NRFANRHFSA-N 2 0 418.585 4.481 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H](O)COc1cccc(Cl)c1Cl ZINC000481532490 896894386 /nfs/dbraw/zinc/89/43/86/896894386.db2.gz JQQCKNUWQMQAMI-YVWKXTFCSA-N 2 0 423.384 4.233 20 0 HIADRP Cc1cc(NCc2cccc(OCC[N@@H+](C)C3CCOCC3)c2)c2cc(F)ccc2[nH+]1 ZINC000481684286 897067528 /nfs/dbraw/zinc/06/75/28/897067528.db2.gz LDWCXXXCVAYMNS-UHFFFAOYSA-N 2 0 423.532 4.206 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1Br ZINC000481719472 897113754 /nfs/dbraw/zinc/11/37/54/897113754.db2.gz DEACXXACZBSVRB-HNNXBMFYSA-N 2 0 407.352 4.249 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCCOc2cc(Br)ccc21 ZINC000481746792 897140682 /nfs/dbraw/zinc/14/06/82/897140682.db2.gz QUHPRHMYWRIQOO-LJQANCHMSA-N 2 0 419.363 4.393 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H]1CCC(C)(C)c2ccc(Br)cc21 ZINC000482000117 897397189 /nfs/dbraw/zinc/39/71/89/897397189.db2.gz RGHRCIDXNJNGIK-UZLBHIALSA-N 2 0 408.428 4.177 20 0 HIADRP C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000482228746 897707489 /nfs/dbraw/zinc/70/74/89/897707489.db2.gz DMGRSJVGTLGNNS-BVZFJXPGSA-N 2 0 412.549 4.338 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)C(c1ccccc1)c1ccccc1 ZINC000482252166 897732687 /nfs/dbraw/zinc/73/26/87/897732687.db2.gz JJUYRTMNJUWNQO-OAQYLSRUSA-N 2 0 415.581 4.288 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H]2CCCSc3ccc(Cl)cc32)c1 ZINC000482253817 897734698 /nfs/dbraw/zinc/73/46/98/897734698.db2.gz RRWCCBBVBWITLG-FQEVSTJZSA-N 2 0 418.006 4.348 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000482259040 897741959 /nfs/dbraw/zinc/74/19/59/897741959.db2.gz RSYAQVYYGIFNHI-QGZVFWFLSA-N 2 0 422.598 4.261 20 0 HIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C3CCOCC3)c1)CCCO2 ZINC000482263105 897747373 /nfs/dbraw/zinc/74/73/73/897747373.db2.gz LDZQJJULQJFUAS-RUZDIDTESA-N 2 0 424.585 4.488 20 0 HIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC1CC[NH+](CCN(C)C)CC1 ZINC000482347845 897858390 /nfs/dbraw/zinc/85/83/90/897858390.db2.gz DPCOLBNGCKPOHV-GOSISDBHSA-N 2 0 400.636 4.351 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc2ccccc2c1OC(F)F ZINC000482364656 897883881 /nfs/dbraw/zinc/88/38/81/897883881.db2.gz ZPVLPFSMSPTIMP-QGZVFWFLSA-N 2 0 405.533 4.365 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(-c2cccs2)cc1 ZINC000482433464 897991568 /nfs/dbraw/zinc/99/15/68/897991568.db2.gz CGLCCWQUSJEKSQ-HXUWFJFHSA-N 2 0 421.614 4.458 20 0 HIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000482455308 898024868 /nfs/dbraw/zinc/02/48/68/898024868.db2.gz XZPZRTAUHYHPOO-CTNGQTDRSA-N 2 0 406.574 4.186 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)[C@@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000482504038 898086688 /nfs/dbraw/zinc/08/66/88/898086688.db2.gz MPDTWFVNUOSLHL-IXDOHACOSA-N 2 0 402.410 4.012 20 0 HIADRP COc1c(Br)cccc1C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000482520254 898107147 /nfs/dbraw/zinc/10/71/47/898107147.db2.gz UZTPHZPTWUGWFY-UHFFFAOYSA-N 2 0 404.352 4.201 20 0 HIADRP COc1ccc(Cc2nc(C)c([C@H](C)[NH2+]CC3CC[NH+](C)CC3)s2)cc1OC ZINC000482543918 898133057 /nfs/dbraw/zinc/13/30/57/898133057.db2.gz OMJVRKZPLHNYBM-HNNXBMFYSA-N 2 0 403.592 4.052 20 0 HIADRP CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)OCCO2 ZINC000482565129 898158231 /nfs/dbraw/zinc/15/82/31/898158231.db2.gz MPMXLKGMYSRVLJ-LAUBAEHRSA-N 2 0 413.537 4.151 20 0 HIADRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2cn(-c3ccccc3Cl)nc2C(C)(C)C)CC1 ZINC000482757427 898363614 /nfs/dbraw/zinc/36/36/14/898363614.db2.gz FEPWAFHZHYMJOQ-UHFFFAOYSA-N 2 0 419.013 4.148 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000482956093 898585823 /nfs/dbraw/zinc/58/58/23/898585823.db2.gz ZVEOTVMIIWZKJN-GJZUVCINSA-N 2 0 406.618 4.458 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3cccc(Br)c3)CC2)[C@@H](C)C1 ZINC000483121794 898809183 /nfs/dbraw/zinc/80/91/83/898809183.db2.gz RAGGAVYVXGVTFR-PXNSSMCTSA-N 2 0 409.412 4.207 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C[N@@H+]1Cc1ccccc1 ZINC000483167286 898837124 /nfs/dbraw/zinc/83/71/24/898837124.db2.gz IGPXOAIAFLKQQV-QPPBQGQZSA-N 2 0 405.586 4.068 20 0 HIADRP CN(CC1CCN(c2cc[nH+]cc2)CC1)C(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000483293942 898928002 /nfs/dbraw/zinc/92/80/02/898928002.db2.gz IKYFCCAXPCLGTK-UHFFFAOYSA-N 2 0 420.601 4.059 20 0 HIADRP CCOc1ccc(-c2nc(CN3CC[C@@H]4[C@H](CCC[N@@H+]4C)C3)cs2)cc1OC ZINC000483481708 899127944 /nfs/dbraw/zinc/12/79/44/899127944.db2.gz IQHOXHKUCSBPGP-IEBWSBKVSA-N 2 0 401.576 4.134 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC2CC[NH+](C3CCCC3)CC2)cc1 ZINC000483695763 899352327 /nfs/dbraw/zinc/35/23/27/899352327.db2.gz BWBGJUBKKVURHU-HXUWFJFHSA-N 2 0 412.622 4.267 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+](C)C2CCCCC2)C[C@@H]1C ZINC000483698036 899355729 /nfs/dbraw/zinc/35/57/29/899355729.db2.gz GEZBPYXAMGJYBA-RDPSFJRHSA-N 2 0 414.638 4.465 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccc(-n2cncn2)cc1 ZINC000483725303 899385109 /nfs/dbraw/zinc/38/51/09/899385109.db2.gz LFUWMSOCUMWELV-IBGZPJMESA-N 2 0 401.514 4.343 20 0 HIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2nnn(-c3cccc(Br)c3)c2C)CC1 ZINC000483735301 899395939 /nfs/dbraw/zinc/39/59/39/899395939.db2.gz QJSQWVGWUBDBFX-HNNXBMFYSA-N 2 0 420.399 4.111 20 0 HIADRP C[C@@H]([NH2+][C@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc(OCC[NH+](C)C)cc1 ZINC000483747140 899411006 /nfs/dbraw/zinc/41/10/06/899411006.db2.gz OQRFVWKNAQTIHJ-UTKZUKDTSA-N 2 0 415.965 4.127 20 0 HIADRP C[C@@H]([NH2+][C@@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc(OCC[NH+](C)C)cc1 ZINC000483747138 899411811 /nfs/dbraw/zinc/41/18/11/899411811.db2.gz OQRFVWKNAQTIHJ-DYESRHJHSA-N 2 0 415.965 4.127 20 0 HIADRP C[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)OCO2 ZINC000483752375 899415057 /nfs/dbraw/zinc/41/50/57/899415057.db2.gz LPFFDSFLJHMWBE-OAHLLOKOSA-N 2 0 421.463 4.037 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC(CC)(CC)[NH2+][C@@H](C)c2ccccc2)C[C@@H]1C ZINC000483795811 899468203 /nfs/dbraw/zinc/46/82/03/899468203.db2.gz BKXYVHSAPFJYAF-ONTIZHBOSA-N 2 0 402.627 4.410 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)C[C@H]1C ZINC000483800319 899475357 /nfs/dbraw/zinc/47/53/57/899475357.db2.gz OLCGXVKJKHOGDV-SJBKTWHCSA-N 2 0 400.611 4.164 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000483946366 899600338 /nfs/dbraw/zinc/60/03/38/899600338.db2.gz UKGCDUQXKHATSZ-URXFXBBRSA-N 2 0 422.617 4.238 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccccc1OC(F)F ZINC000484470967 899965373 /nfs/dbraw/zinc/96/53/73/899965373.db2.gz FENGCXGSIZSTOO-NRFANRHFSA-N 2 0 404.501 4.486 20 0 HIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCC(=O)Nc3ccc(OCc4ccccc4)cc3)CC[C@@H]21 ZINC000485337129 900624836 /nfs/dbraw/zinc/62/48/36/900624836.db2.gz MMNZHQDDJQZJHC-QPPBQGQZSA-N 2 0 407.558 4.010 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1ccc2ncsc2c1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000485837054 901083311 /nfs/dbraw/zinc/08/33/11/901083311.db2.gz ZMWZFUSCFUMNFG-ROUUACIJSA-N 2 0 422.598 4.116 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H](C)c2ccc3ncsc3c2)CC1 ZINC000485842148 901087454 /nfs/dbraw/zinc/08/74/54/901087454.db2.gz BFDUOPAUOFEZMX-SFHVURJKSA-N 2 0 422.598 4.036 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486386138 901550055 /nfs/dbraw/zinc/55/00/55/901550055.db2.gz GUQMVEVWIMTZLO-RCZVLFRGSA-N 3 0 407.602 4.161 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)[C@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000505919635 914566250 /nfs/dbraw/zinc/56/62/50/914566250.db2.gz TXDJLMYFVZTVTH-PUHATCMVSA-N 2 0 415.597 4.151 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H]2CC[NH+](CCc3ccccc3)C2)cc1)C(C)C ZINC000487117085 902063767 /nfs/dbraw/zinc/06/37/67/902063767.db2.gz HQTGGJPMIFFNPF-XMMPIXPASA-N 2 0 407.602 4.211 20 0 HIADRP C[NH+](Cc1ccccc1C[N@@H+](C)[C@@H](CO)c1ccccc1)[C@@H](CO)c1ccccc1 ZINC000487441870 902212860 /nfs/dbraw/zinc/21/28/60/902212860.db2.gz FZLPFCKDFXKFKT-UIOOFZCWSA-N 2 0 404.554 4.017 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000487939912 902469868 /nfs/dbraw/zinc/46/98/68/902469868.db2.gz BZEUISFKPWPOCK-JOCHJYFZSA-N 2 0 415.622 4.135 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N[C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C)C1 ZINC000489283438 903307020 /nfs/dbraw/zinc/30/70/20/903307020.db2.gz APGWBXSGVSCIEI-WIVXBSKCSA-N 2 0 420.601 4.032 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000489529732 903439746 /nfs/dbraw/zinc/43/97/46/903439746.db2.gz VPSJECLQBFDVOK-IEZKXTBUSA-N 2 0 420.601 4.033 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000489837688 903622040 /nfs/dbraw/zinc/62/20/40/903622040.db2.gz TZRHPUCUZCCFPG-PXDATVDWSA-N 2 0 422.617 4.238 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)CC1 ZINC000490004681 903719868 /nfs/dbraw/zinc/71/98/68/903719868.db2.gz POOGQFKXPYAWOK-HSZRJFAPSA-N 2 0 424.589 4.113 20 0 HIADRP CCOc1ccc([C@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2ccccc2Cl)cc1 ZINC000490120859 903777183 /nfs/dbraw/zinc/77/71/83/903777183.db2.gz WWWSJBXEARCNGX-DEOSSOPVSA-N 2 0 416.009 4.444 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](c3ccccc3)c3ccc(C)cc3)cn2)CC1 ZINC000490158440 903800256 /nfs/dbraw/zinc/80/02/56/903800256.db2.gz RTZGKCYRFCFJND-AREMUKBSSA-N 2 0 400.570 4.411 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000490167743 903806803 /nfs/dbraw/zinc/80/68/03/903806803.db2.gz NAOZKVNSTMZRAU-MBSDFSHPSA-N 2 0 401.982 4.054 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000491021359 904373497 /nfs/dbraw/zinc/37/34/97/904373497.db2.gz NWJYMGIJVDQHPQ-YADARESESA-N 2 0 416.009 4.301 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1oc2ccccc2c1C[NH+](C)C ZINC000491055257 904398848 /nfs/dbraw/zinc/39/88/48/904398848.db2.gz YVABCRNUWJCKRU-NRFANRHFSA-N 2 0 419.569 4.479 20 0 HIADRP Cc1ccc([C@H]([NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c2ccccc2)cc1 ZINC000491056626 904400939 /nfs/dbraw/zinc/40/09/39/904400939.db2.gz BXQIWZGPJHGRNO-RUZDIDTESA-N 2 0 401.554 4.166 20 0 HIADRP CCOc1ccc([C@H]([NH2+]C[C@H](C)CN2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000491062831 904404835 /nfs/dbraw/zinc/40/48/35/904404835.db2.gz XKAZDEOCSLFSGO-CYFREDJKSA-N 2 0 416.009 4.301 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)CC[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491062018 904405338 /nfs/dbraw/zinc/40/53/38/904405338.db2.gz PPNFTAFUVRDYMM-SFHVURJKSA-N 2 0 407.986 4.265 20 0 HIADRP CSc1cccc([C@@H]([NH2+]CCCN2CC[NH+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491344102 904547792 /nfs/dbraw/zinc/54/77/92/904547792.db2.gz WKRONRLORCLIII-JOCHJYFZSA-N 2 0 405.558 4.003 20 0 HIADRP CN(c1ccccc1C[N@H+](C)Cc1ccccc1N1CCCC1)C1CC[NH+](C)CC1 ZINC000506160374 914829370 /nfs/dbraw/zinc/82/93/70/914829370.db2.gz PHNXASYKBGFHKS-UHFFFAOYSA-N 2 0 406.618 4.449 20 0 HIADRP C[C@@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)[N@H+](C)CCCN1CC[NH+](C)CC1 ZINC000492810760 904910459 /nfs/dbraw/zinc/91/04/59/904910459.db2.gz UMMWVZIUXKAWNJ-HNNXBMFYSA-N 2 0 411.377 4.279 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c2ccccc2C1 ZINC000493209780 905051760 /nfs/dbraw/zinc/05/17/60/905051760.db2.gz ZPZKLYNSHKZHKQ-SANMLTNESA-N 2 0 417.553 4.495 20 0 HIADRP COc1cc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1OCc1ccncc1 ZINC000512388709 921124662 /nfs/dbraw/zinc/12/46/62/921124662.db2.gz YCNFMKPYSJLNLX-DENIHFKCSA-N 2 0 409.574 4.412 20 0 HIADRP c1cc(-c2nc3ccccc3s2)oc1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000512419708 921148038 /nfs/dbraw/zinc/14/80/38/921148038.db2.gz BMIJOWRVSJENGC-UHFFFAOYSA-N 2 0 411.571 4.491 20 0 HIADRP c1ccc2nc(N3CCCCC3)c(C[NH+]3CCC(CC[NH+]4CCOCC4)CC3)cc2c1 ZINC000512419943 921148439 /nfs/dbraw/zinc/14/84/39/921148439.db2.gz FPPVRPYUIJCPHH-UHFFFAOYSA-N 2 0 422.617 4.159 20 0 HIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)CC2 ZINC000494743766 905942081 /nfs/dbraw/zinc/94/20/81/905942081.db2.gz CQDRKIARRUAVBW-LEWJYISDSA-N 2 0 415.375 4.101 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495092391 906233139 /nfs/dbraw/zinc/23/31/39/906233139.db2.gz LYKSIHXMCQWZFB-KBMIEXCESA-N 2 0 412.549 4.040 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)[C@@H](C)C1 ZINC000495186284 906296645 /nfs/dbraw/zinc/29/66/45/906296645.db2.gz WNQQWNNALSDDCR-FVJLSDCUSA-N 2 0 414.421 4.299 20 0 HIADRP Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000495445623 906455558 /nfs/dbraw/zinc/45/55/58/906455558.db2.gz XXNZWLLDWLJTBR-GJZGRUSLSA-N 2 0 412.500 4.414 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(C(F)(F)F)cc1 ZINC000495465758 906467249 /nfs/dbraw/zinc/46/72/49/906467249.db2.gz SFAIZHBPZSEBQI-JXFKEZNVSA-N 2 0 419.491 4.254 20 0 HIADRP C[C@@H]1C[C@@H](CCNC(=O)c2cccc(C[NH+]3CCCC3)c2)C[N@@H+]1Cc1ccccc1 ZINC000512575416 921246201 /nfs/dbraw/zinc/24/62/01/921246201.db2.gz ZCMLWFSSVFJHJP-ZJSXRUAMSA-N 2 0 405.586 4.313 20 0 HIADRP CC[C@@H](C)[NH2+][C@@H](CNC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccco1 ZINC000496649842 906728937 /nfs/dbraw/zinc/72/89/37/906728937.db2.gz JSVQGVQNEHZRRP-YGDZHLNZSA-N 2 0 424.589 4.204 20 0 HIADRP CN(C(=O)C[NH+]1CCC(CC[NH+](C)C)CC1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000497475562 906956297 /nfs/dbraw/zinc/95/62/97/906956297.db2.gz IDVKOYAMUGTZEB-RUZDIDTESA-N 2 0 411.565 4.037 20 0 HIADRP C[C@@H](C[NH2+][C@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1)N1CC[NH+](C)CC1 ZINC000512668582 921281516 /nfs/dbraw/zinc/28/15/16/921281516.db2.gz VUMIKXOAXNWHID-KKSFZXQISA-N 2 0 409.471 4.159 20 0 HIADRP C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000512706486 921293175 /nfs/dbraw/zinc/29/31/75/921293175.db2.gz ANLXVWMTEHEBMQ-LSDHHAIUSA-N 2 0 400.394 4.223 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)NC1CC[NH+]([C@H](C)c2ccccc2)CC1)c1ccco1 ZINC000497632001 907113940 /nfs/dbraw/zinc/11/39/40/907113940.db2.gz FTLBQQHUWDWVQW-NNMXDRDESA-N 2 0 412.578 4.234 20 0 HIADRP O=C(NCCC[NH2+]C1CCCCC1)NCc1ccccc1C[NH+]1CCCCCC1 ZINC000497724649 907223476 /nfs/dbraw/zinc/22/34/76/907223476.db2.gz CPYRNCCMUMRVPO-UHFFFAOYSA-N 2 0 400.611 4.174 20 0 HIADRP C[C@H](NC(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@H](c1ccccc1)[NH+](C)C ZINC000498024364 907523705 /nfs/dbraw/zinc/52/37/05/907523705.db2.gz CSUWSBGPYVUENH-BZNRXQDOSA-N 2 0 414.619 4.122 20 0 HIADRP CCN(CC[NH+]1CCCCCC1)C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000498042422 907551401 /nfs/dbraw/zinc/55/14/01/907551401.db2.gz BGCLJNBFUMIXMJ-FPOVZHCZSA-N 2 0 406.640 4.039 20 0 HIADRP C[C@H](NC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[C@H](c1ccccc1)[NH+](C)C ZINC000498899546 908305659 /nfs/dbraw/zinc/30/56/59/908305659.db2.gz SQVMTETWEHQRHO-UWXQAFAOSA-N 2 0 408.590 4.030 20 0 HIADRP CN(C(=O)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000499647154 908864788 /nfs/dbraw/zinc/86/47/88/908864788.db2.gz IYOSAPYPWNNQJX-HSZRJFAPSA-N 2 0 423.576 4.161 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513007892 921471722 /nfs/dbraw/zinc/47/17/22/921471722.db2.gz YBOMBDNHADYFKZ-OAQYLSRUSA-N 2 0 416.447 4.086 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+]C2(c3ccc(Br)cc3)CCCC2)CC1 ZINC000500125288 909608840 /nfs/dbraw/zinc/60/88/40/909608840.db2.gz PGGWXOXDMYTBMO-UHFFFAOYSA-N 2 0 408.428 4.224 20 0 HIADRP O=C(CC[NH2+]C1CC[NH+](C2CCCCC2)CC1)Nc1ccc(Br)cc1 ZINC000513053621 921511314 /nfs/dbraw/zinc/51/13/14/921511314.db2.gz XBUMLUCGBFLILR-UHFFFAOYSA-N 2 0 408.384 4.164 20 0 HIADRP CC(C)(C)[NH+]1CCC([NH2+]CC2(c3ccc(Br)cc3)CCOCC2)CC1 ZINC000513052378 921511350 /nfs/dbraw/zinc/51/13/50/921511350.db2.gz QSQUUXDJCSESJN-UHFFFAOYSA-N 2 0 409.412 4.350 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)[C@H](C)CN1C(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000500441881 909861238 /nfs/dbraw/zinc/86/12/38/909861238.db2.gz ZKJRKKNMUPHYSG-FGZHOGPDSA-N 2 0 405.586 4.020 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000500816727 910098312 /nfs/dbraw/zinc/09/83/12/910098312.db2.gz HWTVNXPRARDVCN-OAQYLSRUSA-N 2 0 414.638 4.324 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH+]2CCC(C)(c3cccc(Br)c3)CC2)CC1 ZINC000501029513 910246580 /nfs/dbraw/zinc/24/65/80/910246580.db2.gz PNVQLRLAYBTGJF-UHFFFAOYSA-N 2 0 422.455 4.219 20 0 HIADRP C[N@@H+](Cc1ccc(OCc2cccnc2)cc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501040691 910255188 /nfs/dbraw/zinc/25/51/88/910255188.db2.gz SEMZMDDUSRJEFQ-UHFFFAOYSA-N 2 0 402.542 4.404 20 0 HIADRP CCc1ccc([C@@H](C)NC(=O)[C@H](C)[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000501048265 910259439 /nfs/dbraw/zinc/25/94/39/910259439.db2.gz QKLBSXWDVZRBFC-UXHICEINSA-N 2 0 408.590 4.058 20 0 HIADRP C[C@H](OC[C@H](O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000501052590 910262899 /nfs/dbraw/zinc/26/28/99/910262899.db2.gz PCQSYHLDBAUUIK-FDDCHVKYSA-N 2 0 417.981 4.022 20 0 HIADRP C[C@@H](C(=O)Nc1cc(Cl)ccc1F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501055361 910267417 /nfs/dbraw/zinc/26/74/17/910267417.db2.gz VRHKAOINSPAEET-HNNXBMFYSA-N 2 0 404.917 4.050 20 0 HIADRP C[C@H](NC(=O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1cccc2ccccc21 ZINC000501060363 910271505 /nfs/dbraw/zinc/27/15/05/910271505.db2.gz ASIWYRMUSICRMR-FQEVSTJZSA-N 2 0 416.569 4.260 20 0 HIADRP C[C@H](c1nc(Cc2ccc(F)cc2)no1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501078487 910278753 /nfs/dbraw/zinc/27/87/53/910278753.db2.gz JRJLTHNFOOMZCM-QGZVFWFLSA-N 2 0 409.509 4.104 20 0 HIADRP Fc1ccc(C(C[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c2ccc(F)cc2)cc1 ZINC000501445413 910571694 /nfs/dbraw/zinc/57/16/94/910571694.db2.gz QVBYWPXQWHXONO-SFHVURJKSA-N 2 0 400.513 4.187 20 0 HIADRP Fc1ccc(C(C[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c2ccc(F)cc2)cc1 ZINC000501445412 910572834 /nfs/dbraw/zinc/57/28/34/910572834.db2.gz QVBYWPXQWHXONO-GOSISDBHSA-N 2 0 400.513 4.187 20 0 HIADRP C[C@@H](CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)[N@@H+]1CCC[C@H](C)C1 ZINC000501488829 910604848 /nfs/dbraw/zinc/60/48/48/910604848.db2.gz CQPUCZQHPQDABY-SFTDATJTSA-N 2 0 422.617 4.335 20 0 HIADRP CSc1ccccc1[C@@H](C)[NH2+]CC(=O)N1CCC[N@H+](Cc2ccccc2C)CC1 ZINC000501524969 910633349 /nfs/dbraw/zinc/63/33/49/910633349.db2.gz YFJNAPRBUGXTHH-HXUWFJFHSA-N 2 0 411.615 4.102 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000501849196 910882586 /nfs/dbraw/zinc/88/25/86/910882586.db2.gz FRLZFFZXNKAUAA-VWLOTQADSA-N 2 0 420.601 4.309 20 0 HIADRP C[C@@H]([NH2+][C@@H]1CCC[C@H]1c1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000513233506 921646973 /nfs/dbraw/zinc/64/69/73/921646973.db2.gz YGMZXKIFAVPKHL-DCEDVJGZSA-N 2 0 405.586 4.082 20 0 HIADRP CC(C)[C@@H]([NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000502562525 911565905 /nfs/dbraw/zinc/56/59/05/911565905.db2.gz HDDXAOHPUXMQLR-YADARESESA-N 2 0 411.565 4.282 20 0 HIADRP C[NH+]1CCC(Nc2ccccc2NC(=O)C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000502623618 911650274 /nfs/dbraw/zinc/65/02/74/911650274.db2.gz OPIHEBKHCGCMTR-UHFFFAOYSA-N 2 0 406.574 4.043 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)CCCC1)c1ccccc1 ZINC000502914428 911900525 /nfs/dbraw/zinc/90/05/25/911900525.db2.gz ZRZQNBWRXJIMMX-RXVVDRJESA-N 2 0 414.619 4.314 20 0 HIADRP CC(C)C[NH+]1CCC(NC(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)CC1 ZINC000502923019 911907962 /nfs/dbraw/zinc/90/79/62/911907962.db2.gz AASLQCBATAENBU-HXUWFJFHSA-N 2 0 400.611 4.070 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000502962105 911942604 /nfs/dbraw/zinc/94/26/04/911942604.db2.gz UZPKJQJBPBGLHH-NRFANRHFSA-N 2 0 422.617 4.122 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000503036298 912005879 /nfs/dbraw/zinc/00/58/79/912005879.db2.gz CEBPBPPPYVJJRW-SFTDATJTSA-N 2 0 414.638 4.049 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)N[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000506311419 914899599 /nfs/dbraw/zinc/89/95/99/914899599.db2.gz SSLIWKWPUIGVLV-IFMALSPDSA-N 2 0 424.589 4.364 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)C1 ZINC000506918306 915718778 /nfs/dbraw/zinc/71/87/78/915718778.db2.gz REOJHPPBJGKDPV-FGZHOGPDSA-N 2 0 412.622 4.078 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000513429020 921798222 /nfs/dbraw/zinc/79/82/22/921798222.db2.gz PPQKEXIDAFAKKT-UHFFFAOYSA-N 2 0 411.615 4.007 20 0 HIADRP CCOc1cc(C[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)cc(Cl)c1O ZINC000507407163 916176992 /nfs/dbraw/zinc/17/69/92/916176992.db2.gz SKIDXRNKBWFDMS-IAGOWNOFSA-N 2 0 418.965 4.343 20 0 HIADRP C[NH+]1CCC(C)(C[NH2+][C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000507430273 916202782 /nfs/dbraw/zinc/20/27/82/916202782.db2.gz SBMYNBKMZBFDKM-OAQYLSRUSA-N 2 0 421.006 4.154 20 0 HIADRP c1sc(CC[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)nc1-c1ccccn1 ZINC000507465070 916233330 /nfs/dbraw/zinc/23/33/30/916233330.db2.gz ZJPJNMVRBZAYQA-PCCBWWKXSA-N 2 0 404.583 4.248 20 0 HIADRP CCc1ccc([C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000507471159 916240801 /nfs/dbraw/zinc/24/08/01/916240801.db2.gz BJFQOHIYIDTPHL-HSZRJFAPSA-N 2 0 414.615 4.063 20 0 HIADRP Cc1ccc(C(=O)N2CCC([NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]34)CC2)cc1 ZINC000507504125 916270176 /nfs/dbraw/zinc/27/01/76/916270176.db2.gz AVQBVFLTBPOXQZ-LGPLSSKUSA-N 2 0 417.597 4.100 20 0 HIADRP O=C(CC[NH+]1CCC(C[NH+]2CCCC2)CC1)NC(c1ccccc1)c1ccccc1 ZINC000507858264 916686625 /nfs/dbraw/zinc/68/66/25/916686625.db2.gz CPCDTTUNOHYWCV-UHFFFAOYSA-N 2 0 405.586 4.090 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+]C3CCC(C(=O)OC(C)(C)C)CC3)cc2)C[C@H](C)O1 ZINC000507936319 916807455 /nfs/dbraw/zinc/80/74/55/916807455.db2.gz PTFHLOMRGMCCOP-MGAZVUHYSA-N 2 0 416.606 4.286 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508697673 917458607 /nfs/dbraw/zinc/45/86/07/917458607.db2.gz MKACEMKOSBVHPQ-ICLZECGLSA-N 3 0 421.629 4.296 20 0 HIADRP Cc1ccc(C(=O)N2CCC([NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000508700981 917462559 /nfs/dbraw/zinc/46/25/59/917462559.db2.gz VNQAMUFMZPRGTA-URXFXBBRSA-N 2 0 405.586 4.100 20 0 HIADRP CCc1noc(-c2ccc(CC[NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)cc2)n1 ZINC000508715670 917476928 /nfs/dbraw/zinc/47/69/28/917476928.db2.gz DVOKSQKVIVZJQP-XXBNENTESA-N 2 0 404.558 4.342 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N[C@@H](C)[C@@H](c1ccccc1C)[NH+](C)C)c1ccco1 ZINC000508877148 917630120 /nfs/dbraw/zinc/63/01/20/917630120.db2.gz DXLKUVZTCGUDNO-RUOSDFBUSA-N 2 0 400.567 4.008 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N(C)C1CC[NH+](CCC)CC1)c1ccc(Cl)cc1 ZINC000509016492 917770272 /nfs/dbraw/zinc/77/02/72/917770272.db2.gz LBKLSVCNTUQRLA-OAQYLSRUSA-N 2 0 409.018 4.239 20 0 HIADRP CCC[N@H+](C)[C@@H](CNC(=O)N(C)C1CC[NH+](CCC)CC1)c1ccc(Cl)cc1 ZINC000509016490 917770910 /nfs/dbraw/zinc/77/09/10/917770910.db2.gz LBKLSVCNTUQRLA-NRFANRHFSA-N 2 0 409.018 4.239 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+]Cc1ccc(-c2ccccc2Br)cc1 ZINC000509473723 918121434 /nfs/dbraw/zinc/12/14/34/918121434.db2.gz XIIUWCCYXLZCTI-HXUWFJFHSA-N 2 0 417.391 4.443 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000509586649 918235342 /nfs/dbraw/zinc/23/53/42/918235342.db2.gz ICJSLGRAMUHYKM-ONTIZHBOSA-N 2 0 412.578 4.015 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccco1 ZINC000509595722 918246605 /nfs/dbraw/zinc/24/66/05/918246605.db2.gz JGDUGESAVKIKEZ-PCCBWWKXSA-N 2 0 404.599 4.006 20 0 HIADRP C[C@H]1C[C@H](CCNC(=O)NCCCC[NH+]2CCC(C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000509772525 918384998 /nfs/dbraw/zinc/38/49/98/918384998.db2.gz AXOSESZQIJHHGR-UPVQGACJSA-N 2 0 414.638 4.098 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3ccccc3-c3ccnn3C)CC2)c1 ZINC000509800099 918406905 /nfs/dbraw/zinc/40/69/05/918406905.db2.gz WHKQVDBJKZXUMI-UHFFFAOYSA-N 2 0 417.601 4.088 20 0 HIADRP CC[C@@H](CNC(=O)c1oc2ccccc2c1C[NH+](C)C)[N@@H+]1CCc2ccccc2C1 ZINC000510305082 918819879 /nfs/dbraw/zinc/81/98/79/918819879.db2.gz FCRVXDXMEJLGKT-FQEVSTJZSA-N 2 0 405.542 4.061 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+]([C@@H]2CCCc3ccc(F)cc32)CC1)Cc1ccccc1 ZINC000510374246 918859856 /nfs/dbraw/zinc/85/98/56/918859856.db2.gz HJYSESKPRFUHTO-RUZDIDTESA-N 2 0 423.576 4.163 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@H](C)[C@@H]2CCC[NH+](C3CCC3)C2)CC1)CC(C)C ZINC000511266759 919864589 /nfs/dbraw/zinc/86/45/89/919864589.db2.gz PWYCQWJVZPWTTG-FYYLOGMGSA-N 2 0 420.686 4.429 20 0 HIADRP C[C@H](NC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511286646 919881404 /nfs/dbraw/zinc/88/14/04/919881404.db2.gz MIESOLLTOAXFBJ-ICSRJNTNSA-N 2 0 421.029 4.066 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000511398464 920011092 /nfs/dbraw/zinc/01/10/92/920011092.db2.gz OUDXODWRLDKFPR-RPWUZVMVSA-N 2 0 416.009 4.343 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000511398466 920012241 /nfs/dbraw/zinc/01/22/41/920012241.db2.gz OUDXODWRLDKFPR-ZEQRLZLVSA-N 2 0 416.009 4.343 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(N3CC[NH+](CC)CC3)cc2C)cc1)C1CC1 ZINC000511405997 920019055 /nfs/dbraw/zinc/01/90/55/920019055.db2.gz UUIRVLLXSKRAQK-UHFFFAOYSA-N 2 0 420.601 4.374 20 0 HIADRP C[C@H]1C[NH+](CC2CC[NH+](Cc3c[nH]nc3-c3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000512188413 920931429 /nfs/dbraw/zinc/93/14/29/920931429.db2.gz YEZVCNRJYSZJRM-IRXDYDNUSA-N 2 0 402.970 4.051 20 0 HIADRP CC1CC[NH+](C[C@H]2CCCN(Cc3ccccc3N(C)C3CC[NH+](C)CC3)C2)CC1 ZINC000512192003 920935572 /nfs/dbraw/zinc/93/55/72/920935572.db2.gz CHRUEPOAMHYEOK-HSZRJFAPSA-N 2 0 412.666 4.161 20 0 HIADRP CCOc1ccc(NC(=O)CC[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1 ZINC000512237310 920992687 /nfs/dbraw/zinc/99/26/87/920992687.db2.gz PEIJPTGEVPNINI-RUZDIDTESA-N 2 0 407.558 4.012 20 0 HIADRP COc1ccc(CC[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c(OC)c1OC ZINC000512287614 921042951 /nfs/dbraw/zinc/04/29/51/921042951.db2.gz IYXZJXLGPDMLLX-YTFSRNRJSA-N 2 0 424.585 4.145 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512321190 921071636 /nfs/dbraw/zinc/07/16/36/921071636.db2.gz DDHBBBYMJFPUMO-BBWFWOEESA-N 2 0 407.986 4.308 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512327249 921076976 /nfs/dbraw/zinc/07/69/76/921076976.db2.gz CSOQJPAZSKEBBC-GUDVDZBRSA-N 2 0 406.014 4.320 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(Br)cc1 ZINC000513456964 921822079 /nfs/dbraw/zinc/82/20/79/921822079.db2.gz GVMWPOPLJGIICW-LEWJYISDSA-N 2 0 403.364 4.257 20 0 HIADRP CN(C)C(=O)c1cccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000514092166 922414303 /nfs/dbraw/zinc/41/43/03/922414303.db2.gz CHONJANRPRGXPU-DSNGMDLFSA-N 2 0 405.586 4.169 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)NC[C@@H]2CCC[NH+](Cc3cccs3)C2)C1 ZINC000514107714 922437382 /nfs/dbraw/zinc/43/73/82/922437382.db2.gz PKVKSRRCYYFARU-HBMCJLEFSA-N 2 0 420.667 4.017 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000514162628 922503104 /nfs/dbraw/zinc/50/31/04/922503104.db2.gz NQTHNQLNTZMTDH-NRSPTQNISA-N 2 0 412.603 4.020 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CCCc2ccc(Br)cc21 ZINC000514853111 922825422 /nfs/dbraw/zinc/82/54/22/922825422.db2.gz UFUGILJIRQQGRW-HXUWFJFHSA-N 2 0 418.379 4.342 20 0 HIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000515326955 923052333 /nfs/dbraw/zinc/05/23/33/923052333.db2.gz XCUUNYQTPCATRD-LGMDPLHJSA-N 2 0 419.491 4.190 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNC(=O)N2CCC(CC[NH+](C)C)CC2)C1 ZINC000515802595 923360676 /nfs/dbraw/zinc/36/06/76/923360676.db2.gz YAMZGTUSPNJGBI-OYRHEFFESA-N 2 0 414.638 4.038 20 0 HIADRP CC(C)CN(CC[NH+](C)C)C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000515815454 923369510 /nfs/dbraw/zinc/36/95/10/923369510.db2.gz NIJVYKQNOXRPKX-UHFFFAOYSA-N 2 0 402.627 4.180 20 0 HIADRP CC[NH+](CC)CCOc1ccc(NC(=O)C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000516672638 923837757 /nfs/dbraw/zinc/83/77/57/923837757.db2.gz PJSISXHAWNZXOP-UHFFFAOYSA-N 2 0 409.574 4.258 20 0 HIADRP C[C@@H](CNC(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1)[NH+](C)Cc1ccccc1 ZINC000517703029 926804284 /nfs/dbraw/zinc/80/42/84/926804284.db2.gz WZJNSTGCJVBQBV-QFIPXVFZSA-N 2 0 422.617 4.061 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CCC[C@H]2C[NH+]2CCCC2)cc1 ZINC000517911913 926887160 /nfs/dbraw/zinc/88/71/60/926887160.db2.gz GUTAAVGXWFQOBG-DEOSSOPVSA-N 2 0 420.601 4.185 20 0 HIADRP COc1ccc(C2(C[NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CCOCC2)cc1 ZINC000518007662 926948017 /nfs/dbraw/zinc/94/80/17/926948017.db2.gz MSIVWPSSECTOHE-GMAHTHKFSA-N 2 0 408.586 4.244 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)N3CCCC[C@H]([NH+]4CCCC4)C3)cc2)CC1 ZINC000519384096 927912218 /nfs/dbraw/zinc/91/22/18/927912218.db2.gz DUEINHBPPDNPNM-DEOSSOPVSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H](O)COc1cccc2ccccc21 ZINC000520686651 928733984 /nfs/dbraw/zinc/73/39/84/928733984.db2.gz WSPQKEHSVGKNQB-QFZRFWILSA-N 2 0 404.554 4.080 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H](O)COc1cccc2ccccc21 ZINC000520686652 928734216 /nfs/dbraw/zinc/73/42/16/928734216.db2.gz WSPQKEHSVGKNQB-XRODADMRSA-N 2 0 404.554 4.080 20 0 HIADRP COCc1cccc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)c1 ZINC000525694684 930406352 /nfs/dbraw/zinc/40/63/52/930406352.db2.gz MSORBXUPBFXFLE-UHFFFAOYSA-N 2 0 415.581 4.445 20 0 HIADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 ZINC000527127102 930598410 /nfs/dbraw/zinc/59/84/10/930598410.db2.gz OYGBWCBIDZOMRO-UHFFFAOYSA-N 2 0 404.942 4.089 20 0 HIADRP C[N@@H+]1CC[C@@H](NC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)[C@@H]1c1ccccc1 ZINC000530356646 930692732 /nfs/dbraw/zinc/69/27/32/930692732.db2.gz MXDCBWYBJHZCTC-RPWUZVMVSA-N 2 0 406.574 4.282 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)Nc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)CC1 ZINC000530727050 930809317 /nfs/dbraw/zinc/80/93/17/930809317.db2.gz QIPQPQPKNVTWSA-IBGZPJMESA-N 2 0 406.574 4.477 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ccccc3Br)CC2)CC1 ZINC000530952650 930866800 /nfs/dbraw/zinc/86/68/00/930866800.db2.gz YQRKUOLIEIGKFW-UHFFFAOYSA-N 2 0 408.428 4.077 20 0 HIADRP CC[C@H](C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1)[NH+](CC)CC ZINC000531300499 931007639 /nfs/dbraw/zinc/00/76/39/931007639.db2.gz WZDUTCQANIYDQX-RLLQIKCJSA-N 2 0 413.528 4.325 20 0 HIADRP CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1)[NH+](CC)CC ZINC000531300500 931007784 /nfs/dbraw/zinc/00/77/84/931007784.db2.gz WZDUTCQANIYDQX-SXLOBPIMSA-N 2 0 413.528 4.325 20 0 HIADRP Fc1ccccc1-c1n[nH]cc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531532324 931094815 /nfs/dbraw/zinc/09/48/15/931094815.db2.gz QSMPHRZQYLBIGH-UHFFFAOYSA-N 2 0 422.548 4.377 20 0 HIADRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000531863827 931225477 /nfs/dbraw/zinc/22/54/77/931225477.db2.gz LZDQAARKEPXURD-UHFFFAOYSA-N 2 0 402.966 4.244 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]Cc1cccc(Cn2ccnc2)c1 ZINC000531940177 931255035 /nfs/dbraw/zinc/25/50/35/931255035.db2.gz ORGADIKZLFZOJV-SFHVURJKSA-N 2 0 410.949 4.112 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531944001 931257037 /nfs/dbraw/zinc/25/70/37/931257037.db2.gz OUHJRLOWFRKIPF-IBGZPJMESA-N 2 0 400.588 4.173 20 0 HIADRP Cc1nccn1-c1ccc([C@H](C)NCc2nnc3ccc(C(F)(F)F)cn32)cc1 ZINC000531945969 931257570 /nfs/dbraw/zinc/25/75/70/931257570.db2.gz MWMBDZZSRCRCQD-ZDUSSCGKSA-N 2 0 400.408 4.093 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccc(S(C)(=O)=O)cc1 ZINC000531980883 931274942 /nfs/dbraw/zinc/27/49/42/931274942.db2.gz ZNNXBRMJQDGGCX-SFHVURJKSA-N 2 0 412.555 4.166 20 0 HIADRP CC(C)C[NH+]1CCC([NH2+][C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 ZINC000531989597 931278273 /nfs/dbraw/zinc/27/82/73/931278273.db2.gz POCFDMSOTJFZPZ-OAHLLOKOSA-N 2 0 401.473 4.012 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCc4nc(-c5ccccc5)sc43)cn2)CC1 ZINC000531989924 931278436 /nfs/dbraw/zinc/27/84/36/931278436.db2.gz XPXJJPLVJKHFST-FQEVSTJZSA-N 2 0 419.598 4.124 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000532042066 931295448 /nfs/dbraw/zinc/29/54/48/931295448.db2.gz NQLXBUGJQIAOCR-UHFFFAOYSA-N 2 0 421.507 4.450 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccc(Br)cc1)C1CC[NH+](C)CC1 ZINC000532105282 931313480 /nfs/dbraw/zinc/31/34/80/931313480.db2.gz ZODHFNVGXZOQQR-UHFFFAOYSA-N 2 0 402.380 4.269 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccnc(OC2CCCC2)c1)C1CC[NH+](C)CC1 ZINC000532107386 931315641 /nfs/dbraw/zinc/31/56/41/931315641.db2.gz CUSXADIGZXLGID-UHFFFAOYSA-N 2 0 408.590 4.223 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000532200348 931346842 /nfs/dbraw/zinc/34/68/42/931346842.db2.gz JKXIZWXLOUYTLC-HNNXBMFYSA-N 2 0 404.352 4.018 20 0 HIADRP COc1cc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c(-c2ccccc2)cc1OC ZINC000532270308 931378393 /nfs/dbraw/zinc/37/83/93/931378393.db2.gz ZGIMVMBUKSGAEY-RPWUZVMVSA-N 2 0 424.585 4.228 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc2c(c1)OCCCO2 ZINC000532454427 931442406 /nfs/dbraw/zinc/44/24/06/931442406.db2.gz SBQIAXUMLUOXNM-AQNXPRMDSA-N 2 0 410.558 4.308 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc2c(c1)OCCCO2 ZINC000532454428 931442953 /nfs/dbraw/zinc/44/29/53/931442953.db2.gz SBQIAXUMLUOXNM-HSALFYBXSA-N 2 0 410.558 4.308 20 0 HIADRP CCC(CC)[C@H](C[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1)[NH+]1CCCC1 ZINC000532458863 931444474 /nfs/dbraw/zinc/44/44/74/931444474.db2.gz WGWYDOPVUXVALX-QFIPXVFZSA-N 2 0 406.014 4.435 20 0 HIADRP C[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(Br)cc1 ZINC000532497858 931463063 /nfs/dbraw/zinc/46/30/63/931463063.db2.gz ZIGUUIXPKHFTRF-UWJYYQICSA-N 2 0 402.380 4.088 20 0 HIADRP COc1ccc2cc(CN(C)C(=O)[C@@H](C)N3CCC[C@@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000532586089 931542314 /nfs/dbraw/zinc/54/23/14/931542314.db2.gz UDGBYEBMNUELKC-HYBUGGRVSA-N 2 0 423.601 4.146 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)Nc2ccc(OCC[NH+]3CCCCC3)cc2)CC1 ZINC000532635132 931562799 /nfs/dbraw/zinc/56/27/99/931562799.db2.gz RNRMALWNEUKLON-UHFFFAOYSA-N 2 0 422.573 4.110 20 0 HIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccccc3N(C)C3CC[NH+](C)CC3)CC2)CC1 ZINC000532784366 931630553 /nfs/dbraw/zinc/63/05/53/931630553.db2.gz MNFBDSMEBMVZLU-UHFFFAOYSA-N 3 0 412.666 4.350 20 0 HIADRP COc1ccc(CNc2c[nH+]ccc2N2CC[NH+](C)CC2)cc1OCc1ccccc1 ZINC000532829238 931645344 /nfs/dbraw/zinc/64/53/44/931645344.db2.gz WOIHSVOLLXWIGQ-UHFFFAOYSA-N 2 0 418.541 4.033 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCC2(CC)CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC000533133565 931778361 /nfs/dbraw/zinc/77/83/61/931778361.db2.gz WXYZCNXBERFGHU-FYYLOGMGSA-N 2 0 414.638 4.193 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000533435486 931867826 /nfs/dbraw/zinc/86/78/26/931867826.db2.gz FDKRURJTLLULCF-LGVFNWMJSA-N 2 0 405.586 4.034 20 0 HIADRP CC(CN1CC[NH+](C2CCC(C)CC2)CC1)CN1CC[NH+](C2CCC(C)CC2)CC1 ZINC000533435371 931867977 /nfs/dbraw/zinc/86/79/77/931867977.db2.gz VBKPJFFHLPCWCX-UHFFFAOYSA-N 2 0 418.714 4.015 20 0 HIADRP COc1ccc(C(=O)Nc2cccc(CNC[C@@H]3CCC[N@H+](CC(C)C)C3)c2)cc1 ZINC000533444589 931871135 /nfs/dbraw/zinc/87/11/35/931871135.db2.gz DQUHOVDJGWCMNZ-NRFANRHFSA-N 2 0 409.574 4.405 20 0 HIADRP CCC1(CNC(=O)N2CCC(CC[NH+](C)C)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000533610995 931924047 /nfs/dbraw/zinc/92/40/47/931924047.db2.gz XDBYEFSNLMDSFR-UHFFFAOYSA-N 2 0 414.638 4.052 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCc3c2c(Br)ccc3F)cc1 ZINC000534058384 932236610 /nfs/dbraw/zinc/23/66/10/932236610.db2.gz APMPXCWYABURGY-IBGZPJMESA-N 2 0 407.327 4.306 20 0 HIADRP COCCC[NH+]1CCC([NH2+][C@@H]2CCc3c2cc(Cl)cc3Br)CC1 ZINC000534058864 932237830 /nfs/dbraw/zinc/23/78/30/932237830.db2.gz HGKVIEAHXHBQHH-GOSISDBHSA-N 2 0 401.776 4.180 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000534443285 932456353 /nfs/dbraw/zinc/45/63/53/932456353.db2.gz AFTPYAJTKFYCKQ-NFBKMPQASA-N 2 0 414.638 4.269 20 0 HIADRP COCCC[NH+]1CCC([NH2+][C@H]2CCc3c2cc(Br)cc3Cl)CC1 ZINC000535506953 933199132 /nfs/dbraw/zinc/19/91/32/933199132.db2.gz FILPJAKNNOMBRM-SFHVURJKSA-N 2 0 401.776 4.180 20 0 HIADRP Clc1cc2c(c(Br)c1)CC[C@@H]2NC1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000535509187 933203853 /nfs/dbraw/zinc/20/38/53/933203853.db2.gz VRSAXCFMVZZLHK-DJJJIMSYSA-N 2 0 413.787 4.180 20 0 HIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cc(F)cc(Br)c1 ZINC000537306402 933707600 /nfs/dbraw/zinc/70/76/00/933707600.db2.gz GUIUMSRLNRYFCT-ZCNNSNEGSA-N 2 0 413.375 4.397 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H](O)CO[C@@H]1CCCc2ccccc21 ZINC000537841882 938387256 /nfs/dbraw/zinc/38/72/56/938387256.db2.gz PIRCDXWRKMDDEF-AOYPEHQESA-N 2 0 423.601 4.075 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H](O)CO[C@@H]1CCCc2ccccc21 ZINC000537841885 938387291 /nfs/dbraw/zinc/38/72/91/938387291.db2.gz PIRCDXWRKMDDEF-AZGAKELHSA-N 2 0 423.601 4.075 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCc3c2cc(Br)cc3Cl)CC1 ZINC000537957735 938433420 /nfs/dbraw/zinc/43/34/20/938433420.db2.gz SGHOVQPSCODTGZ-CEXWTWQISA-N 2 0 413.787 4.057 20 0 HIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000537970224 938440895 /nfs/dbraw/zinc/44/08/95/938440895.db2.gz MPQHDMPYPGKALW-QHCPKHFHSA-N 2 0 421.610 4.422 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H]2CCCOc3cc(Br)ccc32)C[C@H](C)O1 ZINC000537971353 938441257 /nfs/dbraw/zinc/44/12/57/938441257.db2.gz LDPJDGYQQUXQAM-FCEWJHQRSA-N 2 0 411.384 4.142 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@@H](Cc2ccccc2)c2ccccc2)cc1 ZINC000537973248 938443245 /nfs/dbraw/zinc/44/32/45/938443245.db2.gz BHDUIGNRCZCAMP-VWLOTQADSA-N 2 0 401.554 4.052 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000537991555 938453155 /nfs/dbraw/zinc/45/31/55/938453155.db2.gz SYLRLTKXPYLDQC-HXUWFJFHSA-N 2 0 409.574 4.104 20 0 HIADRP CC(C)Oc1cccc([C@H](C)[NH2+][C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000538124867 938511545 /nfs/dbraw/zinc/51/15/45/938511545.db2.gz OHARTUFZJWPORP-LEWJYISDSA-N 2 0 423.601 4.294 20 0 HIADRP C[C@@H]([NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)C(C)(C)c1ccccc1 ZINC000538149842 938522415 /nfs/dbraw/zinc/52/24/15/938522415.db2.gz FRNZZPMDOJKKJW-LJQANCHMSA-N 2 0 411.615 4.130 20 0 HIADRP CC[C@@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2ccccc2C1 ZINC000538268918 938579848 /nfs/dbraw/zinc/57/98/48/938579848.db2.gz QLTGNLKPBDRMKK-ZCYQVOJMSA-N 2 0 419.613 4.401 20 0 HIADRP C[C@@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2sccc2C1 ZINC000538276819 938581552 /nfs/dbraw/zinc/58/15/52/938581552.db2.gz SHQWQXGGCBVZSV-GHTZIAJQSA-N 2 0 411.615 4.073 20 0 HIADRP Cc1cc(Br)cc2cc([C@@H]([NH2+]C[C@H](C)N3CC[NH+](C)CC3)C(C)C)oc21 ZINC000538445435 938623275 /nfs/dbraw/zinc/62/32/75/938623275.db2.gz LKBXJKGBVLDQIT-JXFKEZNVSA-N 2 0 422.411 4.426 20 0 HIADRP C[C@@H](Nc1cccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000538589587 938656809 /nfs/dbraw/zinc/65/68/09/938656809.db2.gz MPMMNFABMIWQIL-NJDAHSKKSA-N 2 0 411.590 4.409 20 0 HIADRP CSc1cccc([C@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2ccc(F)c(F)c2)c1 ZINC000538709467 938687675 /nfs/dbraw/zinc/68/76/75/938687675.db2.gz SEPTZAXJCCJMNM-QHCPKHFHSA-N 2 0 419.585 4.393 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(Br)c(OC(F)F)c(OC)c2)[C@H](C)C1 ZINC000538718317 938689514 /nfs/dbraw/zinc/68/95/14/938689514.db2.gz JXHGSZUAYFAGRF-DOMZBBRYSA-N 2 0 421.326 4.221 20 0 HIADRP Cc1cccc(-c2n[nH]cc2C[N@@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c1 ZINC000538723408 938692222 /nfs/dbraw/zinc/69/22/22/938692222.db2.gz AWTKLCRHXNFDRY-UHFFFAOYSA-N 2 0 409.622 4.013 20 0 HIADRP C[C@H](C(=O)Nc1nc2ccccc2s1)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538944181 938743493 /nfs/dbraw/zinc/74/34/93/938743493.db2.gz OTWJAJKKZKJYIC-QGZVFWFLSA-N 2 0 423.586 4.257 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(COC2CCOCC2)cc1 ZINC000539052479 938784223 /nfs/dbraw/zinc/78/42/23/938784223.db2.gz IRMPBBBOYYOKCZ-LVXARBLLSA-N 2 0 408.586 4.382 20 0 HIADRP COc1ccc(Br)cc1C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000539064218 938789778 /nfs/dbraw/zinc/78/97/78/938789778.db2.gz IROTWDQJTUAOIH-HNNXBMFYSA-N 2 0 407.352 4.249 20 0 HIADRP C[C@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1cccc2ccccc21 ZINC000539244368 938824755 /nfs/dbraw/zinc/82/47/55/938824755.db2.gz RWJNQVXYVUAWFQ-FQEVSTJZSA-N 2 0 401.554 4.403 20 0 HIADRP C[C@H]1C[NH+](CCOc2ccc(CC[NH2+]C3CC[NH+](C(C)(C)C)CC3)cc2)C[C@@H]1C ZINC000539298512 938836263 /nfs/dbraw/zinc/83/62/63/938836263.db2.gz QZQLAZSJKMFAAW-SFTDATJTSA-N 3 0 401.639 4.048 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]Cc1ccc(Cn3cccn3)cc1)c1ccccc1O2 ZINC000539369253 938850210 /nfs/dbraw/zinc/85/02/10/938850210.db2.gz QXAWDWGLILKSKU-QHCPKHFHSA-N 2 0 402.542 4.009 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H](NC[C@H]1CC[N@H+](CCc3ccccc3)C1)c1ccccc1O2 ZINC000539378181 938851491 /nfs/dbraw/zinc/85/14/91/938851491.db2.gz YMSOTQGYYREXFN-ILBGXUMGSA-N 3 0 419.613 4.129 20 0 HIADRP C[C@@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1nc(-c2ccccc2)no1 ZINC000539409058 938856412 /nfs/dbraw/zinc/85/64/12/938856412.db2.gz IAPINBRKMVZVRB-RXVVDRJESA-N 2 0 418.541 4.418 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[NH+]4CC[C@@H]5[C@@H](CCC[N@H+]5C)C4)cc3)nc12 ZINC000539897993 938972111 /nfs/dbraw/zinc/97/21/11/938972111.db2.gz GFGGMEJLRZYGDG-XUZZJYLKSA-N 2 0 404.558 4.138 20 0 HIADRP COCCc1nc(C)c([C@@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000539969965 938982625 /nfs/dbraw/zinc/98/26/25/938982625.db2.gz YIBSXNMBGHPVHP-MNDCFMPDSA-N 2 0 401.620 4.448 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1cc(F)ccc1F ZINC000540169108 939101087 /nfs/dbraw/zinc/10/10/87/939101087.db2.gz KHHJWJMFBOMDOF-QFIPXVFZSA-N 2 0 401.501 4.031 20 0 HIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3CCN(C(=O)CCc4ccccc4)CC3)CC2)C1 ZINC000540192310 939117152 /nfs/dbraw/zinc/11/71/52/939117152.db2.gz DHKVIPDLNBRQMU-PXDATVDWSA-N 2 0 411.634 4.243 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)NCc2ccc(C[NH+](C)C)cc2)CC1)CC(C)C ZINC000540280810 939181795 /nfs/dbraw/zinc/18/17/95/939181795.db2.gz WDADEFOQVOQYHA-UHFFFAOYSA-N 2 0 402.627 4.038 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000540302738 939187918 /nfs/dbraw/zinc/18/79/18/939187918.db2.gz SJUSDZCISMBTPP-FQEVSTJZSA-N 2 0 406.496 4.339 20 0 HIADRP CC(C)Oc1cccc([C@H](C)[NH2+]CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000540325345 939195191 /nfs/dbraw/zinc/19/51/91/939195191.db2.gz GIWFJINRCCVEAX-FQEVSTJZSA-N 2 0 409.574 4.037 20 0 HIADRP C[C@@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2ccccc2C1 ZINC000540475600 939266883 /nfs/dbraw/zinc/26/68/83/939266883.db2.gz QJYGWJVLFKAAKO-RDPSFJRHSA-N 2 0 405.586 4.011 20 0 HIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)CN1Cc1ccccc1 ZINC000540494349 939274989 /nfs/dbraw/zinc/27/49/89/939274989.db2.gz XSDPYBDZBDYTMQ-BKULYWANSA-N 2 0 405.586 4.227 20 0 HIADRP C[N@H+](CCC(=O)NC[C@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1)C1CCCCC1 ZINC000563663019 945242759 /nfs/dbraw/zinc/24/27/59/945242759.db2.gz HRAXJWONTSGJNU-VGOFRKELSA-N 2 0 409.977 4.243 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3cc4cccc(OC)c4o3)cc2)CC1 ZINC000540598423 939315723 /nfs/dbraw/zinc/31/57/23/939315723.db2.gz JGMZFYAIOQYECO-IBGZPJMESA-N 2 0 407.558 4.430 20 0 HIADRP C[N@H+](CCC(=O)NC[C@@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1)C1CCCCC1 ZINC000563663018 945243549 /nfs/dbraw/zinc/24/35/49/945243549.db2.gz HRAXJWONTSGJNU-JTSKRJEESA-N 2 0 409.977 4.243 20 0 HIADRP CCC[NH+]1CCC(NC(=O)N[C@H]2CCN(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000540711748 939345310 /nfs/dbraw/zinc/34/53/10/939345310.db2.gz AHYFXNJCPXYMKY-LEWJYISDSA-N 2 0 424.992 4.177 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccccc1OC(F)(F)F ZINC000540991043 939426552 /nfs/dbraw/zinc/42/65/52/939426552.db2.gz WZUVRKGDUYPSBL-QFBILLFUSA-N 2 0 408.464 4.393 20 0 HIADRP C[C@H]1[C@H](c2ccccc2)C[C@@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000541238637 939487108 /nfs/dbraw/zinc/48/71/08/939487108.db2.gz YBFNRTWQCCNEKZ-LZYPDUGYSA-N 2 0 408.586 4.458 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(-c4ccccc4Cl)o3)CC2)CC1 ZINC000541759691 939623313 /nfs/dbraw/zinc/62/33/13/939623313.db2.gz WRHGOEAYSGNSFD-UHFFFAOYSA-N 2 0 401.982 4.450 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cc(F)cc(Br)c1 ZINC000541915114 939652699 /nfs/dbraw/zinc/65/26/99/939652699.db2.gz YFCMTTLYIHLFMZ-NHCUHLMSSA-N 2 0 421.354 4.396 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)c2ccc(C[NH+]3CCSCC3)cc2)CC1 ZINC000542093590 939709106 /nfs/dbraw/zinc/70/91/06/939709106.db2.gz NIQFMPLAIYOGRJ-UHFFFAOYSA-N 2 0 417.663 4.210 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000542465855 939827956 /nfs/dbraw/zinc/82/79/56/939827956.db2.gz MTEOLQZVSMAXPP-AWEZNQCLSA-N 2 0 407.465 4.431 20 0 HIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCCc2nc(-c3ccc(F)cc3)no2)CC1 ZINC000542483594 939831313 /nfs/dbraw/zinc/83/13/13/939831313.db2.gz QSEAAGXLYMPENH-DYESRHJHSA-N 2 0 400.542 4.441 20 0 HIADRP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000542501701 939833446 /nfs/dbraw/zinc/83/34/46/939833446.db2.gz DNFAHHQRAJQMED-RUZDIDTESA-N 2 0 419.613 4.269 20 0 HIADRP CN(CCC[NH+](C)C)C(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000542719887 939856601 /nfs/dbraw/zinc/85/66/01/939856601.db2.gz JTJAMWYWVFWCQB-UHFFFAOYSA-N 2 0 408.590 4.043 20 0 HIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2cccc(Br)c21 ZINC000542845624 939862423 /nfs/dbraw/zinc/86/24/23/939862423.db2.gz DDNCBFXLZTUFFV-YWMUFLPLSA-N 2 0 415.375 4.354 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(F)cc1Br ZINC000542849460 939863024 /nfs/dbraw/zinc/86/30/24/939863024.db2.gz PMUKUYQZXXEAJC-RDTXWAMCSA-N 2 0 407.327 4.006 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cc(-n3ccnc3)cs2)CC1 ZINC000543177519 939985928 /nfs/dbraw/zinc/98/59/28/939985928.db2.gz UVHOQGCLMHQTRC-KRWDZBQOSA-N 2 0 413.566 4.066 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC000543289023 940019454 /nfs/dbraw/zinc/01/94/54/940019454.db2.gz USOBBRLWBXMQNU-DEOSSOPVSA-N 2 0 405.586 4.267 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(-c4ccc(Cl)cc4)o3)CC2)CC1 ZINC000543618641 940135072 /nfs/dbraw/zinc/13/50/72/940135072.db2.gz RVHMTLCMBFBEIZ-UHFFFAOYSA-N 2 0 401.982 4.450 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000543775242 940182511 /nfs/dbraw/zinc/18/25/11/940182511.db2.gz QTJXXKZYFBIWEX-HTAPYJJXSA-N 2 0 422.598 4.321 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cnn1-c1cc(C)ccc1C ZINC000543776314 940182536 /nfs/dbraw/zinc/18/25/36/940182536.db2.gz FZZOEDGVFFODBI-GBXCKJPGSA-N 2 0 418.585 4.215 20 0 HIADRP COc1cc(OC)c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1Cl ZINC000543777106 940183534 /nfs/dbraw/zinc/18/35/34/940183534.db2.gz JUPKUWATOJYLMO-QFBILLFUSA-N 2 0 418.965 4.165 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(F)cc1OC(F)F ZINC000543778050 940184066 /nfs/dbraw/zinc/18/40/66/940184066.db2.gz RUHNORGRXZOMTI-DNVCBOLYSA-N 2 0 408.464 4.235 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCCC4)C1 ZINC000543777608 940184189 /nfs/dbraw/zinc/18/41/89/940184189.db2.gz URGBUPAZUIIOAD-UKILVPOCSA-N 2 0 406.570 4.136 20 0 HIADRP O[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)COc1cccc2ccccc21 ZINC000563798794 945304120 /nfs/dbraw/zinc/30/41/20/945304120.db2.gz IZYUDXMVFTYDEG-WQYPUDFKSA-N 2 0 416.565 4.365 20 0 HIADRP Fc1ccc(-c2noc(CCC[NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@H]34)n2)cc1 ZINC000544367020 940403060 /nfs/dbraw/zinc/40/30/60/940403060.db2.gz IALXEZAWGUUHGN-AKIFATBCSA-N 2 0 420.532 4.309 20 0 HIADRP CC1(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000544374359 940405381 /nfs/dbraw/zinc/40/53/81/940405381.db2.gz KCASWSMZVSYFGB-UHFFFAOYSA-N 2 0 405.586 4.070 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ncc(Br)cc1Br ZINC000544407271 940415311 /nfs/dbraw/zinc/41/53/11/940415311.db2.gz XHEMFGMNZDYVRK-ZDUSSCGKSA-N 2 0 419.205 4.351 20 0 HIADRP C[C@H]([NH2+]CC[S@](=O)c1cc(Cl)ccc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544419266 940418607 /nfs/dbraw/zinc/41/86/07/940418607.db2.gz AIKASDUHQGLBDA-XHQUFGICSA-N 2 0 403.419 4.344 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COC(c1ccccc1)c1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544425720 940424478 /nfs/dbraw/zinc/42/44/78/940424478.db2.gz XVKVXLFXCYQJPJ-BBVWWWHTSA-N 2 0 422.613 4.396 20 0 HIADRP C[C@H](CS(=O)(=O)c1ccccc1)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000544576629 940483321 /nfs/dbraw/zinc/48/33/21/940483321.db2.gz QYCKGGNBRITWAF-HXUWFJFHSA-N 2 0 414.615 4.403 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)N(C)[C@H](C)C2CC[NH+](C)CC2)CCCC1)c1ccccc1 ZINC000544657702 940499351 /nfs/dbraw/zinc/49/93/51/940499351.db2.gz ZOOJOLCKGMCNPN-WOJBJXKFSA-N 2 0 400.611 4.022 20 0 HIADRP C[NH+](C)CCOc1ccccc1-c1noc(C2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000545696602 940581334 /nfs/dbraw/zinc/58/13/34/940581334.db2.gz NSDFWPXKCZOVTN-UHFFFAOYSA-N 2 0 406.530 4.057 20 0 HIADRP CC[NH+](CC)C[C@@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000563977635 945333738 /nfs/dbraw/zinc/33/37/38/945333738.db2.gz FFBIYQYNOVTPAF-FJXZYEQHSA-N 2 0 421.029 4.283 20 0 HIADRP CCN(C(=O)c1ccc(C[NH+](CC)C2CC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000546183367 940723180 /nfs/dbraw/zinc/72/31/80/940723180.db2.gz CLGZVXAAXWVWHI-RUZDIDTESA-N 2 0 405.586 4.408 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccncc2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547505538 941066082 /nfs/dbraw/zinc/06/60/82/941066082.db2.gz RGJGHTHQCAYLKY-GBXCKJPGSA-N 2 0 414.553 4.334 20 0 HIADRP Cc1ccc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c(-c2ccnn2C)c1 ZINC000548979109 941138077 /nfs/dbraw/zinc/13/80/77/941138077.db2.gz MEPIUWIXWQMXIK-UHFFFAOYSA-N 2 0 417.601 4.088 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000548982046 941138504 /nfs/dbraw/zinc/13/85/04/941138504.db2.gz PQASVJNZZOGOLS-UHFFFAOYSA-N 2 0 415.541 4.399 20 0 HIADRP Cc1nc(CN2CCC(C[NH2+]Cc3ccc(C)cc3-c3cnn(C)c3)CC2)oc1C ZINC000549238373 941173125 /nfs/dbraw/zinc/17/31/25/941173125.db2.gz NWMZVJMXQIMHBH-UHFFFAOYSA-N 2 0 407.562 4.002 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000549381710 941184520 /nfs/dbraw/zinc/18/45/20/941184520.db2.gz UDWVSOSWFCOMFC-BWKNWUBXSA-N 2 0 405.586 4.408 20 0 HIADRP C[C@H](c1ccc(F)cc1)N1CC[C@H](N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)C1=O ZINC000549446487 941190812 /nfs/dbraw/zinc/19/08/12/941190812.db2.gz SUUJZZNNECMEFL-UGTOYMOASA-N 2 0 401.570 4.074 20 0 HIADRP COC(=O)c1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[nH]1 ZINC000549447191 941191082 /nfs/dbraw/zinc/19/10/82/941191082.db2.gz YTUYHQWFJZMKHT-FTSXVACHSA-N 2 0 401.938 4.158 20 0 HIADRP COc1ccc2c(c1)C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CC2 ZINC000549868343 941221385 /nfs/dbraw/zinc/22/13/85/941221385.db2.gz UIVRFMBSICOAIK-JWQCQUIFSA-N 2 0 420.597 4.071 20 0 HIADRP COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000550218580 941300589 /nfs/dbraw/zinc/30/05/89/941300589.db2.gz RGMBZWGLCMSDPT-PZJWPPBQSA-N 2 0 402.579 4.151 20 0 HIADRP CC(C)[C@]1(CO)CCC[N@H+](Cc2ccccc2C[NH+]2CCC[C@](CO)(C(C)C)C2)C1 ZINC000550433227 941326107 /nfs/dbraw/zinc/32/61/07/941326107.db2.gz FUIYSIVNGWRMMO-WMPKNSHKSA-N 2 0 416.650 4.148 20 0 HIADRP CC(C)[C@]1(CO)CCC[NH+](Cc2ccc(C[N@H+]3CCC[C@@](CO)(C(C)C)C3)cc2)C1 ZINC000550433605 941326833 /nfs/dbraw/zinc/32/68/33/941326833.db2.gz MQWDTQGKIZUZLF-CLJLJLNGSA-N 2 0 416.650 4.148 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(F)c2ccccc21 ZINC000551029224 941397430 /nfs/dbraw/zinc/39/74/30/941397430.db2.gz AQIGHKCVAVAVKV-LJQANCHMSA-N 2 0 407.537 4.022 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)C(=O)Nc1ccc(F)cc1F ZINC000551283106 941442696 /nfs/dbraw/zinc/44/26/96/941442696.db2.gz HXZPLHXRFYLQIV-QGZVFWFLSA-N 2 0 401.501 4.314 20 0 HIADRP CC1CC[NH+](CCC[C@@H]([NH2+]Cc2ccc3c(c2)C(=O)NCC3)c2ccc(F)cc2)CC1 ZINC000551286289 941444053 /nfs/dbraw/zinc/44/40/53/941444053.db2.gz KQZMIIIDXDWTFW-RUZDIDTESA-N 2 0 423.576 4.455 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000552332046 941634374 /nfs/dbraw/zinc/63/43/74/941634374.db2.gz ZGMGITULLPQLHC-QPPBQGQZSA-N 2 0 412.622 4.221 20 0 HIADRP CN(CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nc2ccc(Cl)cc2c(=O)[nH]1 ZINC000552437392 941671529 /nfs/dbraw/zinc/67/15/29/941671529.db2.gz AILJLSCGCDXCFV-UHFFFAOYSA-N 2 0 411.937 4.122 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1nc(-c2cccc(Cl)c2)no1 ZINC000552571909 941709962 /nfs/dbraw/zinc/70/99/62/941709962.db2.gz VOGPWOHTNBAAIQ-UTKZUKDTSA-N 2 0 410.949 4.433 20 0 HIADRP COc1ccccc1[C@@H](CNC(=O)c1ccc(C[NH+]2CCCCC2)cc1)[NH+]1CCCC1 ZINC000553621400 941922885 /nfs/dbraw/zinc/92/28/85/941922885.db2.gz FJPMXKNAIKDJJU-XMMPIXPASA-N 2 0 421.585 4.248 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000554388752 942122601 /nfs/dbraw/zinc/12/26/01/942122601.db2.gz DIBAXEUHENVZGS-YKSBVNFPSA-N 2 0 408.590 4.289 20 0 HIADRP C[C@H]([NH2+]C1CCN(C(=O)CCc2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554858695 942294865 /nfs/dbraw/zinc/29/48/65/942294865.db2.gz UOPQYXCOCPCHLW-WIOPSUGQSA-N 2 0 419.613 4.110 20 0 HIADRP Cc1cc2ncn(C[C@@H](O)C[NH2+]Cc3ccc(C[N@H+]4CCCC[C@H]4C)cc3)c2cc1C ZINC000554863405 942297534 /nfs/dbraw/zinc/29/75/34/942297534.db2.gz RQDHSDNBVGDFDD-QPPBQGQZSA-N 2 0 420.601 4.178 20 0 HIADRP C[N@H+](CCCN1CC[NH+](C)CC1)Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000554883894 942307317 /nfs/dbraw/zinc/30/73/17/942307317.db2.gz FUKRMCFNVUCLCK-UHFFFAOYSA-N 2 0 418.029 4.028 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000554915296 942317563 /nfs/dbraw/zinc/31/75/63/942317563.db2.gz PNXWPMOLICKLFY-UHFFFAOYSA-N 2 0 403.574 4.406 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+]Cc3cccc4cccnc43)C3(C2)CCOCC3)cc1 ZINC000555619119 942673944 /nfs/dbraw/zinc/67/39/44/942673944.db2.gz ZSUFKWPUGFRGQH-DEOSSOPVSA-N 2 0 401.554 4.253 20 0 HIADRP C[C@H]([NH2+]C1(CN[C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCOCC1)c1ccccc1 ZINC000556093673 942803900 /nfs/dbraw/zinc/80/39/00/942803900.db2.gz LFDMRBDOLWAGOB-GVXSCFBNSA-N 2 0 407.602 4.312 20 0 HIADRP C[C@H]([NH2+]C1(CN[C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCOCC1)c1ccccc1 ZINC000556093671 942803994 /nfs/dbraw/zinc/80/39/94/942803994.db2.gz LFDMRBDOLWAGOB-FTBPSBKWSA-N 2 0 407.602 4.312 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000556223576 942820837 /nfs/dbraw/zinc/82/08/37/942820837.db2.gz KLSJGZVLFCXTLY-IXGWMPLNSA-N 2 0 423.576 4.378 20 0 HIADRP CS(=O)(=O)c1cccc([C@H]([NH2+]CCCCC[NH+]2CCCC2)c2ccc(F)cc2)c1 ZINC000556233941 942824098 /nfs/dbraw/zinc/82/40/98/942824098.db2.gz UDWBNQCRSBFJMF-HSZRJFAPSA-N 2 0 418.578 4.174 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2cnc(OC)c(Cl)c2)CC1 ZINC000556582651 942905928 /nfs/dbraw/zinc/90/59/28/942905928.db2.gz CDAVZKPUMBMOSM-JKSUJKDBSA-N 2 0 420.960 4.436 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCNC(=O)NC[C@@H]1CC[NH+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000556637588 942923343 /nfs/dbraw/zinc/92/33/43/942923343.db2.gz ALNQIOHSBGRDCT-MMOPVJDHSA-N 2 0 424.992 4.036 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCN(C)[C@@H](c4ccccc4)C3)CC2)cc1 ZINC000559752342 944043734 /nfs/dbraw/zinc/04/37/34/944043734.db2.gz FYBRVGFNHUWUPH-AOYPEHQESA-N 2 0 407.602 4.332 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2C[NH+](C(C)(C)C)C[C@H]2C(F)(F)F)C1 ZINC000559825597 944061352 /nfs/dbraw/zinc/06/13/52/944061352.db2.gz YWJFYZDASKXZAB-FCGDIQPGSA-N 2 0 417.560 4.008 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H]3CCCNc4ccccc43)C3(C2)CCOCC3)cc1 ZINC000559890719 944076497 /nfs/dbraw/zinc/07/64/97/944076497.db2.gz IKJKPMNLUTUITN-DHLKQENFSA-N 2 0 405.586 4.452 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+]C3CCC4(CCOCC4)CC3)C3(C2)CCOCC3)cc1 ZINC000559895237 944079336 /nfs/dbraw/zinc/07/93/36/944079336.db2.gz VYFUQIJHTXYCPU-HSZRJFAPSA-N 2 0 412.618 4.244 20 0 HIADRP CC[N@H+](C)C[C@@H]1CCN(C(=O)[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2c2cccc(C)c2)C1 ZINC000560083687 944152153 /nfs/dbraw/zinc/15/21/53/944152153.db2.gz PEUGHGQPXFCRNS-DMDYGQEQSA-N 2 0 419.613 4.011 20 0 HIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1OC ZINC000560266022 944212504 /nfs/dbraw/zinc/21/25/04/944212504.db2.gz UOLZIXMJZNEPDP-MOPGFXCFSA-N 2 0 412.574 4.459 20 0 HIADRP COc1cc(OC)c(OC)cc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000560542778 944248997 /nfs/dbraw/zinc/24/89/97/944248997.db2.gz JLSZRGOAEDXMQZ-UHFFFAOYSA-N 2 0 410.558 4.201 20 0 HIADRP CCC1(C[NH2+][C@H](C)c2ccc3c(c2)OCC(=O)N3)CC[NH+](Cc2ccccc2)CC1 ZINC000560546764 944249787 /nfs/dbraw/zinc/24/97/87/944249787.db2.gz WNHTYKYLYVYZAE-LJQANCHMSA-N 2 0 407.558 4.361 20 0 HIADRP C[S@](=O)Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000560558438 944254998 /nfs/dbraw/zinc/25/49/98/944254998.db2.gz QNVLAYIGXPPGLC-VYUAFQCHSA-N 2 0 410.627 4.346 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)C[C@H](c2ncc[nH]2)c2ccccc2)C1 ZINC000561155229 944485593 /nfs/dbraw/zinc/48/55/93/944485593.db2.gz GUQODTSWVOJLDT-YKSBVNFPSA-N 2 0 416.569 4.480 20 0 HIADRP CCc1ccc(-c2ccc(C[NH+]3CCC(C(=O)NCCC[NH+]4CCCC4)CC3)o2)cc1 ZINC000564313218 945510972 /nfs/dbraw/zinc/51/09/72/945510972.db2.gz PFESYJRVRFNFOC-UHFFFAOYSA-N 2 0 423.601 4.323 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC[NH+](C2CCCC2)CC1 ZINC000564374281 945539368 /nfs/dbraw/zinc/53/93/68/945539368.db2.gz WUDIHSPJKBSGLG-NRFANRHFSA-N 2 0 412.622 4.221 20 0 HIADRP Cc1cccc(C)c1NC(=O)CCC[N@@H+]1C[C@@H]2CC[NH+](Cc3ccccc3)C[C@H]2C1 ZINC000564402563 945556674 /nfs/dbraw/zinc/55/66/74/945556674.db2.gz CPGFOBBHUAVUCR-BJKOFHAPSA-N 2 0 405.586 4.476 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@H]3CCN(C)[C@H](c4ccccc4)C3)CC2)c1 ZINC000564474776 945605575 /nfs/dbraw/zinc/60/55/75/945605575.db2.gz SQYYMEVDFOPKPV-BDYUSTAISA-N 2 0 420.645 4.322 20 0 HIADRP CN1CC[C@H]([NH2+]C[C@H](c2ccc(Cl)cc2)N2CCOCC2)C[C@@H]1c1ccccc1 ZINC000565097796 945773805 /nfs/dbraw/zinc/77/38/05/945773805.db2.gz SLCDDNRGPOFXFL-RBZQAINGSA-N 2 0 413.993 4.138 20 0 HIADRP CC1CC[NH+](CCC[C@@H]([NH2+]CCC(=O)Nc2ccccn2)c2ccc(F)cc2)CC1 ZINC000568930760 946765335 /nfs/dbraw/zinc/76/53/35/946765335.db2.gz SUUFGNPDADTSHV-JOCHJYFZSA-N 2 0 412.553 4.392 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)NC[C@@H](C2CCCCC2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000571007173 947430818 /nfs/dbraw/zinc/43/08/18/947430818.db2.gz AIBRIACIAWCREW-QDSKXPNFSA-N 2 0 414.638 4.191 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+]C3CCN(c4ccccc4)CC3)C3(C2)CCOCC3)cc1 ZINC000571064954 947459865 /nfs/dbraw/zinc/45/98/65/947459865.db2.gz IWERIIFBZLWTFL-XMMPIXPASA-N 2 0 419.613 4.174 20 0 HIADRP Clc1ccc([C@H](C2CCOCC2)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000571268620 947576339 /nfs/dbraw/zinc/57/63/39/947576339.db2.gz FYSSIPQOWGTAGM-HSZRJFAPSA-N 2 0 406.998 4.385 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000571322583 947593758 /nfs/dbraw/zinc/59/37/58/947593758.db2.gz MWSUYEIMKXTSJA-LJQANCHMSA-N 2 0 409.452 4.088 20 0 HIADRP CC[C@@H](C(=O)Nc1ccc(C[NH+]2CCSCC2)cc1C)[N@H+](C)Cc1ccccc1 ZINC000575023764 948576193 /nfs/dbraw/zinc/57/61/93/948576193.db2.gz ZYSYOEVKXBKCIO-QHCPKHFHSA-N 2 0 411.615 4.393 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000575058071 948583011 /nfs/dbraw/zinc/58/30/11/948583011.db2.gz WSUXLAQKUNCCSH-QFIPXVFZSA-N 2 0 416.407 4.156 20 0 HIADRP CCC[N@@H+]1CCCC[C@H]1c1ccc(N(c2ncnc3c2CC[NH2+]CC3)C(C)C)nc1 ZINC001164663237 719345166 /nfs/dbraw/zinc/34/51/66/719345166.db2.gz XEHMIQCILNOYFD-QFIPXVFZSA-N 2 0 408.594 4.043 20 0 HIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@@H]2CC[NH+]3Cc2cccnc2)nc1 ZINC001164732085 720472637 /nfs/dbraw/zinc/47/26/37/720472637.db2.gz YNTUFGGWCCMPAP-SMIHKQSGSA-N 2 0 405.590 4.267 20 0 HIADRP CC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCn3c(C[NH+](C)C(C)C)cnc3[C@H]2C)nc1 ZINC001164862338 721016915 /nfs/dbraw/zinc/01/69/15/721016915.db2.gz PYPZLRHDGZCSAG-DENIHFKCSA-N 2 0 410.610 4.246 20 0 HIADRP CC(C)CN1c2ccccc2[C@@H]2CN(c3cc(OC4CC[NH+](C)CC4)cc[nH+]3)CC[C@H]21 ZINC001165003999 722245755 /nfs/dbraw/zinc/24/57/55/722245755.db2.gz MEBSAVDKDAZUQX-UKILVPOCSA-N 2 0 420.601 4.393 20 0 HIADRP CN1CC[C@@H](C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000436480892 861820109 /nfs/dbraw/zinc/82/01/09/861820109.db2.gz JJHSROGILXPSDI-HTAPYJJXSA-N 2 0 402.945 4.126 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)NC[C@@H](c2ccccc2Cl)[NH+]2CCCC2)c1 ZINC000044291806 848540648 /nfs/dbraw/zinc/54/06/48/848540648.db2.gz GEUUBZATXZLJJL-NRFANRHFSA-N 2 0 400.954 4.360 20 0 HIADRP CCOc1c(Br)cc(Br)cc1C[NH2+]CCCC[NH+](C)C ZINC000045598429 848699036 /nfs/dbraw/zinc/69/90/36/848699036.db2.gz FGEBACAONONZRF-UHFFFAOYSA-N 2 0 408.178 4.042 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000047777596 849109527 /nfs/dbraw/zinc/10/95/27/849109527.db2.gz MZUFQOXNYQNPAR-JOCHJYFZSA-N 2 0 412.578 4.146 20 0 HIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000048717360 849258696 /nfs/dbraw/zinc/25/86/96/849258696.db2.gz DPOWAQBZHWCYSJ-UHFFFAOYSA-N 2 0 412.965 4.373 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2c[nH]nc2-c2ccc(F)cc2)C[C@H](C)O1 ZINC000048816727 849270370 /nfs/dbraw/zinc/27/03/70/849270370.db2.gz YEMJKIGFCVWQSQ-HDICACEKSA-N 2 0 408.521 4.115 20 0 HIADRP Cc1c(O)ccc2c(C[NH2+]Cc3ccccc3C[N@H+]3CCC[C@@H](C)C3)cc(=O)oc12 ZINC000056156175 850261703 /nfs/dbraw/zinc/26/17/03/850261703.db2.gz DSZBGOCTIGOPLW-QGZVFWFLSA-N 2 0 406.526 4.329 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)NCC2([NH+](C)C)CCCC2)cc1 ZINC000061115102 851297613 /nfs/dbraw/zinc/29/76/13/851297613.db2.gz YVEMXDWZBXMCBT-UHFFFAOYSA-N 2 0 408.590 4.089 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)N[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000061553789 851403777 /nfs/dbraw/zinc/40/37/77/851403777.db2.gz BZTTWTMKAYHKCT-VWLOTQADSA-N 2 0 420.601 4.136 20 0 HIADRP Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000061596622 851412331 /nfs/dbraw/zinc/41/23/31/851412331.db2.gz SXBFQTMLHNDJKM-UHFFFAOYSA-N 2 0 409.599 4.392 20 0 HIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000062252802 851517297 /nfs/dbraw/zinc/51/72/97/851517297.db2.gz CKMWQFZRULJCCB-IRXDYDNUSA-N 2 0 404.986 4.122 20 0 HIADRP C[C@@H](NC(=O)[C@@H](C)[NH+]1CCC(CC[NH+](C)C)CC1)c1ccc(Cl)cc1Cl ZINC000065431687 852130516 /nfs/dbraw/zinc/13/05/16/852130516.db2.gz ANLXVWMTEHEBMQ-HUUCEWRRSA-N 2 0 400.394 4.223 20 0 HIADRP CC[NH+](CC)Cc1cccc(NC(=O)c2ccc(N3CC[NH+](C(C)C)CC3)cc2)c1 ZINC000065749948 852244164 /nfs/dbraw/zinc/24/41/64/852244164.db2.gz KRDZMPPTDLJFBT-UHFFFAOYSA-N 2 0 408.590 4.311 20 0 HIADRP O=C(NCC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000065897321 852307692 /nfs/dbraw/zinc/30/76/92/852307692.db2.gz OPJUUTROHPLAPK-DEOSSOPVSA-N 2 0 423.576 4.066 20 0 HIADRP O=C(NC[C@H](c1ccccc1)[NH+]1CCCC1)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000072036185 852478944 /nfs/dbraw/zinc/47/89/44/852478944.db2.gz CVNGVCPRAZMJJZ-RUZDIDTESA-N 2 0 420.601 4.035 20 0 HIADRP COc1ccccc1[C@H](CNC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccc1)[NH+]1CCCCC1 ZINC000108934210 852895543 /nfs/dbraw/zinc/89/55/43/852895543.db2.gz DXTZVTYDYJYJJM-ZEQRLZLVSA-N 2 0 421.585 4.003 20 0 HIADRP c1ccc(-c2nnn(CCCCC[NH+]3CCC(C[NH+]4CCCCCC4)CC3)n2)cc1 ZINC000110793887 853152955 /nfs/dbraw/zinc/15/29/55/853152955.db2.gz ILWZYXJYIVONJV-UHFFFAOYSA-N 2 0 410.610 4.098 20 0 HIADRP C[C@H]([NH2+]C1CCN(c2ccccn2)CC1)c1ccc(I)cc1 ZINC000195616218 853716459 /nfs/dbraw/zinc/71/64/59/853716459.db2.gz QDUXCYYTUFCNIW-AWEZNQCLSA-N 2 0 407.299 4.006 20 0 HIADRP O=C(NCC1CC[NH+](Cc2ccccc2)CC1)N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000195664393 853745524 /nfs/dbraw/zinc/74/55/24/853745524.db2.gz ZMXWJCVOTWITJC-RUZDIDTESA-N 2 0 420.601 4.035 20 0 HIADRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC000236651999 853907305 /nfs/dbraw/zinc/90/73/05/853907305.db2.gz XCETXHLDDAFEQP-UHFFFAOYSA-N 2 0 417.981 4.316 20 0 HIADRP CC(C)(C)c1nc(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)cs1 ZINC000236723069 853916434 /nfs/dbraw/zinc/91/64/34/853916434.db2.gz WEUDMOMKDMNKBC-UHFFFAOYSA-N 2 0 400.636 4.128 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cc(N(C)C)nc3ccccc23)CC1 ZINC000236814086 853925821 /nfs/dbraw/zinc/92/58/21/853925821.db2.gz DNWXYXDKCCZXOG-UHFFFAOYSA-N 2 0 417.601 4.123 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(N3CCCCC3=O)cc2)CC1 ZINC000236814494 853925953 /nfs/dbraw/zinc/92/59/53/853925953.db2.gz KITPQIKFTIKETF-UHFFFAOYSA-N 2 0 420.601 4.025 20 0 HIADRP CCOc1ccccc1C[NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000236938777 853940425 /nfs/dbraw/zinc/94/04/25/853940425.db2.gz DNFTWKTWYJJCIB-UHFFFAOYSA-N 2 0 407.480 4.146 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000236949305 853941511 /nfs/dbraw/zinc/94/15/11/853941511.db2.gz SMUKESXEYFRTPP-KRWDZBQOSA-N 2 0 420.395 4.072 20 0 HIADRP CCOc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)cc1OC ZINC000237006991 853950194 /nfs/dbraw/zinc/95/01/94/853950194.db2.gz YAMHGYMAVQHBKY-SFHVURJKSA-N 2 0 415.553 4.226 20 0 HIADRP C[NH+](C)Cc1cc(C[NH2+]CC2=Cc3cc(Br)ccc3OC2)ccc1F ZINC000237063103 853958695 /nfs/dbraw/zinc/95/86/95/853958695.db2.gz MDVBIZLQDCCAEQ-UHFFFAOYSA-N 2 0 405.311 4.215 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2cc3cc(F)ccc3o2)c1)C1CCOCC1 ZINC000237205878 853982273 /nfs/dbraw/zinc/98/22/73/853982273.db2.gz YXHGTDPCSZAOJJ-UHFFFAOYSA-N 2 0 412.505 4.351 20 0 HIADRP COc1cc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)ccc1OCc1c(C)noc1C ZINC000237211024 853983301 /nfs/dbraw/zinc/98/33/01/853983301.db2.gz DVSICWDBGWFAJP-QGZVFWFLSA-N 2 0 401.551 4.091 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(OC[C@@H]3CCCO3)cc2)C[C@@H](C)O1 ZINC000237574633 854057241 /nfs/dbraw/zinc/05/72/41/854057241.db2.gz WLTDNLNDXIFNIK-YPCDYVTLSA-N 2 0 424.585 4.143 20 0 HIADRP Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000237608891 854061245 /nfs/dbraw/zinc/06/12/45/854061245.db2.gz QKOSJPXMJITHGH-CALCHBBNSA-N 2 0 422.976 4.011 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(Br)s2)C[C@H](C)O1 ZINC000237621392 854063811 /nfs/dbraw/zinc/06/38/11/854063811.db2.gz DKQAKKDCOBFKPE-GASCZTMLSA-N 2 0 409.393 4.410 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)[C@H]2CCC[N@H+](Cc3cccc(F)c3)C2)cc1 ZINC000303080270 854751205 /nfs/dbraw/zinc/75/12/05/854751205.db2.gz UPGXLUGIEAFEGV-QHCPKHFHSA-N 2 0 411.565 4.196 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000303212991 854819535 /nfs/dbraw/zinc/81/95/35/854819535.db2.gz PJMGECHNDSBDEE-QFIPXVFZSA-N 2 0 414.638 4.182 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCC[NH+]2Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303767635 855185632 /nfs/dbraw/zinc/18/56/32/855185632.db2.gz QBLJLAMIMFVEIG-NQHRYMMQSA-N 2 0 405.586 4.163 20 0 HIADRP C[C@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309805432 855364221 /nfs/dbraw/zinc/36/42/21/855364221.db2.gz UFGNIXHSRZCZCL-KIZRIRGWSA-N 2 0 401.595 4.132 20 0 HIADRP C[C@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309712030 855364476 /nfs/dbraw/zinc/36/44/76/855364476.db2.gz JQRLETARHARGBN-CEMLEFRQSA-N 2 0 401.595 4.276 20 0 HIADRP C[C@@H](CCCNC(=O)OC(C)(C)C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390526224 855454693 /nfs/dbraw/zinc/45/46/93/855454693.db2.gz CNQQJIZIDQIJBW-BHGTWAMESA-N 2 0 401.595 4.465 20 0 HIADRP CC(C)(C)OC(=O)NC[C@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390538412 855454715 /nfs/dbraw/zinc/45/47/15/855454715.db2.gz GSMGSDRYZSSJHZ-XCFNNZSKSA-N 2 0 413.606 4.465 20 0 HIADRP OC1(C[NH2+][C@H]2CCc3ccc(Br)cc32)CC[NH+](Cc2ccccc2)CC1 ZINC000397587790 855472989 /nfs/dbraw/zinc/47/29/89/855472989.db2.gz HYWJPONCZZHWGG-NRFANRHFSA-N 2 0 415.375 4.053 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000398045424 855474848 /nfs/dbraw/zinc/47/48/48/855474848.db2.gz VLLTXPSIHNMLNS-BAGYTPMASA-N 2 0 401.595 4.134 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@H](c2ccccc2)[NH+](C)C)cc1 ZINC000410344081 855939317 /nfs/dbraw/zinc/93/93/17/855939317.db2.gz HIXXEGFBWFDCQK-GBXCKJPGSA-N 2 0 408.590 4.163 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C[C@H](C)O1 ZINC000425960574 856019297 /nfs/dbraw/zinc/01/92/97/856019297.db2.gz XVCPTKCGMICMCD-YYDVJCTNSA-N 2 0 401.982 4.498 20 0 HIADRP Cc1ccc2cc([C@H](C)[NH2+]Cc3cccc(C[N@@H+]4CCC[C@H](C(N)=O)C4)c3)oc2c1 ZINC000426029709 856056672 /nfs/dbraw/zinc/05/66/72/856056672.db2.gz LKOPHAZPHHNUEC-AVRDEDQJSA-N 2 0 405.542 4.289 20 0 HIADRP COc1ccc(CC[C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)cc1O ZINC000426394887 856273093 /nfs/dbraw/zinc/27/30/93/856273093.db2.gz KRUKCFZIMZYGDW-UFYCRDLUSA-N 2 0 412.574 4.121 20 0 HIADRP Cc1ccc([C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C2CCC2)cc1 ZINC000427698969 856913615 /nfs/dbraw/zinc/91/36/15/856913615.db2.gz RZCNZMIFIRJHBA-VWLOTQADSA-N 2 0 405.586 4.452 20 0 HIADRP O=C(c1ccco1)N1CCC([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000428239065 857122800 /nfs/dbraw/zinc/12/28/00/857122800.db2.gz MWFSIDBIZPZRHZ-GMKZXUHWSA-N 2 0 421.585 4.165 20 0 HIADRP C[C@H]1C[C@H](NC(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1Cc1ccccc1 ZINC000428277221 857137251 /nfs/dbraw/zinc/13/72/51/857137251.db2.gz PKRAQGUAUMAIAB-SQJMNOBHSA-N 2 0 420.601 4.135 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000428653480 857290463 /nfs/dbraw/zinc/29/04/63/857290463.db2.gz WTZCTBXFYULHFV-HYVLGVRCSA-N 2 0 414.638 4.097 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H](Cc3ccccc3F)c3ccccc3)ccn2)CC1 ZINC000429518206 857712867 /nfs/dbraw/zinc/71/28/67/857712867.db2.gz IEEFXSDIWGDYQO-XMMPIXPASA-N 2 0 404.533 4.046 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)CC1 ZINC000429520278 857713821 /nfs/dbraw/zinc/71/38/21/857713821.db2.gz XKTOIBABWCTSSL-XMMPIXPASA-N 2 0 404.533 4.046 20 0 HIADRP CC[N@H+](CCC1CC[NH+](Cc2cnc(-c3ccccc3OC)nc2)CC1)CC1CC1 ZINC000430235276 858091911 /nfs/dbraw/zinc/09/19/11/858091911.db2.gz CQTBZQBYXKYMFG-UHFFFAOYSA-N 2 0 408.590 4.486 20 0 HIADRP Cc1ccc(NC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c(OCC[NH+](C)C)c1 ZINC000431196358 858498612 /nfs/dbraw/zinc/49/86/12/858498612.db2.gz LERCVHKVONBRFE-IFMALSPDSA-N 2 0 424.589 4.110 20 0 HIADRP CC(C)[NH+](CCCNC(=O)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)C(C)C ZINC000431279166 858544015 /nfs/dbraw/zinc/54/40/15/858544015.db2.gz DGNRDVOGVUYQLJ-UHFFFAOYSA-N 2 0 414.638 4.193 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCOc4c(C)cc(Cl)cc43)cn2)CC1 ZINC000431326378 858567003 /nfs/dbraw/zinc/56/70/03/858567003.db2.gz BSNOYIQRSHXNBY-NRFANRHFSA-N 2 0 414.981 4.189 20 0 HIADRP C[C@H](CC[N@@H+]1CCCN(c2ccccc2)CC1)[NH+]1CCCN(c2ccccc2)CC1 ZINC000431617037 858692045 /nfs/dbraw/zinc/69/20/45/858692045.db2.gz LJKXVEGGRSPRJT-XMMPIXPASA-N 2 0 406.618 4.190 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000431619841 858693870 /nfs/dbraw/zinc/69/38/70/858693870.db2.gz JCMWPEZHIWMXRR-UHFFFAOYSA-N 2 0 414.638 4.051 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000432411608 859151982 /nfs/dbraw/zinc/15/19/82/859151982.db2.gz ZNKURPJFMLUFSI-PUPGKCOFSA-N 2 0 407.396 4.053 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(C)c2ccc(OCC[NH+]3CCCC3)cc2)cc1)C1CC1 ZINC000434180775 860173310 /nfs/dbraw/zinc/17/33/10/860173310.db2.gz DMQVDRLNAPWLIH-UHFFFAOYSA-N 2 0 421.585 4.422 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCC(F)(c2ccccc2)CC1 ZINC000434494165 860371423 /nfs/dbraw/zinc/37/14/23/860371423.db2.gz NQYCBYCYIJNFCT-OAQYLSRUSA-N 2 0 423.576 4.117 20 0 HIADRP CC1CC[NH+](C2CCC([NH2+][C@H](c3ccc(Cl)cc3)[C@H]3CN(C)CCO3)CC2)CC1 ZINC000467734921 881536753 /nfs/dbraw/zinc/53/67/53/881536753.db2.gz KGKGKDMXSMXMLW-SNDHGLFQSA-N 2 0 420.041 4.344 20 0 HIADRP C[C@H]([NH2+]CCCN1CC[N@H+](C)C[C@@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000467738098 881541404 /nfs/dbraw/zinc/54/14/04/881541404.db2.gz RFFQOPMAJFYUMV-DOTOQJQBSA-N 2 0 412.525 4.191 20 0 HIADRP O=C(NC[C@@H]1CCC[N@@H+]1C1CCCCC1)Nc1nc(CN2CCCCC2)cs1 ZINC000435768593 861044380 /nfs/dbraw/zinc/04/43/80/861044380.db2.gz FCKMBPNUYVKPMI-IBGZPJMESA-N 2 0 405.612 4.048 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC(C)C)c(Cl)c1 ZINC000437901177 863272886 /nfs/dbraw/zinc/27/28/86/863272886.db2.gz JXACVRVVFNOTRM-GOSISDBHSA-N 2 0 410.990 4.007 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NC[C@@H]2CCC[NH+]2C2CCCCC2)[C@H]1c1cccs1 ZINC000438159575 863579481 /nfs/dbraw/zinc/57/94/81/863579481.db2.gz YITBVEIFQPXJSJ-CBQOVEMMSA-N 2 0 418.651 4.227 20 0 HIADRP Cc1ccccc1CN(C)C(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000439594293 864915206 /nfs/dbraw/zinc/91/52/06/864915206.db2.gz KMUHXAZXHADXIA-NRFANRHFSA-N 2 0 419.569 4.357 20 0 HIADRP Cc1nc(NC(=O)[C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)sc1C ZINC000439612906 864936743 /nfs/dbraw/zinc/93/67/43/864936743.db2.gz ULPSPLMAFULUEQ-MRXNPFEDSA-N 2 0 412.559 4.102 20 0 HIADRP CC(C)C[C@H](CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)[NH2+][C@@H](C)c1ccccc1 ZINC000468023421 881857855 /nfs/dbraw/zinc/85/78/55/881857855.db2.gz AYZQBBGSFORPGM-IEXKNLJHSA-N 2 0 400.611 4.066 20 0 HIADRP CC(C)C[C@@H](CNC(=O)N1CCC([NH+]2CCCC2)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000468031377 881863466 /nfs/dbraw/zinc/86/34/66/881863466.db2.gz VRQPCGSAKGPIFN-UNMCSNQZSA-N 2 0 400.611 4.022 20 0 HIADRP Cc1ccc(NC2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)cc1NC(=O)CC[NH+](C)C ZINC000468041854 881871508 /nfs/dbraw/zinc/87/15/08/881871508.db2.gz ZGKQREVTTWHHNZ-XMSQKQJNSA-N 2 0 400.611 4.340 20 0 HIADRP CSc1ccccc1[C@H](C)[NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000440615822 865840763 /nfs/dbraw/zinc/84/07/63/865840763.db2.gz CPBVJKUJHYSSFX-OALUTQOASA-N 2 0 411.615 4.228 20 0 HIADRP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CC[C@H](C)[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000441273071 866346952 /nfs/dbraw/zinc/34/69/52/866346952.db2.gz WEBHVOOTVIQANF-KKSFZXQISA-N 2 0 411.512 4.077 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442779267 867672520 /nfs/dbraw/zinc/67/25/20/867672520.db2.gz LSZNELKVUVEXSB-GHTZIAJQSA-N 2 0 418.507 4.278 20 0 HIADRP COCCC[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(F)cc1 ZINC000442781856 867672637 /nfs/dbraw/zinc/67/26/37/867672637.db2.gz KDAOCRYTNUJKSR-DEOSSOPVSA-N 2 0 400.538 4.040 20 0 HIADRP C[C@@H]([NH2+]CCN1CC[N@H+](C)C(C)(C)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000442877626 867712620 /nfs/dbraw/zinc/71/26/20/867712620.db2.gz RIJATLQJJBVEGX-CYBMUJFWSA-N 2 0 411.434 4.401 20 0 HIADRP C[C@H](C(=O)N1CCC[C@H]1c1cccs1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443602539 868161718 /nfs/dbraw/zinc/16/17/18/868161718.db2.gz PNZURUTWGMXPQS-CTNGQTDRSA-N 2 0 403.636 4.388 20 0 HIADRP CCC(CC)(CNC(=O)NCC1CC[NH+](C2CC2)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000444971178 869134414 /nfs/dbraw/zinc/13/44/14/869134414.db2.gz WUCBPSSVMKMOBO-IBGZPJMESA-N 2 0 400.611 4.070 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000446575794 870486110 /nfs/dbraw/zinc/48/61/10/870486110.db2.gz LNZKMQPGYPNAQI-RXVVDRJESA-N 2 0 400.592 4.057 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cc2ccccc2s1 ZINC000446819621 870734892 /nfs/dbraw/zinc/73/48/92/870734892.db2.gz YTQPARBWXVCPBP-DYESRHJHSA-N 2 0 407.583 4.449 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000446819854 870734984 /nfs/dbraw/zinc/73/49/84/870734984.db2.gz VWEGDLVMUMPLHY-LJQANCHMSA-N 2 0 414.819 4.171 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]CC1(N3CCCCC3)CC[NH+](C)CC1)CCCS2 ZINC000446843083 870761769 /nfs/dbraw/zinc/76/17/69/870761769.db2.gz JMUOOKVJGKVXON-OAQYLSRUSA-N 2 0 403.636 4.162 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(Br)cc1F ZINC000446881174 870802012 /nfs/dbraw/zinc/80/20/12/870802012.db2.gz NRHMNEBIMGAIMG-KDOFPFPSSA-N 2 0 407.327 4.006 20 0 HIADRP OC[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1c(F)cccc1Cl ZINC000447545296 871413181 /nfs/dbraw/zinc/41/31/81/871413181.db2.gz QUQQFQSFPGSVBT-MXEMCNAFSA-N 2 0 416.968 4.415 20 0 HIADRP CC(C)(O)C[N@@H+]1CCc2c(cccc2N[C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000447599838 871508338 /nfs/dbraw/zinc/50/83/38/871508338.db2.gz YWXMONYTOXBHNS-JOZNFPNDSA-N 2 0 419.613 4.423 20 0 HIADRP c1cc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)n(-c2ccccc2)n1 ZINC000447938282 871818485 /nfs/dbraw/zinc/81/84/85/871818485.db2.gz ZRJQXLRAZMRSKG-UHFFFAOYSA-N 2 0 404.558 4.033 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)N3CC[C@@H]4[C@@H](CCC[N@@H+]4C4CC4)C3)cc2)CC1 ZINC000448203793 872095707 /nfs/dbraw/zinc/09/57/07/872095707.db2.gz YVSGBPLQHBQHMA-UKILVPOCSA-N 2 0 424.633 4.077 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@H](C)C2)[C@@H](C)C1 ZINC000448461587 872423638 /nfs/dbraw/zinc/42/36/38/872423638.db2.gz MKENMWCUFRBYTG-XARGGIHNSA-N 2 0 414.638 4.036 20 0 HIADRP CCN(C(=O)NC[C@@H]1CCC[NH+](CC(C)C)C1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000448467167 872441793 /nfs/dbraw/zinc/44/17/93/872441793.db2.gz PKYCLGNBWUQUBV-FIXSFTCYSA-N 2 0 414.638 4.221 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N(C)[C@H]2CC[NH+](CC)C[C@@H]2C)c1 ZINC000448524495 872517214 /nfs/dbraw/zinc/51/72/14/872517214.db2.gz IOANNEJWNFWKFD-REWPJTCUSA-N 2 0 402.627 4.180 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CCCc1nc(-c2ccccc2)no1 ZINC000460344458 872960234 /nfs/dbraw/zinc/96/02/34/872960234.db2.gz BNNPUQKIMIANDI-WOJBJXKFSA-N 2 0 404.558 4.415 20 0 HIADRP O=C(NC[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(C[NH+]2CCCC2)c1 ZINC000461469759 874525408 /nfs/dbraw/zinc/52/54/08/874525408.db2.gz PPMJXGKZDHZOKJ-DEOSSOPVSA-N 2 0 405.586 4.315 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCSCC2)cc1)[C@@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000468746728 882840218 /nfs/dbraw/zinc/84/02/18/882840218.db2.gz AJZJFWRZDXXVCI-DEOSSOPVSA-N 2 0 423.626 4.271 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)NC[C@H](c2cccc(C(F)(F)F)c2)[NH+](C)C)c1 ZINC000468861455 882895171 /nfs/dbraw/zinc/89/51/71/882895171.db2.gz FWXSFCCGCCUSNI-LJQANCHMSA-N 2 0 408.468 4.191 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@H](C)C1 ZINC000462813584 875856270 /nfs/dbraw/zinc/85/62/70/875856270.db2.gz APQWSWARTWNLMG-KRZXBLKESA-N 2 0 409.412 4.422 20 0 HIADRP Cc1[nH+]c2ccc(Br)cc2c(N2CCC[C@@H](C[NH+]3CCOCC3)C2)c1C ZINC000462834847 875869940 /nfs/dbraw/zinc/86/99/40/875869940.db2.gz AWBHOJOLBXGFCH-KRWDZBQOSA-N 2 0 418.379 4.163 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(OC(C)(C)C)cc1 ZINC000463027036 876045682 /nfs/dbraw/zinc/04/56/82/876045682.db2.gz BTWNPUICHVKBJC-AUSIDOKSSA-N 2 0 423.601 4.412 20 0 HIADRP Clc1ccccc1CN1CCC([NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)CC1 ZINC000463106562 876144813 /nfs/dbraw/zinc/14/48/13/876144813.db2.gz AOGOCFUEQRMKCU-JOCHJYFZSA-N 2 0 412.021 4.459 20 0 HIADRP Clc1ccc(CN2CCC([NH2+]C[C@H]3CC[N@H+](CCc4ccccc4)C3)CC2)cc1 ZINC000463113396 876153361 /nfs/dbraw/zinc/15/33/61/876153361.db2.gz CFRSEJDHPRGDOS-HSZRJFAPSA-N 2 0 412.021 4.459 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CCN(Cc3ccccc3Cl)CC2)[C@H](C)C1 ZINC000463126182 876169380 /nfs/dbraw/zinc/16/93/80/876169380.db2.gz YXMWQCLAPKUYQT-XXBNENTESA-N 2 0 408.030 4.031 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2nc3ccc(Br)cc3o2)CC1 ZINC000463160477 876216161 /nfs/dbraw/zinc/21/61/61/876216161.db2.gz FCHCOYMTBCCAPW-UHFFFAOYSA-N 2 0 424.383 4.161 20 0 HIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc(Br)cc(Br)c1N ZINC000463245164 876301427 /nfs/dbraw/zinc/30/14/27/876301427.db2.gz XNSDNVBGZOGMMX-LBPRGKRZSA-N 2 0 421.221 4.394 20 0 HIADRP O=C(c1ccccc1Cl)N1CCC([NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)CC1 ZINC000463252884 876309142 /nfs/dbraw/zinc/30/91/42/876309142.db2.gz XQRAZKVFBKJOJE-HXUWFJFHSA-N 2 0 403.998 4.331 20 0 HIADRP COc1ccc(Cn2nc(C)c(C[NH2+]CC3CC[NH+](CCC(C)C)CC3)c2C)cc1 ZINC000463739730 876860795 /nfs/dbraw/zinc/86/07/95/876860795.db2.gz PCMRGPMNBRMHGA-UHFFFAOYSA-N 2 0 412.622 4.405 20 0 HIADRP C[N@H+](C[C@H](O)COc1cc(Cl)ccc1Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464848691 878123920 /nfs/dbraw/zinc/12/39/20/878123920.db2.gz MTSYVHKCWKLJHE-ICSRJNTNSA-N 2 0 423.384 4.187 20 0 HIADRP C[N@H+](C[C@@H](O)COc1cc(Cl)ccc1Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464848695 878124820 /nfs/dbraw/zinc/12/48/20/878124820.db2.gz MTSYVHKCWKLJHE-UYAOXDASSA-N 2 0 423.384 4.187 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+]C(C)(C)CCc2ccccc2)CC1 ZINC000464877302 878165993 /nfs/dbraw/zinc/16/59/93/878165993.db2.gz IRIDIFVCBINLCA-UHFFFAOYSA-N 2 0 407.602 4.077 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)C1 ZINC000503389099 912371777 /nfs/dbraw/zinc/37/17/77/912371777.db2.gz QTBYSCHAWNQGRH-DNVJHFABSA-N 2 0 406.659 4.042 20 0 HIADRP CC1CC[NH+](CCSc2nnc(SCC[NH+]3CCC(C)CC3)s2)CC1 ZINC000465471469 878908401 /nfs/dbraw/zinc/90/84/01/878908401.db2.gz SKBGENGGHAGQCT-UHFFFAOYSA-N 2 0 400.683 4.186 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)C1 ZINC000465537026 878997020 /nfs/dbraw/zinc/99/70/20/878997020.db2.gz GERXVVMGIQRAPW-VSKRKVRLSA-N 2 0 414.638 4.038 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N(C)CC[C@H]2CCCC[NH+]2C)cc1 ZINC000465557858 879027318 /nfs/dbraw/zinc/02/73/18/879027318.db2.gz KDLIOMVNAYQEMC-NZQKXSOJSA-N 2 0 400.611 4.077 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCc1ccc(C[NH+]3CCC[C@@H](C)C3)cc1)CC2 ZINC000465562367 879035168 /nfs/dbraw/zinc/03/51/68/879035168.db2.gz FKKSKVCGZQMEQM-HUVFLSCGSA-N 2 0 412.622 4.075 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)cc1 ZINC000465640236 879157074 /nfs/dbraw/zinc/15/70/74/879157074.db2.gz VWFMIJRYSCAPNW-JOCHJYFZSA-N 2 0 422.617 4.334 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NC[C@H](c1ccccc1)[NH+]1CCC(C)CC1)CC2 ZINC000465727064 879304723 /nfs/dbraw/zinc/30/47/23/879304723.db2.gz QMCKQONDZVQWIK-TZRRMPRUSA-N 2 0 412.622 4.116 20 0 HIADRP CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)NC[C@H]1CCC[NH+](C)[C@@H]1c1cccs1 ZINC000465871809 879523714 /nfs/dbraw/zinc/52/37/14/879523714.db2.gz JHYWUTFUWASBOB-SBHAEUEKSA-N 2 0 406.640 4.085 20 0 HIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC000465888945 879543776 /nfs/dbraw/zinc/54/37/76/879543776.db2.gz MORYELWURWOJNU-FYYLOGMGSA-N 2 0 414.638 4.051 20 0 HIADRP CCC(CC)(CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)[NH2+][C@@H](C)c1ccccc1 ZINC000465922438 879584854 /nfs/dbraw/zinc/58/48/54/879584854.db2.gz IBOIIMWOLSUNKU-BHGTWAMESA-N 2 0 400.611 4.211 20 0 HIADRP CC1CCC([NH+]2CCN(C(=O)NC[C@@H]3CCC[N@H+](C)[C@@H]3c3cccs3)CC2)CC1 ZINC000466084506 879803552 /nfs/dbraw/zinc/80/35/52/879803552.db2.gz ZUHYLHDONYXEPZ-OYZUSSLQSA-N 2 0 418.651 4.037 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CCC[C@@H]([C@H]4CCOC4)C3)CC2)cc1 ZINC000466347620 880104581 /nfs/dbraw/zinc/10/45/81/880104581.db2.gz SGGOULPSLMVNIL-TZRRMPRUSA-N 2 0 400.607 4.243 20 0 HIADRP C[NH+](C)CCc1ccc(CNC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)cc1 ZINC000466423199 880196806 /nfs/dbraw/zinc/19/68/06/880196806.db2.gz XQVZAJUNBJTGRT-UHFFFAOYSA-N 2 0 408.590 4.141 20 0 HIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+]Cc2cncc(Br)c2)CC1 ZINC000466462837 880243572 /nfs/dbraw/zinc/24/35/72/880243572.db2.gz HTJGFWJNCYOLRN-UHFFFAOYSA-N 2 0 408.771 4.499 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CNc1ccc(CN(C)C)c(Br)c1 ZINC000466724750 880510841 /nfs/dbraw/zinc/51/08/41/880510841.db2.gz LFGCKSPULCSWLB-UHFFFAOYSA-N 2 0 400.324 4.012 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)NCc3ccc(CC[NH+](C)C)cc3)c2)CC1 ZINC000467014107 880817970 /nfs/dbraw/zinc/81/79/70/880817970.db2.gz MDQCBKUXEBVZER-UHFFFAOYSA-N 2 0 422.617 4.022 20 0 HIADRP C[C@H]([NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)c1cc2ccccc2o1 ZINC000467278922 881023309 /nfs/dbraw/zinc/02/33/09/881023309.db2.gz BMZHFKVAOSZWPF-KRWDZBQOSA-N 2 0 409.555 4.271 20 0 HIADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C1 ZINC000467336091 881086387 /nfs/dbraw/zinc/08/63/87/881086387.db2.gz NSDUOBASHXPQDA-DNQXCXABSA-N 2 0 420.601 4.032 20 0 HIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000467341315 881092217 /nfs/dbraw/zinc/09/22/17/881092217.db2.gz DLCNQOCWRSGXAZ-YCRPNKLZSA-N 2 0 401.501 4.063 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H]2CCc3cc(F)c(OC)cc32)CC1 ZINC000467349721 881104920 /nfs/dbraw/zinc/10/49/20/881104920.db2.gz YJRVLGLPEWIGGE-OPAMFIHVSA-N 2 0 415.528 4.453 20 0 HIADRP C[C@H](Cn1cc(Br)cn1)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000469302561 883401478 /nfs/dbraw/zinc/40/14/78/883401478.db2.gz SPDYLLUDOZCNOK-MRXNPFEDSA-N 2 0 417.351 4.049 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)N1CCC(CC[NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000469492472 883733709 /nfs/dbraw/zinc/73/37/09/883733709.db2.gz SJPBXWXGXWRZJP-HXUWFJFHSA-N 2 0 413.528 4.279 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C(=O)Nc3ccccc3)cc2)[C@@H](C)C1 ZINC000469769264 883942954 /nfs/dbraw/zinc/94/29/54/883942954.db2.gz OHGRMPRDZRQQNM-RDPSFJRHSA-N 2 0 409.574 4.166 20 0 HIADRP CCC[NH+]1CCC(N(C)C(=O)NCC(CC)(CC)[NH2+][C@@H](C)c2ccccc2)CC1 ZINC000503710857 912806265 /nfs/dbraw/zinc/80/62/65/912806265.db2.gz YUVBQOSCSWVJCG-FQEVSTJZSA-N 2 0 402.627 4.412 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)N2CCC(C[NH+]3CCCC3)CC2)CCCC1)c1ccccc1 ZINC000503742799 912813627 /nfs/dbraw/zinc/81/36/27/912813627.db2.gz VSYYORFJJSTNNE-OAQYLSRUSA-N 2 0 412.622 4.167 20 0 HIADRP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1oc2ccccc2c1C[NH+](C)C ZINC000470546378 884956830 /nfs/dbraw/zinc/95/68/30/884956830.db2.gz LJRHPTUAQOWPMP-FQEVSTJZSA-N 2 0 405.542 4.089 20 0 HIADRP CN(C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470737114 885194004 /nfs/dbraw/zinc/19/40/04/885194004.db2.gz MVDOOOHUFUEYOI-PKTZIBPZSA-N 2 0 424.589 4.113 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000470740481 885200130 /nfs/dbraw/zinc/20/01/30/885200130.db2.gz MLKHDPWJPITCPF-RUZDIDTESA-N 2 0 422.617 4.334 20 0 HIADRP CN(C(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470747230 885211477 /nfs/dbraw/zinc/21/14/77/885211477.db2.gz ZHRIEEPZCSIAAK-LOSJGSFVSA-N 2 0 420.601 4.130 20 0 HIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CCC(=O)N[C@H](c2cccs2)c2ccccc2)C1 ZINC000470972620 885473316 /nfs/dbraw/zinc/47/33/16/885473316.db2.gz YMLJBYREDZMTSM-RDPSFJRHSA-N 2 0 411.615 4.008 20 0 HIADRP CCCc1cccc(C(C)C)c1NC(=O)NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000471896460 886678811 /nfs/dbraw/zinc/67/88/11/886678811.db2.gz ORFABRJJCGNALA-UHFFFAOYSA-N 2 0 423.605 4.491 20 0 HIADRP C[N@@H+]1CC[C@@H](NC(=O)Nc2ccc(OCC[NH+]3CCCCC3)cc2)[C@H]1c1ccccc1 ZINC000471929858 886722813 /nfs/dbraw/zinc/72/28/13/886722813.db2.gz NRCGJBUWBWXBRQ-DNQXCXABSA-N 2 0 422.573 4.118 20 0 HIADRP CC[NH+](CC)CCO[C@H]1CC[N@@H+]([C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1 ZINC000472257601 887067835 /nfs/dbraw/zinc/06/78/35/887067835.db2.gz IIBMHKWUHNQDBD-YKSBVNFPSA-N 2 0 409.574 4.433 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH+]2CCC(Nc3nc(C)cs3)CC2)CC1 ZINC000473065736 887886442 /nfs/dbraw/zinc/88/64/42/887886442.db2.gz QCDOXGXSUGTAPU-UHFFFAOYSA-N 2 0 413.635 4.060 20 0 HIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000474061744 888895481 /nfs/dbraw/zinc/89/54/81/888895481.db2.gz DJBMNJORCKHELL-XMMPIXPASA-N 2 0 421.585 4.033 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccc(Cl)cc2-n2cncn2)CC1 ZINC000474274401 889138142 /nfs/dbraw/zinc/13/81/42/889138142.db2.gz XCEKMNPYJFTZKX-UHFFFAOYSA-N 2 0 409.965 4.265 20 0 HIADRP CC(C)[NH+]1CCC([NH2+][C@H](C)CCc2ccc(I)cc2)CC1 ZINC000474467574 889330320 /nfs/dbraw/zinc/33/03/20/889330320.db2.gz BYAPQYRWXFZREO-OAHLLOKOSA-N 2 0 400.348 4.075 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)[C@@H]3C[C@H]3c3ccc(Cl)s3)cn2)CC1 ZINC000474484248 889344731 /nfs/dbraw/zinc/34/47/31/889344731.db2.gz HDARGUWOXQBFSL-RYQLBKOJSA-N 2 0 405.011 4.220 20 0 HIADRP Fc1ccc(-n2nccc2C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000474814825 889667208 /nfs/dbraw/zinc/66/72/08/889667208.db2.gz ZDSBFHXBBGDHAB-UHFFFAOYSA-N 2 0 422.548 4.172 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccc(Cl)cc1-n1cncn1 ZINC000474824196 889678106 /nfs/dbraw/zinc/67/81/06/889678106.db2.gz YUNQQSPGNJWHOD-UHFFFAOYSA-N 2 0 421.932 4.436 20 0 HIADRP CCN(C(=O)NCc1ccc(C[NH+]2CCCC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475007915 889860613 /nfs/dbraw/zinc/86/06/13/889860613.db2.gz JWMQBNKKXHRQHO-VWLOTQADSA-N 2 0 420.601 4.088 20 0 HIADRP CN(C(=O)NCc1ccccc1C[NH+]1CCCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475013898 889866907 /nfs/dbraw/zinc/86/69/07/889866907.db2.gz NGLPEJYDNVCYDP-VWLOTQADSA-N 2 0 420.601 4.088 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475279149 890175651 /nfs/dbraw/zinc/17/56/51/890175651.db2.gz KZAWCZRQOACHBG-HKUYNNGSSA-N 2 0 415.965 4.177 20 0 HIADRP COc1cc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OCc1ccncc1 ZINC000475286096 890185412 /nfs/dbraw/zinc/18/54/12/890185412.db2.gz OWXLBBPDTGGNIX-XMMPIXPASA-N 2 0 417.553 4.281 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H](C)c2cc3cccc(F)c3o2)CC1 ZINC000475705185 890643641 /nfs/dbraw/zinc/64/36/41/890643641.db2.gz SQSXUCRDJRIXFN-GOSISDBHSA-N 2 0 423.532 4.312 20 0 HIADRP c1ccc(C[NH+]2CCC[C@@]3(CC[N@@H+](CCc4nc(-c5ccccc5)no4)C3)C2)cc1 ZINC000475731450 890670758 /nfs/dbraw/zinc/67/07/58/890670758.db2.gz VHTANRMZIBNYDQ-VWLOTQADSA-N 2 0 402.542 4.267 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000475970823 890889169 /nfs/dbraw/zinc/88/91/69/890889169.db2.gz FECWCKPCUBKMDV-UHFFFAOYSA-N 2 0 412.622 4.269 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000476008139 890936877 /nfs/dbraw/zinc/93/68/77/890936877.db2.gz PWXSNRNZPSOWRR-RTWAWAEBSA-N 2 0 404.643 4.080 20 0 HIADRP Cc1ccccc1[C@H]([C@H](C)NC(=O)NCc1ccccc1C[NH+]1CCCC1)[NH+](C)C ZINC000476908241 891860829 /nfs/dbraw/zinc/86/08/29/891860829.db2.gz UNLLZTUYHZQXIQ-RDPSFJRHSA-N 2 0 408.590 4.081 20 0 HIADRP Cc1ccccc1[C@@H]([C@@H](C)NC(=O)[C@@H]1C[N@@H+](C(C)(C)C)C[C@H]1C(F)(F)F)[NH+](C)C ZINC000504984596 913730500 /nfs/dbraw/zinc/73/05/00/913730500.db2.gz GXUPHVKESPTQSI-NXWXRZEISA-N 2 0 413.528 4.011 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CC(=O)N2CCc3[nH]c4ccccc4c3C2)CC1 ZINC000478035199 893166148 /nfs/dbraw/zinc/16/61/48/893166148.db2.gz TYLXHINXQXEREL-FQEVSTJZSA-N 2 0 422.617 4.029 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000478615741 893877653 /nfs/dbraw/zinc/87/76/53/893877653.db2.gz AINPXJGLFUCEPY-QFIPXVFZSA-N 2 0 411.634 4.402 20 0 HIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCCc3nn(-c4ccccc4)cc32)cc1 ZINC000479058943 894317484 /nfs/dbraw/zinc/31/74/84/894317484.db2.gz KUBGGKRUIXRWPX-DEOSSOPVSA-N 2 0 404.558 4.370 20 0 HIADRP CC1(C)C[C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c2cc(Br)ccc21 ZINC000479062825 894324922 /nfs/dbraw/zinc/32/49/22/894324922.db2.gz OPZHMPMRTZKZQN-MGPUTAFESA-N 2 0 407.396 4.262 20 0 HIADRP CC[C@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479083031 894349129 /nfs/dbraw/zinc/34/91/29/894349129.db2.gz YDAGTUJFYGYDEN-KRWDZBQOSA-N 2 0 423.317 4.213 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479264343 894535169 /nfs/dbraw/zinc/53/51/69/894535169.db2.gz COHXOCYIMRDARN-AVRDEDQJSA-N 2 0 416.407 4.154 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](C)c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000479267377 894538348 /nfs/dbraw/zinc/53/83/48/894538348.db2.gz SZQRJFRSCOFVHD-ZIAGYGMSSA-N 2 0 422.333 4.145 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](C)c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000479267375 894539305 /nfs/dbraw/zinc/53/93/05/894539305.db2.gz SZQRJFRSCOFVHD-KGLIPLIRSA-N 2 0 422.333 4.145 20 0 HIADRP Brc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccccc1CN1CCOCC1 ZINC000479350892 894647355 /nfs/dbraw/zinc/64/73/55/894647355.db2.gz UQGZJSFUPKMNSE-JOCHJYFZSA-N 2 0 415.375 4.449 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NCCCCC[NH+]2CCCCC2)CC1 ZINC000479539053 894843379 /nfs/dbraw/zinc/84/33/79/894843379.db2.gz DCDQNNRJBQCPSL-JOCHJYFZSA-N 2 0 406.659 4.329 20 0 HIADRP COc1cccc([C@H](CN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)[NH+]2CCCC2)c1 ZINC000480083155 895441756 /nfs/dbraw/zinc/44/17/56/895441756.db2.gz ORJSVFMXUUPDLW-QGDZQMKYSA-N 2 0 407.602 4.332 20 0 HIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCN(Cc4ccccn4)C[C@@H]3C)cc2)CC1 ZINC000480256288 895666299 /nfs/dbraw/zinc/66/62/99/895666299.db2.gz ACENQHLYTYGUPE-BKMJKUGQSA-N 2 0 406.618 4.314 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480442348 895831503 /nfs/dbraw/zinc/83/15/03/895831503.db2.gz WULQVJKVLVDRSA-QGZVFWFLSA-N 2 0 404.551 4.066 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H](C)[C@@H](C)Oc1ccc(Cl)cc1Cl)N1CC[NH+](C)CC1 ZINC000480523253 895886950 /nfs/dbraw/zinc/88/69/50/895886950.db2.gz DUFVSDZFMNOGNF-FCEWJHQRSA-N 2 0 402.410 4.011 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H](C)c1ccc(SCC(F)(F)F)cc1)N1CC[NH+](C)CC1 ZINC000480544319 895905568 /nfs/dbraw/zinc/90/55/68/895905568.db2.gz ZFRKWUHUYGGOMZ-APWZRJJASA-N 2 0 403.558 4.264 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000480601293 895963954 /nfs/dbraw/zinc/96/39/54/895963954.db2.gz MTOYVHHUUITPKV-TVZXLZGTSA-N 2 0 406.618 4.456 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC[C@@H](C)C3)cc2)[C@@H](C)C1 ZINC000480600990 895964360 /nfs/dbraw/zinc/96/43/60/895964360.db2.gz MUPUSAFQYDWWBH-SLSDLSHTSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480603288 895968172 /nfs/dbraw/zinc/96/81/72/895968172.db2.gz DYLALQFQOPOLPH-SFTDATJTSA-N 2 0 421.651 4.166 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000480612354 895979123 /nfs/dbraw/zinc/97/91/23/895979123.db2.gz LQCYVTJIFXSIQP-DRLORSAXSA-N 2 0 406.618 4.456 20 0 HIADRP CSc1ccc([C@H](C[NH2+][C@@H]2CC[N@H+](C)C[C@@H]2C)N2CCc3sccc3C2)cc1 ZINC000480615797 895982221 /nfs/dbraw/zinc/98/22/21/895982221.db2.gz SZRVLPUZNJXELL-WTOYTKOKSA-N 2 0 415.672 4.499 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)C1 ZINC000480621959 895989848 /nfs/dbraw/zinc/98/98/48/895989848.db2.gz UQNLPBRDFQTAHE-DRLORSAXSA-N 2 0 406.618 4.314 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccccc1Br ZINC000480735426 896094971 /nfs/dbraw/zinc/09/49/71/896094971.db2.gz FPCDGBULXCPVPZ-FQEVSTJZSA-N 2 0 417.395 4.227 20 0 HIADRP C[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)C(c1ccccc1)c1ccccc1 ZINC000480734473 896095244 /nfs/dbraw/zinc/09/52/44/896095244.db2.gz PVCGRHKYTLLYNR-NRFANRHFSA-N 2 0 400.570 4.144 20 0 HIADRP C[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)C(c1ccccc1)c1ccccc1 ZINC000480734475 896095831 /nfs/dbraw/zinc/09/58/31/896095831.db2.gz PVCGRHKYTLLYNR-OAQYLSRUSA-N 2 0 400.570 4.144 20 0 HIADRP CCC[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1cccc(C(F)(F)F)c1 ZINC000480735820 896097137 /nfs/dbraw/zinc/09/71/37/896097137.db2.gz ADZLLMHLPAYFDV-HXUWFJFHSA-N 2 0 406.496 4.483 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H]3CCCSc4ccc(Cl)cc43)ccn2)CC1 ZINC000480740011 896100912 /nfs/dbraw/zinc/10/09/12/896100912.db2.gz VAWWDPFLIKHKBY-LJQANCHMSA-N 2 0 402.995 4.204 20 0 HIADRP Cc1ccccc1OCCCC(=O)Nc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000480741143 896103292 /nfs/dbraw/zinc/10/32/92/896103292.db2.gz RJZSEZABISQPNC-NFBKMPQASA-N 2 0 409.574 4.365 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 ZINC000480765418 896129412 /nfs/dbraw/zinc/12/94/12/896129412.db2.gz ZNKLGVDBXHWNJS-MRXNPFEDSA-N 2 0 407.027 4.450 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccc(-c2ccncc2)c1 ZINC000480878523 896236047 /nfs/dbraw/zinc/23/60/47/896236047.db2.gz FYTNMAHSLNNUPJ-OAQYLSRUSA-N 2 0 400.570 4.347 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1cccc(NC(=O)C2CCCC2)c1 ZINC000480886096 896241952 /nfs/dbraw/zinc/24/19/52/896241952.db2.gz XHBFMQULRZQXFV-YADARESESA-N 2 0 406.574 4.211 20 0 HIADRP COc1ccc2oc([C@@H](C)[NH2+]Cc3ccc(CN4CC[NH+](C)CC4)cc3)c(C)c2c1 ZINC000480907124 896263128 /nfs/dbraw/zinc/26/31/28/896263128.db2.gz KAUHHVDDXDTJCK-LJQANCHMSA-N 2 0 407.558 4.348 20 0 HIADRP O=C(NCCC[NH+](Cc1ccccc1)Cc1ccccc1)NC1CC[NH+](C2CC2)CC1 ZINC000481049628 896373127 /nfs/dbraw/zinc/37/31/27/896373127.db2.gz MLSDTENAUHXLRW-UHFFFAOYSA-N 2 0 420.601 4.005 20 0 HIADRP C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CCOCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000481181318 896520307 /nfs/dbraw/zinc/52/03/07/896520307.db2.gz YZWCUKBKYVLMEL-LJQANCHMSA-N 2 0 400.538 4.165 20 0 HIADRP COc1ccccc1[C@H](C[NH2+][C@H]1CCN(Cc2ccccn2)C[C@H]1C)N1CCCCC1 ZINC000481181392 896520574 /nfs/dbraw/zinc/52/05/74/896520574.db2.gz ZJWDSWRHGFXZJO-ZODMCCGTSA-N 2 0 422.617 4.117 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H](O)Cc1ccccc1C(F)(F)F ZINC000481180675 896521921 /nfs/dbraw/zinc/52/19/21/896521921.db2.gz XKAYSSGUNACEPY-ZNLUXHQJSA-N 2 0 406.492 4.109 20 0 HIADRP C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000481301398 896645416 /nfs/dbraw/zinc/64/54/16/896645416.db2.gz YYTJNXBHPWJFFZ-UQBPGWFLSA-N 2 0 413.556 4.429 20 0 HIADRP COc1ccc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1Br ZINC000482037058 897453211 /nfs/dbraw/zinc/45/32/11/897453211.db2.gz CSZOGWILJNWXHW-HNNXBMFYSA-N 2 0 407.352 4.249 20 0 HIADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000482228747 897708193 /nfs/dbraw/zinc/70/81/93/897708193.db2.gz DMGRSJVGTLGNNS-CJAUYULYSA-N 2 0 412.549 4.338 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@@H]2CCSc3c(F)cccc32)c1 ZINC000482247890 897730033 /nfs/dbraw/zinc/73/00/33/897730033.db2.gz VYMJLPLVGWSNAK-OAQYLSRUSA-N 2 0 404.551 4.109 20 0 HIADRP CCc1nc(C)c([C@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)s1 ZINC000482253095 897735057 /nfs/dbraw/zinc/73/50/57/897735057.db2.gz DMWBEYZLSHGXSA-KRWDZBQOSA-N 2 0 417.619 4.354 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000482332046 897836971 /nfs/dbraw/zinc/83/69/71/897836971.db2.gz KYPKWDPKSNRNOJ-CVEARBPZSA-N 2 0 402.410 4.012 20 0 HIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CC1CC[NH+](CCN(C)C)CC1 ZINC000482364326 897882144 /nfs/dbraw/zinc/88/21/44/897882144.db2.gz VPLDPGUCXOJVHQ-INIZCTEOSA-N 2 0 404.599 4.182 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12)C1CC[NH+](C)CC1 ZINC000482424750 897977299 /nfs/dbraw/zinc/97/72/99/897977299.db2.gz QNMLLDOGDWHQDG-AREMUKBSSA-N 2 0 405.586 4.239 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)CC1 ZINC000482497386 898077910 /nfs/dbraw/zinc/07/79/10/898077910.db2.gz YATMDEJXAOEIPB-DLBZAZTESA-N 2 0 404.599 4.182 20 0 HIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2nnn(-c3cccc(Br)c3)c2C)CC1 ZINC000482511266 898094875 /nfs/dbraw/zinc/09/48/75/898094875.db2.gz PPUOZIHTQXFTOL-OAHLLOKOSA-N 2 0 420.399 4.111 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(F)cc1OC(F)F ZINC000482537485 898125711 /nfs/dbraw/zinc/12/57/11/898125711.db2.gz NKKOFYDKLCSCJJ-OAHLLOKOSA-N 2 0 408.464 4.235 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(-n2cccn2)cc1 ZINC000482542726 898131683 /nfs/dbraw/zinc/13/16/83/898131683.db2.gz YQQFFRUBAAGWQU-MOPGFXCFSA-N 2 0 407.537 4.175 20 0 HIADRP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1ccc(-c2ccccc2Cl)s1 ZINC000482547654 898136189 /nfs/dbraw/zinc/13/61/89/898136189.db2.gz CMJSPWATHZERFB-CVEARBPZSA-N 2 0 405.995 4.307 20 0 HIADRP COc1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(OC)c1 ZINC000482551203 898142130 /nfs/dbraw/zinc/14/21/30/898142130.db2.gz QOSCVKHTIMUYMC-DLBZAZTESA-N 2 0 401.526 4.007 20 0 HIADRP C[C@H](C[NH2+][C@H](CCSc1ccccc1)c1ccc(F)cc1)N1CC[NH+](C)CC1 ZINC000482554214 898145672 /nfs/dbraw/zinc/14/56/72/898145672.db2.gz GVLGXZJWOYMWSB-AUSIDOKSSA-N 2 0 401.595 4.275 20 0 HIADRP C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000482558331 898150536 /nfs/dbraw/zinc/15/05/36/898150536.db2.gz WMQLRHHSDXMNQR-CQSZACIVSA-N 2 0 411.434 4.402 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2ccc(OC)cc2OC)CC1 ZINC000482570414 898165697 /nfs/dbraw/zinc/16/56/97/898165697.db2.gz WNNIAMORQMADQT-ROUUACIJSA-N 2 0 415.553 4.397 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000482630011 898232598 /nfs/dbraw/zinc/23/25/98/898232598.db2.gz MDUHYENVUAEBHJ-OXJNMPFZSA-N 2 0 419.491 4.254 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(-c2ccccc2)o1 ZINC000482816248 898426556 /nfs/dbraw/zinc/42/65/56/898426556.db2.gz BDNBECRSIWGPOY-WMZHIEFXSA-N 2 0 417.553 4.495 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(-c2ccccc2)o1 ZINC000482816246 898426745 /nfs/dbraw/zinc/42/67/45/898426745.db2.gz BDNBECRSIWGPOY-AUSIDOKSSA-N 2 0 417.553 4.495 20 0 HIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CCCC[N@@H+]3CCC[C@@H]3CO)s2)cc1 ZINC000482874108 898486973 /nfs/dbraw/zinc/48/69/73/898486973.db2.gz HITUWKBGVZEEQG-VQIMIIECSA-N 2 0 403.592 4.015 20 0 HIADRP CC1(C(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000482944041 898568222 /nfs/dbraw/zinc/56/82/22/898568222.db2.gz FBEGIVBZFJPQDX-XMMPIXPASA-N 2 0 411.634 4.403 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3c2cc(Br)cc3F)[C@H](C)C1 ZINC000483129405 898812917 /nfs/dbraw/zinc/81/29/17/898812917.db2.gz SOOOOSWLRZKPMS-VOBQZIQPSA-N 2 0 413.375 4.302 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2sc(-c3cccnc3)nc2C)[C@H](C)C1 ZINC000483141193 898820734 /nfs/dbraw/zinc/82/07/34/898820734.db2.gz RVZDOTQBNBIINL-HLIPFELVSA-N 2 0 402.608 4.301 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(CCO)CC1)c1ccc(-c2ccccc2Cl)s1 ZINC000483143470 898822723 /nfs/dbraw/zinc/82/27/23/898822723.db2.gz LDDFJCKMIXXCAH-GOSISDBHSA-N 2 0 422.038 4.109 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000483219670 898865052 /nfs/dbraw/zinc/86/50/52/898865052.db2.gz UNQQEXPIGUJOSM-HRCADAONSA-N 2 0 401.378 4.240 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)CC2)CC1 ZINC000483252389 898894752 /nfs/dbraw/zinc/89/47/52/898894752.db2.gz WIPYOCDBGHGFEF-UHFFFAOYSA-N 2 0 411.634 4.448 20 0 HIADRP C[C@@H](NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000483375831 899012664 /nfs/dbraw/zinc/01/26/64/899012664.db2.gz JACXYBOJKMLWCE-RCZVLFRGSA-N 2 0 419.613 4.316 20 0 HIADRP CC[NH+]1CCN(c2cccc(NC(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)c2)CC1 ZINC000483453413 899089257 /nfs/dbraw/zinc/08/92/57/899089257.db2.gz HYUUUJOIFYLGSE-UHFFFAOYSA-N 2 0 420.601 4.069 20 0 HIADRP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](CCc4nc(-c5ccccc5)no4)CC[C@@H]32)cc1 ZINC000483467077 899109159 /nfs/dbraw/zinc/10/91/59/899109159.db2.gz KIMMZPNVKSNZNH-PKTZIBPZSA-N 2 0 402.542 4.266 20 0 HIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(Br)s1 ZINC000483544798 899205506 /nfs/dbraw/zinc/20/55/06/899205506.db2.gz PEUDZVNMHMXPTJ-OAHLLOKOSA-N 2 0 400.430 4.112 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)C[C@@H]1C ZINC000483686715 899345556 /nfs/dbraw/zinc/34/55/56/899345556.db2.gz VEJMDCBXVHQBMM-YOEKFXIASA-N 2 0 414.638 4.179 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)NC1CC[NH+](C2CCCC2)CC1 ZINC000483743621 899406956 /nfs/dbraw/zinc/40/69/56/899406956.db2.gz NSVWHGTZTCWVKH-UHFFFAOYSA-N 2 0 412.622 4.269 20 0 HIADRP CC(C)n1cc([C@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cn1 ZINC000483747888 899411192 /nfs/dbraw/zinc/41/11/92/899411192.db2.gz VXKHRUHKQWTEDA-INIZCTEOSA-N 2 0 409.500 4.085 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2CCCCCC2)C[C@@H]1C ZINC000483811741 899489529 /nfs/dbraw/zinc/48/95/29/899489529.db2.gz AHXJDEYJZFVXLZ-REWPJTCUSA-N 2 0 400.611 4.077 20 0 HIADRP CC[C@@H]1Oc2cc([C@@H](C)[NH2+][C@@H](C)c3cccc(OCC[NH+](C)C)c3)ccc2NC1=O ZINC000483866321 899547959 /nfs/dbraw/zinc/54/79/59/899547959.db2.gz SDXDKCKTEICYEO-JKSBSHDWSA-N 2 0 411.546 4.148 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(Cl)cc(Cl)c1 ZINC000484277766 899847349 /nfs/dbraw/zinc/84/73/49/899847349.db2.gz SAPJDADQAGLBAW-AWEZNQCLSA-N 2 0 400.394 4.271 20 0 HIADRP CC[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccccc1Br ZINC000484285205 899852261 /nfs/dbraw/zinc/85/22/61/899852261.db2.gz VJMCLMPLXCMJEK-LJQANCHMSA-N 2 0 424.427 4.117 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)c2ccccc12 ZINC000484313095 899872694 /nfs/dbraw/zinc/87/26/94/899872694.db2.gz UAQSUQLPEJAWJR-GOSISDBHSA-N 2 0 411.590 4.126 20 0 HIADRP C(CSc1nnc(SCCC[NH+]2CCCCC2)s1)C[NH+]1CCCCC1 ZINC000484479938 899971533 /nfs/dbraw/zinc/97/15/33/899971533.db2.gz JMMABEMIXOQVBF-UHFFFAOYSA-N 2 0 400.683 4.474 20 0 HIADRP Cc1ccc(C[NH2+][C@H]2CCN(Cc3ccccn3)C[C@@H]2C)c(OCC(F)(F)F)c1 ZINC000484646400 900091380 /nfs/dbraw/zinc/09/13/80/900091380.db2.gz XSYOHWZEURKNKE-PXNSSMCTSA-N 2 0 407.480 4.331 20 0 HIADRP CCC[NH+]1CCC([N@H+](C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccc(C)cc2)CC1 ZINC000484914201 900290925 /nfs/dbraw/zinc/29/09/25/900290925.db2.gz VKCHGLLQLQRQRS-UIOOFZCWSA-N 2 0 410.602 4.268 20 0 HIADRP c1ccc(C[N@@H+]2CC[C@H](C3CCOCC3)C2)c(C[NH+]2CC[C@H](C3CCOCC3)C2)c1 ZINC000485509252 900796454 /nfs/dbraw/zinc/79/64/54/900796454.db2.gz YFJGWHHIHGZHSA-UIOOFZCWSA-N 2 0 412.618 4.184 20 0 HIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCC(=O)Nc3ccccc3C(F)(F)F)C2)CC1 ZINC000485674609 900924421 /nfs/dbraw/zinc/92/44/21/900924421.db2.gz ZGSQHATUKJBIFJ-GOSISDBHSA-N 2 0 411.512 4.478 20 0 HIADRP C[C@H]1C[C@H](NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000486192544 901377705 /nfs/dbraw/zinc/37/77/05/901377705.db2.gz OWHIUYWZLHXNCE-SQJMNOBHSA-N 2 0 405.586 4.455 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](CCc2cc(Cl)ccc2Cl)CC1 ZINC000486813571 901870229 /nfs/dbraw/zinc/87/02/29/901870229.db2.gz DFJMBNCMOFJXNS-UHFFFAOYSA-N 2 0 414.421 4.096 20 0 HIADRP FC(F)(F)c1cccc(N2CC[NH+](CCCC[NH2+]C/C=C\c3ccncc3)CC2)c1 ZINC000486965980 901992383 /nfs/dbraw/zinc/99/23/83/901992383.db2.gz KWTYPLZLJRHGOQ-PLNGDYQASA-N 2 0 418.507 4.306 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+]Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)c1 ZINC000486967136 901994243 /nfs/dbraw/zinc/99/42/43/901994243.db2.gz MQXYFWUMYIDZBF-UHFFFAOYSA-N 2 0 418.463 4.326 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](Cc2csc(-c3ccc(C(=O)OC)cc3)n2)CC1 ZINC000488433462 902824530 /nfs/dbraw/zinc/82/45/30/902824530.db2.gz HJRNOFPTUREIBQ-UHFFFAOYSA-N 2 0 401.576 4.151 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)CC(C)C ZINC000489922167 903678168 /nfs/dbraw/zinc/67/81/68/903678168.db2.gz LFOTUPJRLARBIJ-HSZRJFAPSA-N 2 0 402.627 4.049 20 0 HIADRP COc1ccc([C@@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2ccccc2Cl)cc1 ZINC000490120146 903776831 /nfs/dbraw/zinc/77/68/31/903776831.db2.gz SKAHJPKIZGTVAW-HSZRJFAPSA-N 2 0 401.982 4.054 20 0 HIADRP COc1ccc([C@H]([NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c2ccc(F)cc2)cc1 ZINC000490119830 903777106 /nfs/dbraw/zinc/77/71/06/903777106.db2.gz QIVAAJAQQOVQEM-YDIMBITNSA-N 2 0 400.538 4.403 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000490167744 903806861 /nfs/dbraw/zinc/80/68/61/903806861.db2.gz NAOZKVNSTMZRAU-WZONZLPQSA-N 2 0 401.982 4.054 20 0 HIADRP C[C@H](NC(=O)c1oc2ccccc2c1C[NH+](C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000490802105 904248038 /nfs/dbraw/zinc/24/80/38/904248038.db2.gz XWOCOJDBTOAFJL-ICSRJNTNSA-N 2 0 405.542 4.135 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 ZINC000491019794 904372310 /nfs/dbraw/zinc/37/23/10/904372310.db2.gz LRDYMCWAJLXKEY-JPYJTQIMSA-N 2 0 403.973 4.432 20 0 HIADRP C[C@@H](C[NH2+][C@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1)N1CC[NH+](C)CC1 ZINC000491034758 904387845 /nfs/dbraw/zinc/38/78/45/904387845.db2.gz TZKOIWDJQGRMAA-HRAATJIYSA-N 2 0 423.935 4.256 20 0 HIADRP COc1ccc([C@H]([NH2+]CC2CC[NH+](CCN(C)C)CC2)c2ccccc2Cl)cc1 ZINC000491060068 904402640 /nfs/dbraw/zinc/40/26/40/904402640.db2.gz MJEKCGDUVLGHHK-DEOSSOPVSA-N 2 0 416.009 4.301 20 0 HIADRP CC(C)c1ccccc1OC[C@H](O)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000491074350 904412728 /nfs/dbraw/zinc/41/27/28/904412728.db2.gz IZWVXSGPPQWEER-XMMPIXPASA-N 2 0 410.602 4.394 20 0 HIADRP Cc1ccc(C)c([C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)c2ccccc2)c1 ZINC000491424989 904590701 /nfs/dbraw/zinc/59/07/01/904590701.db2.gz YJDBDYOYPNRIAR-SANMLTNESA-N 2 0 400.570 4.329 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C(=O)NCc2ccco2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492582772 904872719 /nfs/dbraw/zinc/87/27/19/904872719.db2.gz XREZRWALZCYAOU-HYBUGGRVSA-N 2 0 417.553 4.210 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+][C@@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CC1 ZINC000493276649 905074093 /nfs/dbraw/zinc/07/40/93/905074093.db2.gz LLUXKJFRXWTQNL-IBGZPJMESA-N 2 0 410.892 4.077 20 0 HIADRP c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+][C@@H]3[C@H]4CCO[C@H]4C34CCC4)CC2)cc1 ZINC000493961923 905312118 /nfs/dbraw/zinc/31/21/18/905312118.db2.gz RNQNYZGKESRAQG-TWJOJJKGSA-N 2 0 417.597 4.056 20 0 HIADRP c1ccc(CSCCC[NH+]2CCN([C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000512438530 921161593 /nfs/dbraw/zinc/16/15/93/921161593.db2.gz GNODNYAITVXGAZ-VWLOTQADSA-N 2 0 409.643 4.202 20 0 HIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)CC2 ZINC000494743768 905942317 /nfs/dbraw/zinc/94/23/17/905942317.db2.gz CQDRKIARRUAVBW-NHCUHLMSSA-N 2 0 415.375 4.101 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccc(C(=O)N(C)C)cc1 ZINC000495076414 906224185 /nfs/dbraw/zinc/22/41/85/906224185.db2.gz AJTLBVGYSWCVPL-IBGZPJMESA-N 2 0 405.542 4.464 20 0 HIADRP COc1cccc([C@@H]2[C@@H]([NH2+][C@@H](C)c3cccc(OCC[NH+](C)C)c3)CCN2C2CC2)c1 ZINC000495403369 906429132 /nfs/dbraw/zinc/42/91/32/906429132.db2.gz UZOXRYBGJIVNJM-RRWZXMNXSA-N 2 0 423.601 4.264 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(C(F)(F)F)cc1 ZINC000495465760 906467224 /nfs/dbraw/zinc/46/72/24/906467224.db2.gz SFAIZHBPZSEBQI-OXQOHEQNSA-N 2 0 419.491 4.254 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)C(=O)NCCc1cccs1 ZINC000495548533 906500788 /nfs/dbraw/zinc/50/07/88/906500788.db2.gz QPRCCWHXCMALOJ-ZCNNSNEGSA-N 2 0 413.631 4.063 20 0 HIADRP CC(C)n1nccc1NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000495549263 906502565 /nfs/dbraw/zinc/50/25/65/906502565.db2.gz VCLCOPZPWOXMLP-AQNXPRMDSA-N 2 0 411.594 4.059 20 0 HIADRP Cn1cc(-c2ccccc2C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000512612958 921260608 /nfs/dbraw/zinc/26/06/08/921260608.db2.gz QPVBNRKEBIGQOF-ZSQFBXSQSA-N 2 0 400.570 4.477 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]Cc4ccnc(OC5CCOCC5)c4)[C@H]3C2)cc1 ZINC000512621622 921265000 /nfs/dbraw/zinc/26/50/00/921265000.db2.gz ZXBDRGQTTAFCQX-HVCNVCAESA-N 2 0 421.585 4.030 20 0 HIADRP C[C@@H](C[NH2+][C@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1)CN1CC[NH+](C)CC1 ZINC000512643541 921271230 /nfs/dbraw/zinc/27/12/30/921271230.db2.gz XLYNNAHCILLIET-JTSKRJEESA-N 2 0 423.498 4.407 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N[C@@H]2C[NH+](C)C[C@H]2c2ccccc2)c1 ZINC000497398372 906878884 /nfs/dbraw/zinc/87/88/84/906878884.db2.gz BVPYRONQJNDXPG-IZZNHLLZSA-N 2 0 413.565 4.146 20 0 HIADRP O=C(C1CCCCC1)N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000512654813 921276452 /nfs/dbraw/zinc/27/64/52/921276452.db2.gz OXEGQLFZVHLCMI-ZFFYZDHPSA-N 2 0 409.618 4.058 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c2ccccc21 ZINC000512667862 921281761 /nfs/dbraw/zinc/28/17/61/921281761.db2.gz RJLNNFMQFMHKNS-WUEDSLEZSA-N 2 0 403.570 4.375 20 0 HIADRP CCc1noc(C2CCC([NH2+]Cc3ccccc3C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)n1 ZINC000497518446 907009965 /nfs/dbraw/zinc/00/99/65/907009965.db2.gz DZKOLRQEVSDLII-HQHQBECKSA-N 2 0 412.578 4.057 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CCC(C[NH+]2CCCC2)CC1 ZINC000497700912 907203855 /nfs/dbraw/zinc/20/38/55/907203855.db2.gz QRRNKPBZRLUQMS-UHFFFAOYSA-N 2 0 412.622 4.080 20 0 HIADRP CCOC1CC2(C1)CC[NH+](Cc1ccccc1C[N@H+]1CCC3(CC(OCC)C3)C1)C2 ZINC000512812435 921317738 /nfs/dbraw/zinc/31/77/38/921317738.db2.gz UFRZZBKEZQRNNG-UHFFFAOYSA-N 2 0 412.618 4.469 20 0 HIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3ccccc3)c(Br)c2)C1 ZINC000512825508 921329814 /nfs/dbraw/zinc/32/98/14/921329814.db2.gz BWRJBCNKTKRGAY-LJQANCHMSA-N 2 0 403.364 4.460 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cnn(-c2ccc(Br)cc2)c1 ZINC000512828953 921333010 /nfs/dbraw/zinc/33/30/10/921333010.db2.gz RAAKZQQNDYODQG-KRWDZBQOSA-N 2 0 405.384 4.379 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000512827917 921333030 /nfs/dbraw/zinc/33/30/30/921333030.db2.gz MNUVGFFCRMPCER-QGZVFWFLSA-N 2 0 405.384 4.237 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)N[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)C[C@H]1C ZINC000498671871 908103284 /nfs/dbraw/zinc/10/32/84/908103284.db2.gz PFPYWQBTBWIEST-XNKSBNDBSA-N 2 0 422.564 4.003 20 0 HIADRP C[C@H](NC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[C@@H](c1ccccc1)[NH+](C)C ZINC000498899544 908304804 /nfs/dbraw/zinc/30/48/04/908304804.db2.gz SQVMTETWEHQRHO-JDBUVZGPSA-N 2 0 408.590 4.030 20 0 HIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CCC(=O)Nc3ccc(Br)cc3)C2)CC1 ZINC000498909154 908318264 /nfs/dbraw/zinc/31/82/64/908318264.db2.gz VVSVSHWFLLHTOA-SFHVURJKSA-N 2 0 422.411 4.222 20 0 HIADRP O=C(c1ccccc1F)N1CCC([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499137881 908495251 /nfs/dbraw/zinc/49/52/51/908495251.db2.gz AQXCOZATHXLERN-NUNAXRQHSA-N 2 0 421.560 4.216 20 0 HIADRP Cc1cccc([C@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N2CCOCC2)c1 ZINC000499148392 908507946 /nfs/dbraw/zinc/50/79/46/908507946.db2.gz SULNXTWLNBLLMD-XUJYPJAKSA-N 2 0 419.613 4.154 20 0 HIADRP c1ccc(CC[N@@H+]2CC[C@H](CN[C@H]3C[C@H]4CC[C@@H](C3)[NH+]4Cc3ccccc3)C2)cc1 ZINC000499156753 908512360 /nfs/dbraw/zinc/51/23/60/908512360.db2.gz MKTHMPWFBCPJTC-JVYGEBFASA-N 2 0 403.614 4.336 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CCN(C(=O)CC(C)(C)C)CC1 ZINC000499248285 908620144 /nfs/dbraw/zinc/62/01/44/908620144.db2.gz GMQHUFXFQICOBF-UHFFFAOYSA-N 2 0 411.590 4.428 20 0 HIADRP CSc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000500242625 909730902 /nfs/dbraw/zinc/73/09/02/909730902.db2.gz AFRWSWGADUBUON-OALUTQOASA-N 2 0 411.615 4.228 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccccn1 ZINC000500616059 909967002 /nfs/dbraw/zinc/96/70/02/909967002.db2.gz FWMVJBKITNMEPI-SFHVURJKSA-N 2 0 406.496 4.353 20 0 HIADRP CC(C)C[NH+]1CCC(NC(=O)NCc2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)CC1 ZINC000500694964 910027971 /nfs/dbraw/zinc/02/79/71/910027971.db2.gz HOUQELYVLBGNKP-SFTDATJTSA-N 2 0 414.638 4.084 20 0 HIADRP Brc1ccc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc1 ZINC000513098905 921548583 /nfs/dbraw/zinc/54/85/83/921548583.db2.gz NIRGWRWKAGFRKA-UHFFFAOYSA-N 2 0 402.380 4.141 20 0 HIADRP Cc1ccc(NC(=O)[C@@H](C)[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000501047749 910258938 /nfs/dbraw/zinc/25/89/38/910258938.db2.gz OVISMOYPWFXYEL-QGZVFWFLSA-N 2 0 400.954 4.219 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1ccsc1 ZINC000501124695 910307318 /nfs/dbraw/zinc/30/73/18/910307318.db2.gz GGUXPDIHFHQAPF-FCHUYYIVSA-N 2 0 414.619 4.267 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1)c1ccsc1 ZINC000501177238 910344532 /nfs/dbraw/zinc/34/45/32/910344532.db2.gz VSOHRQHUNIXCOS-MOPGFXCFSA-N 2 0 420.648 4.329 20 0 HIADRP CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501790822 910842904 /nfs/dbraw/zinc/84/29/04/910842904.db2.gz OYTYWHGLJPDCMF-UHFFFAOYSA-N 2 0 400.394 4.006 20 0 HIADRP CSc1nnc(CCC[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)n1CC(C)C ZINC000513208413 921624391 /nfs/dbraw/zinc/62/43/91/921624391.db2.gz SQECCNLZVLHUAN-UYAOXDASSA-N 2 0 407.672 4.221 20 0 HIADRP CC(C)[C@H]([NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)c1ccc(F)cc1 ZINC000502579411 911584745 /nfs/dbraw/zinc/58/47/45/911584745.db2.gz PJNBSNLUJRCHMM-QHCPKHFHSA-N 2 0 415.578 4.300 20 0 HIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000502710409 911743505 /nfs/dbraw/zinc/74/35/05/911743505.db2.gz CKDVPONBUNHRJA-NVQXNPDNSA-N 2 0 407.602 4.304 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)NC[C@H](c3ccco3)[NH+]3CCCCC3)CC2)CC1 ZINC000502792406 911814942 /nfs/dbraw/zinc/81/49/42/911814942.db2.gz QUQVZSHARZWLII-LZBANZJXSA-N 2 0 416.610 4.149 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000502846912 911858084 /nfs/dbraw/zinc/85/80/84/911858084.db2.gz UOFWQDXOXCOULH-IBGZPJMESA-N 2 0 421.029 4.116 20 0 HIADRP C[C@H]1CC[N@H+](C)CCN1C(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000502930645 911917500 /nfs/dbraw/zinc/91/75/00/911917500.db2.gz RHGGPRZRWTXVBD-NRFANRHFSA-N 2 0 420.601 4.185 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)CCCC1)c1ccccc1 ZINC000503084331 912052849 /nfs/dbraw/zinc/05/28/49/912052849.db2.gz PZJRSSIWGAXOMH-LJQANCHMSA-N 2 0 400.611 4.212 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)CCCC1)c1ccccc1 ZINC000503107490 912073903 /nfs/dbraw/zinc/07/39/03/912073903.db2.gz MSCMTNNNIOOUCZ-UNMCSNQZSA-N 2 0 424.589 4.379 20 0 HIADRP c1csc(-c2nn(-c3ccccc3)cc2C[NH+]2CCC(C[NH+]3CCOCC3)CC2)c1 ZINC000506897432 915693698 /nfs/dbraw/zinc/69/36/98/915693698.db2.gz PXGMORKWAYGQDF-UHFFFAOYSA-N 2 0 422.598 4.145 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC000506938485 915742055 /nfs/dbraw/zinc/74/20/55/915742055.db2.gz DSEFJWWSQAODKD-KAOXLYBCSA-N 2 0 406.659 4.041 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC000506940393 915745241 /nfs/dbraw/zinc/74/52/41/915745241.db2.gz OCVAOTNCYVJPAA-HOUBMWHVSA-N 2 0 412.622 4.118 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000513428200 921798471 /nfs/dbraw/zinc/79/84/71/921798471.db2.gz CQPWZLPWHGQWMH-UHFFFAOYSA-N 2 0 423.626 4.151 20 0 HIADRP COC(=O)[C@H](C)C[N@H+](Cc1ccccc1)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000507092540 915866241 /nfs/dbraw/zinc/86/62/41/915866241.db2.gz CPTZUNGKFCFKGB-OAQYLSRUSA-N 2 0 423.601 4.028 20 0 HIADRP c1sc(CC[NH2+][C@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)nc1-c1ccccn1 ZINC000507465068 916232444 /nfs/dbraw/zinc/23/24/44/916232444.db2.gz ZJPJNMVRBZAYQA-ACRUOGEOSA-N 2 0 404.583 4.248 20 0 HIADRP c1sc(CC[NH2+][C@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)nc1-c1ccncc1 ZINC000507464746 916232990 /nfs/dbraw/zinc/23/29/90/916232990.db2.gz YNVVLMYTDQNQLB-FKBYEOEOSA-N 2 0 404.583 4.248 20 0 HIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12)c1cccc(N2CCCC2=O)c1 ZINC000507469647 916238118 /nfs/dbraw/zinc/23/81/18/916238118.db2.gz KXRVQWOZHIJGBU-WUBOSGNUSA-N 2 0 403.570 4.375 20 0 HIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000507890395 916737809 /nfs/dbraw/zinc/73/78/09/916737809.db2.gz VZKJHBVQHQHKJT-JOCHJYFZSA-N 2 0 421.564 4.147 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000508317030 917122847 /nfs/dbraw/zinc/12/28/47/917122847.db2.gz ZHAXUUBVVNZZKA-QGZVFWFLSA-N 2 0 415.965 4.451 20 0 HIADRP C[C@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508714577 917475302 /nfs/dbraw/zinc/47/53/02/917475302.db2.gz HLSFVWCSAVWUPW-SQJMNOBHSA-N 2 0 407.602 4.213 20 0 HIADRP CCc1noc(-c2ccc(CC[NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)cc2)n1 ZINC000508715668 917477301 /nfs/dbraw/zinc/47/73/01/917477301.db2.gz DVOKSQKVIVZJQP-WMZHIEFXSA-N 2 0 404.558 4.342 20 0 HIADRP COc1cccc([C@H](CN[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)[NH+]2CCCC2)c1 ZINC000508718552 917480787 /nfs/dbraw/zinc/48/07/87/917480787.db2.gz NYRYUPISEFJWPR-NZJKTDFXSA-N 2 0 407.602 4.332 20 0 HIADRP COc1ccccc1[C@H](CN[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCCC1 ZINC000508719496 917481207 /nfs/dbraw/zinc/48/12/07/917481207.db2.gz PYTOVLVQSFMWQS-VTZPFEBOSA-N 2 0 407.602 4.332 20 0 HIADRP C[C@H](NC(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[C@@H](c1ccccc1)[NH+](C)C ZINC000508855098 917608429 /nfs/dbraw/zinc/60/84/29/917608429.db2.gz UJGOKWDKWZBPMH-MHOPESGUSA-N 2 0 422.617 4.372 20 0 HIADRP Cc1ccccc1[C@H]([C@H](C)NC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000508897238 917653113 /nfs/dbraw/zinc/65/31/13/917653113.db2.gz JHKDFMJSBRGDOP-OFVILXPXSA-N 2 0 422.617 4.292 20 0 HIADRP Fc1ccc2nc([C@H]3CCC[N@H+](CCCN4CCN(c5ccccc5)CC4)C3)oc2c1 ZINC000508978594 917731652 /nfs/dbraw/zinc/73/16/52/917731652.db2.gz OOHGMSSYBJJBPB-FQEVSTJZSA-N 2 0 422.548 4.359 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N(C)[C@H]1CC[NH+](CC)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000509031400 917787114 /nfs/dbraw/zinc/78/71/14/917787114.db2.gz KSSONCKHNJGCKK-DZFGPLHGSA-N 2 0 409.018 4.095 20 0 HIADRP CC(C)[N@@H+]1CCc2nc(CN[C@H]3CC[NH+](Cc4ccccc4)CC3(C)C)sc2C1 ZINC000509452121 918105261 /nfs/dbraw/zinc/10/52/61/918105261.db2.gz VJYVVZHOZYBZPU-QFIPXVFZSA-N 2 0 412.647 4.300 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N(CC)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000509578379 918228938 /nfs/dbraw/zinc/22/89/38/918228938.db2.gz QGYFWRYXCRVJOM-NNWRFLSQSA-N 2 0 412.578 4.015 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N1CC[C@H](C)[N@H+](Cc2ccccc2)CC1)c1ccco1 ZINC000509592570 918240331 /nfs/dbraw/zinc/24/03/31/918240331.db2.gz UFDPMCWYZWLMPH-ONTIZHBOSA-N 2 0 412.578 4.015 20 0 HIADRP CC[N@@H+]1CCC[C@@H](CN(C)c2cc[nH+]c3cc(F)c(OC)cc32)[C@@H]1c1cnn(C)c1 ZINC000509610709 918256667 /nfs/dbraw/zinc/25/66/67/918256667.db2.gz XNOKYCFWMNEZSN-QMHKHESXSA-N 2 0 411.525 4.025 20 0 HIADRP C[C@@H]1C[C@H](CCNC(=O)NCCCC[N@@H+]2CCCC[C@H]2C)C[NH+]1Cc1ccccc1 ZINC000509793908 918400726 /nfs/dbraw/zinc/40/07/26/918400726.db2.gz YJZZZFDLOZFTTO-AKFKNWHVSA-N 2 0 414.638 4.241 20 0 HIADRP C[C@@H]1C[C@@H](CCNC(=O)c2ccc(C[NH+]3CCCC3)cc2)C[N@@H+]1Cc1ccccc1 ZINC000510099411 918663500 /nfs/dbraw/zinc/66/35/00/918663500.db2.gz OLXQLVMEHUGYBH-ZJSXRUAMSA-N 2 0 405.586 4.313 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000510523583 918968933 /nfs/dbraw/zinc/96/89/33/918968933.db2.gz MFXLELBRYFVYOD-XKCSPQBFSA-N 2 0 400.611 4.022 20 0 HIADRP C[NH+](C)Cc1ccccc1CNC(=O)c1cccc(C[N@H+](C)Cc2ccccc2)c1 ZINC000511132512 919748256 /nfs/dbraw/zinc/74/82/56/919748256.db2.gz SGUODKBXJGDNEV-UHFFFAOYSA-N 2 0 401.554 4.310 20 0 HIADRP Cc1nn(-c2ccc(Br)cc2)cc1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000511492025 920101724 /nfs/dbraw/zinc/10/17/24/920101724.db2.gz CZYCKPATJHPRMM-UHFFFAOYSA-N 2 0 405.384 4.107 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@@H](c2cccc(OC)c2)[NH+]2CCCC2)cc1)C1CC1 ZINC000511548920 920179815 /nfs/dbraw/zinc/17/98/15/920179815.db2.gz ZJLILVUKWZPZCE-VWLOTQADSA-N 2 0 421.585 4.246 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)CC1(C)C ZINC000512124411 920875400 /nfs/dbraw/zinc/87/54/00/920875400.db2.gz ULHHRZCVVGRXFA-FYYLOGMGSA-N 2 0 414.638 4.241 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000512150901 920892405 /nfs/dbraw/zinc/89/24/05/920892405.db2.gz XCLGMZXRTHHMFK-ISTRZQFTSA-N 2 0 403.876 4.292 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)N[C@H]2CC[NH+](Cc3ccccc3)CC2(C)C)c1 ZINC000512159335 920898509 /nfs/dbraw/zinc/89/85/09/920898509.db2.gz QSDZFJQSEBWJNA-DEOSSOPVSA-N 2 0 422.617 4.238 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)N[C@@H]2CC[N@H+](Cc3ccc(C(F)(F)F)cc3)C2)c1 ZINC000512234007 920988532 /nfs/dbraw/zinc/98/85/32/920988532.db2.gz NMGBTVQRVCPXAX-HXUWFJFHSA-N 2 0 420.479 4.163 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512321196 921071096 /nfs/dbraw/zinc/07/10/96/921071096.db2.gz DDHBBBYMJFPUMO-ULQDDVLXSA-N 2 0 407.986 4.308 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2csc(Br)c2)C[C@@H](C)O1 ZINC000513587812 921919553 /nfs/dbraw/zinc/91/95/53/921919553.db2.gz BDXBUJRLPSNQIZ-HUUCEWRRSA-N 2 0 409.393 4.410 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccccc2OC(F)(F)F)C[C@H](C)O1 ZINC000513588050 921920383 /nfs/dbraw/zinc/92/03/83/921920383.db2.gz GVQCUSBGEKKPRL-IRXDYDNUSA-N 2 0 408.464 4.484 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N(C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000513613055 921942051 /nfs/dbraw/zinc/94/20/51/921942051.db2.gz LLTKGXPMQNTSAC-UHFFFAOYSA-N 2 0 408.590 4.302 20 0 HIADRP COc1ccc([C@@H](Cc2ccncc2)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000513678180 922000505 /nfs/dbraw/zinc/00/05/05/922000505.db2.gz JENCAOGXQLXEHB-RUZDIDTESA-N 2 0 402.542 4.275 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)c1ccc(C[NH+]2CCSCC2)cc1)c1ccsc1 ZINC000513766262 922084489 /nfs/dbraw/zinc/08/44/89/922084489.db2.gz QJXNTVXXDQFLOR-NRFANRHFSA-N 2 0 417.644 4.110 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000514020620 922343762 /nfs/dbraw/zinc/34/37/62/922343762.db2.gz QEXPBKXUBVGVIM-UHFFFAOYSA-N 2 0 422.617 4.240 20 0 HIADRP CCC1(CNC(=O)NC[C@@H]2CCC[N@@H+](C(C)C)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000514021689 922343999 /nfs/dbraw/zinc/34/39/99/922343999.db2.gz CMEXIWXJIMTBFT-QHCPKHFHSA-N 2 0 414.638 4.098 20 0 HIADRP CSC1(C[NH2+][C@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)CC[NH+](C)CC1 ZINC000514821215 922815040 /nfs/dbraw/zinc/81/50/40/922815040.db2.gz UMWOBTMDHPIUDO-MJGOQNOKSA-N 2 0 410.599 4.252 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1)c1ccccc1 ZINC000515290612 923037016 /nfs/dbraw/zinc/03/70/16/923037016.db2.gz AGTYZKNZWFWFLN-NHCUHLMSSA-N 2 0 414.619 4.267 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2ccccc2Br)c1 ZINC000515526084 923155509 /nfs/dbraw/zinc/15/55/09/923155509.db2.gz BGCUSPTZNRAHCH-MRXNPFEDSA-N 2 0 418.379 4.408 20 0 HIADRP CCOc1ccccc1NC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000515756752 923328476 /nfs/dbraw/zinc/32/84/76/923328476.db2.gz UZHQOJXTSQTWCY-VQTJNVASSA-N 2 0 409.574 4.434 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000515759718 923332335 /nfs/dbraw/zinc/33/23/35/923332335.db2.gz WCHPCKJQFHWBOS-QRVBRYPASA-N 2 0 423.557 4.010 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)C1 ZINC000515800026 923357943 /nfs/dbraw/zinc/35/79/43/923357943.db2.gz KAYKQICKSDRHKE-OAQYLSRUSA-N 2 0 400.611 4.349 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)C1 ZINC000515800025 923358329 /nfs/dbraw/zinc/35/83/29/923358329.db2.gz KAYKQICKSDRHKE-NRFANRHFSA-N 2 0 400.611 4.349 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)C1 ZINC000515819969 923373400 /nfs/dbraw/zinc/37/34/00/923373400.db2.gz YUVBSAZYHLCYJZ-PMACEKPBSA-N 2 0 414.638 4.227 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NCc2ccc(C[NH+](C)C)cc2)c2ccccc2)CC1 ZINC000516560296 923795619 /nfs/dbraw/zinc/79/56/19/923795619.db2.gz SDGMFQGJLSIBRJ-XMMPIXPASA-N 2 0 408.590 4.021 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2CC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000516790937 923888592 /nfs/dbraw/zinc/88/85/92/923888592.db2.gz WMLGIKUCAIHMBU-NHTMILBNSA-N 2 0 400.513 4.280 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC[C@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1Cl ZINC000517104060 923999276 /nfs/dbraw/zinc/99/92/76/923999276.db2.gz PDXICXQYWXGZOQ-NQIIRXRSSA-N 2 0 409.018 4.143 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)c2ccccc2)CC1 ZINC000518363415 927222374 /nfs/dbraw/zinc/22/23/74/927222374.db2.gz FTDCNIRWZIRGFO-YADHBBJMSA-N 2 0 414.619 4.123 20 0 HIADRP C[C@@H](CNC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)[N@@H+]1CCc2ccccc2C1 ZINC000519252744 927847648 /nfs/dbraw/zinc/84/76/48/927847648.db2.gz RZFUYMFICIMTNG-NRFANRHFSA-N 2 0 420.601 4.283 20 0 HIADRP C[C@H](CNC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)[N@@H+]1CCc2ccccc2C1 ZINC000519252745 927848032 /nfs/dbraw/zinc/84/80/32/927848032.db2.gz RZFUYMFICIMTNG-OAQYLSRUSA-N 2 0 420.601 4.283 20 0 HIADRP CN1CC[NH+](CC2CC[NH+](Cc3ccc(Oc4cc(F)cc(F)c4)cc3)CC2)CC1 ZINC000521116519 929004611 /nfs/dbraw/zinc/00/46/11/929004611.db2.gz ONXOHIJUVRVJBE-UHFFFAOYSA-N 2 0 415.528 4.217 20 0 HIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccc(OC)cc2)C1 ZINC000521813518 929470068 /nfs/dbraw/zinc/47/00/68/929470068.db2.gz WZJWPDCBRUFATR-JOCHJYFZSA-N 2 0 418.585 4.429 20 0 HIADRP CC[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1ccc(Br)cc1Cl ZINC000525868408 930472122 /nfs/dbraw/zinc/47/21/22/930472122.db2.gz OVMTZTKCVYAPNG-SFHVURJKSA-N 2 0 402.808 4.169 20 0 HIADRP C[C@H]1C[N@H+](CCOc2ccc(CC[NH2+][C@H](c3ncc[nH]3)c3ccccc3)cc2)C[C@H]1C ZINC000525869311 930473185 /nfs/dbraw/zinc/47/31/85/930473185.db2.gz WBQVMQUJOZZCAU-BKSPAHHJSA-N 2 0 418.585 4.298 20 0 HIADRP Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(-n2cc(Cl)cn2)n1 ZINC000526049882 930514957 /nfs/dbraw/zinc/51/49/57/930514957.db2.gz DFGLQGTVUQLGIB-GHTZIAJQSA-N 2 0 409.965 4.229 20 0 HIADRP Cc1ccc([C@@H](CCn2cncn2)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc1 ZINC000527348619 930643312 /nfs/dbraw/zinc/64/33/12/930643312.db2.gz FVBIIEHKYBDFAY-RUZDIDTESA-N 2 0 403.574 4.494 20 0 HIADRP C[C@H](C[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc(F)cc1 ZINC000527361589 930647464 /nfs/dbraw/zinc/64/74/64/930647464.db2.gz NGNLWDOGOOSZFM-LJQANCHMSA-N 2 0 400.538 4.209 20 0 HIADRP Cc1cc(Sc2ccccc2)ccc1NC(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000527376221 930652056 /nfs/dbraw/zinc/65/20/56/930652056.db2.gz LBYQEGJQEDTUAR-UHFFFAOYSA-N 2 0 400.592 4.103 20 0 HIADRP C[N@@H+]1CC[C@H](NC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)[C@H]1c1ccccc1 ZINC000530356644 930690583 /nfs/dbraw/zinc/69/05/83/930690583.db2.gz MXDCBWYBJHZCTC-BJKOFHAPSA-N 2 0 406.574 4.282 20 0 HIADRP Cc1cc2cc(C[NH2+]Cc3cccc(C[N@@H+]4CCC[C@@H](C(N)=O)C4)c3)oc2cc1C ZINC000530914481 930858014 /nfs/dbraw/zinc/85/80/14/930858014.db2.gz BAKNNAVQOZBPHY-OAQYLSRUSA-N 2 0 405.542 4.037 20 0 HIADRP C[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1 ZINC000530926995 930860566 /nfs/dbraw/zinc/86/05/66/930860566.db2.gz KGQSNNQRVWRSDA-IBGZPJMESA-N 2 0 413.993 4.361 20 0 HIADRP COc1ccc([C@H](CNC(=O)[C@H]2CCCC[N@@H+]2Cc2ccccc2)[NH+]2CCCC2)cc1 ZINC000531281678 930999645 /nfs/dbraw/zinc/99/96/45/930999645.db2.gz XZYVKKFYFUIDNW-RPBOFIJWSA-N 2 0 421.585 4.003 20 0 HIADRP Cc1ccc(OCc2nc(C[NH2+]CCCC[NH+]3C[C@@H](C)O[C@H](C)C3)cs2)cc1 ZINC000531349951 931026401 /nfs/dbraw/zinc/02/64/01/931026401.db2.gz POZQWXOKJAIVQP-RTBURBONSA-N 2 0 403.592 4.010 20 0 HIADRP COc1cc2c(cc1C[NH2+]CCCOC1CC[NH+](Cc3ccccc3)CC1)O[C@H](C)C2 ZINC000531380393 931037481 /nfs/dbraw/zinc/03/74/81/931037481.db2.gz PHYVEBVGDFKYJB-HXUWFJFHSA-N 2 0 424.585 4.180 20 0 HIADRP COc1cc2c(cc1C[NH2+]CCCOC1CC[NH+](Cc3ccccc3)CC1)O[C@@H](C)C2 ZINC000531380388 931037972 /nfs/dbraw/zinc/03/79/72/931037972.db2.gz PHYVEBVGDFKYJB-FQEVSTJZSA-N 2 0 424.585 4.180 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2csc(Br)c2)CC1 ZINC000531531626 931094849 /nfs/dbraw/zinc/09/48/49/931094849.db2.gz GSCBLPWBABSNDN-UHFFFAOYSA-N 2 0 408.409 4.332 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@H]1CCCO[C@@H]1c1ccccc1)C1CC[NH+](C)CC1 ZINC000531596858 931115460 /nfs/dbraw/zinc/11/54/60/931115460.db2.gz AOVFLSYXSNFEAN-ZEQKJWHPSA-N 2 0 407.602 4.475 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3ccc(-n4ccnc4C)cc3)cc2)CC1 ZINC000531682131 931149528 /nfs/dbraw/zinc/14/95/28/931149528.db2.gz YUQRYTURDRCROU-NRFANRHFSA-N 2 0 417.601 4.169 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3sccc3Br)cc2)CC1 ZINC000531682421 931150707 /nfs/dbraw/zinc/15/07/07/931150707.db2.gz VPXOKZCDFFTROY-INIZCTEOSA-N 2 0 422.436 4.499 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531694320 931157211 /nfs/dbraw/zinc/15/72/11/931157211.db2.gz ODRMOLJUUCDLOK-IBGZPJMESA-N 2 0 400.588 4.317 20 0 HIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 ZINC000531707107 931166831 /nfs/dbraw/zinc/16/68/31/931166831.db2.gz YOQGMWLHZVZMLT-HNNXBMFYSA-N 2 0 401.473 4.156 20 0 HIADRP CCCC[NH+]1CCC([NH2+][C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 ZINC000531707108 931167459 /nfs/dbraw/zinc/16/74/59/931167459.db2.gz YOQGMWLHZVZMLT-OAHLLOKOSA-N 2 0 401.473 4.156 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531711455 931169882 /nfs/dbraw/zinc/16/98/82/931169882.db2.gz DUAMHKSASDSWTN-CQSZACIVSA-N 2 0 422.342 4.157 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NC[C@H]1CC[N@H+](CC(C)C)C1)c1cccc(C(F)(F)F)c1 ZINC000531800671 931203166 /nfs/dbraw/zinc/20/31/66/931203166.db2.gz VJAFJTOGWNAJGU-XLIONFOSSA-N 2 0 413.528 4.182 20 0 HIADRP CN(c1ccccc1C[NH2+]CCc1nc(C(F)(F)F)cs1)C1CC[NH+](C)CC1 ZINC000531848307 931219050 /nfs/dbraw/zinc/21/90/50/931219050.db2.gz NACSLFFDTBOJAP-UHFFFAOYSA-N 2 0 412.525 4.025 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1cc(Br)cs1)C1CC[NH+](C)CC1 ZINC000531851502 931220883 /nfs/dbraw/zinc/22/08/83/931220883.db2.gz HFARSMXRZCNVIK-UHFFFAOYSA-N 2 0 408.409 4.331 20 0 HIADRP c1cnn(-c2cccc(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)c2)c1 ZINC000531865902 931227397 /nfs/dbraw/zinc/22/73/97/931227397.db2.gz IUVWOSKAFFIDJO-UHFFFAOYSA-N 2 0 404.558 4.033 20 0 HIADRP C[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000531958748 931264268 /nfs/dbraw/zinc/26/42/68/931264268.db2.gz WWQBFNWPRUFLDK-AVRDEDQJSA-N 2 0 421.507 4.267 20 0 HIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CC(=O)N(C)Cc2ccccc2Cl)c1 ZINC000531959241 931265751 /nfs/dbraw/zinc/26/57/51/931265751.db2.gz VDLWZOZCGMXZRQ-GOSISDBHSA-N 2 0 401.982 4.319 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CCN(Cc2ccncc2)CC1 ZINC000531980354 931274639 /nfs/dbraw/zinc/27/46/39/931274639.db2.gz FPVLOBSICOKADI-UHFFFAOYSA-N 2 0 404.558 4.061 20 0 HIADRP CN(C)[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000532105705 931314315 /nfs/dbraw/zinc/31/43/15/931314315.db2.gz QOXAOYATSSTPMU-DEOSSOPVSA-N 2 0 415.025 4.263 20 0 HIADRP CN(c1ccccc1C[NH2+]CCc1ccc(OC(F)F)cc1)C1CC[NH+](C)CC1 ZINC000532107576 931315289 /nfs/dbraw/zinc/31/52/89/931315289.db2.gz VSYIJDDTYDNLCZ-UHFFFAOYSA-N 2 0 403.517 4.151 20 0 HIADRP Fc1cccc(Cl)c1[C@@H](C[NH2+]C1CCN(c2ccccn2)CC1)N1CCCC1 ZINC000532198082 931346482 /nfs/dbraw/zinc/34/64/82/931346482.db2.gz XXRMAPMHKBNGNN-HXUWFJFHSA-N 2 0 402.945 4.270 20 0 HIADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000532214315 931355932 /nfs/dbraw/zinc/35/59/32/931355932.db2.gz IMZZQJGCGUGPQQ-AREMUKBSSA-N 2 0 424.585 4.352 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(Br)s1 ZINC000532249141 931370670 /nfs/dbraw/zinc/37/06/70/931370670.db2.gz PFCRGLXZLNUXQX-CQSZACIVSA-N 2 0 409.393 4.318 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(Br)s1 ZINC000532249138 931371040 /nfs/dbraw/zinc/37/10/40/931371040.db2.gz PFCRGLXZLNUXQX-AWEZNQCLSA-N 2 0 409.393 4.318 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000532451394 931439584 /nfs/dbraw/zinc/43/95/84/931439584.db2.gz WSGGOWQCLYXWKP-QHCPKHFHSA-N 2 0 403.973 4.380 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](c2ccccc2Cl)N2CCCC2)[C@H](C)C1 ZINC000532461230 931445762 /nfs/dbraw/zinc/44/57/62/931445762.db2.gz BRAGNURPVUJDAB-WTIAFYNJSA-N 2 0 408.030 4.204 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C[C@@H](c1ccccc1Cl)N1CCCC1 ZINC000532461742 931445792 /nfs/dbraw/zinc/44/57/92/931445792.db2.gz QNXDIZZOTZSHDW-YGOYIFOWSA-N 2 0 413.009 4.372 20 0 HIADRP C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)OCCCO2 ZINC000532483200 931456604 /nfs/dbraw/zinc/45/66/04/931456604.db2.gz WGCNAPBBOBOUGX-QZTJIDSGSA-N 2 0 413.537 4.151 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)C1 ZINC000533307271 931835055 /nfs/dbraw/zinc/83/50/55/931835055.db2.gz UFTRPHHBYKZSEC-QHCPKHFHSA-N 2 0 417.601 4.451 20 0 HIADRP C[C@@H]([NH2+][C@H](c1ccccc1)C1CCC1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000533505604 931887327 /nfs/dbraw/zinc/88/73/27/931887327.db2.gz RAXYRQYRCGTWKN-CJFMBICVSA-N 2 0 405.586 4.287 20 0 HIADRP CC(C)Oc1cccc(CN(C)[C@@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000534478871 932512359 /nfs/dbraw/zinc/51/23/59/932512359.db2.gz AGESJYSJMJOJDU-NRFANRHFSA-N 2 0 423.601 4.075 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000534971480 932869296 /nfs/dbraw/zinc/86/92/96/932869296.db2.gz OJGSXAZKBAXKNE-UZLBHIALSA-N 2 0 424.992 4.034 20 0 HIADRP CN1CC[C@H](NC(=O)NC2CC[NH+](CC3CCCC3)CC2)[C@H]1c1ccc(Cl)cc1 ZINC000535018415 932885774 /nfs/dbraw/zinc/88/57/74/932885774.db2.gz XXTKOFTYZFREAW-FCHUYYIVSA-N 2 0 419.013 4.039 20 0 HIADRP COc1ccc(OC2CC[NH+](Cc3ccccc3N(C)C3CC[NH+](C)CC3)CC2)cc1 ZINC000535071651 932897699 /nfs/dbraw/zinc/89/76/99/932897699.db2.gz SDBLUPSLMDBLCT-UHFFFAOYSA-N 2 0 423.601 4.269 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)NC[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000535683632 933338149 /nfs/dbraw/zinc/33/81/49/933338149.db2.gz LANITUWAVVHCAH-UTKZUKDTSA-N 2 0 424.992 4.036 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000535703284 933357474 /nfs/dbraw/zinc/35/74/74/933357474.db2.gz XXUZKSVTBKANEG-BEFAXECRSA-N 2 0 424.992 4.080 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)N2CC[C@H](C3CC[NH+](C)CC3)C2)CCCC1)c1ccccc1 ZINC000535939828 933506838 /nfs/dbraw/zinc/50/68/38/933506838.db2.gz YVKLFIZFFGFDHB-OFNKIYASSA-N 2 0 412.622 4.023 20 0 HIADRP COc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(Br)c1 ZINC000537293726 933701025 /nfs/dbraw/zinc/70/10/25/933701025.db2.gz CNFZSAOXCANBDZ-HNNXBMFYSA-N 2 0 404.352 4.420 20 0 HIADRP COc1cccc2cc([C@@H](C)[NH2+]Cc3ccc(C(=O)NCC[NH+]4CCCC4)cc3)oc21 ZINC000537303629 933705342 /nfs/dbraw/zinc/70/53/42/933705342.db2.gz KGCZOHKHDVGUHU-GOSISDBHSA-N 2 0 421.541 4.118 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cnc(-c4cccs4)s3)CC2)CC1 ZINC000537622736 938337421 /nfs/dbraw/zinc/33/74/21/938337421.db2.gz JKAGUSHOSJCYII-UHFFFAOYSA-N 2 0 418.676 4.500 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2c[nH]nc2-c2ccc3c(c2)OCO3)CC1 ZINC000537637075 938342276 /nfs/dbraw/zinc/34/22/76/938342276.db2.gz NNFQZVIYQHSXFW-UHFFFAOYSA-N 2 0 418.541 4.149 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)Nc1cc(Cl)ccc1F ZINC000537843878 938388277 /nfs/dbraw/zinc/38/82/77/938388277.db2.gz HOWVQQNLBKWETO-UHFFFAOYSA-N 2 0 404.917 4.051 20 0 HIADRP COc1cc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)ccc1OCc1ccncc1 ZINC000537870637 938395408 /nfs/dbraw/zinc/39/54/08/938395408.db2.gz ZTHBIOHZEHEJLI-UHFFFAOYSA-N 2 0 418.541 4.070 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc2cc(OC)ccc2c1 ZINC000537969589 938439400 /nfs/dbraw/zinc/43/94/00/938439400.db2.gz GYNWZKQRSJZHAI-RUZDIDTESA-N 2 0 419.569 4.381 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)C(c1ccccc1)c1ccccc1 ZINC000537970459 938440480 /nfs/dbraw/zinc/44/04/80/938440480.db2.gz VWJOZXXNRIDYLC-OAQYLSRUSA-N 2 0 415.581 4.288 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000538062849 938492357 /nfs/dbraw/zinc/49/23/57/938492357.db2.gz PEWUWOHOQRSTAN-NRFANRHFSA-N 2 0 406.496 4.339 20 0 HIADRP CCc1ccc([C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)C(C)C)cc1 ZINC000538101205 938502600 /nfs/dbraw/zinc/50/26/00/938502600.db2.gz NEIQNFMGMXRAIP-JWQCQUIFSA-N 2 0 407.602 4.433 20 0 HIADRP C[NH+]1CCN(C[C@H]([NH2+][C@@H]2CCc3c2cccc3Br)c2ccccc2)CC1 ZINC000538100528 938502652 /nfs/dbraw/zinc/50/26/52/938502652.db2.gz PHGVAYSJCQRXCF-YADHBBJMSA-N 2 0 414.391 4.015 20 0 HIADRP C[C@@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000538549978 938646779 /nfs/dbraw/zinc/64/67/79/938646779.db2.gz OXORLPJXEUXRFD-HXUWFJFHSA-N 2 0 411.590 4.004 20 0 HIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3cccc(OCc4ccccn4)c3)CC2)C[C@H](C)O1 ZINC000538763277 938704826 /nfs/dbraw/zinc/70/48/26/938704826.db2.gz RJJDJHDDTKIUNL-SZPZYZBQSA-N 2 0 423.601 4.372 20 0 HIADRP CSc1ccc(NC(=O)[C@H](C)[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000538942854 938742735 /nfs/dbraw/zinc/74/27/35/938742735.db2.gz HNIMMPROPMUDHG-SFHVURJKSA-N 2 0 412.603 4.369 20 0 HIADRP C[C@@H](NC(=O)[C@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000538945297 938743257 /nfs/dbraw/zinc/74/32/57/938743257.db2.gz YSUUPTZSYWJHKK-MOPGFXCFSA-N 2 0 412.553 4.025 20 0 HIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000539043541 938779634 /nfs/dbraw/zinc/77/96/34/938779634.db2.gz VLVXWZOUEUACCY-IRFCIJBXSA-N 2 0 415.603 4.009 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000539061120 938787698 /nfs/dbraw/zinc/78/76/98/938787698.db2.gz LKNRPEHEIXKGRU-KMDXXIMOSA-N 2 0 400.513 4.216 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000539063535 938789225 /nfs/dbraw/zinc/78/92/25/938789225.db2.gz JXKNJSOXSOBUOG-JVPBZIDWSA-N 2 0 402.526 4.369 20 0 HIADRP COc1ccc(Br)cc1C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000539064360 938790014 /nfs/dbraw/zinc/79/00/14/938790014.db2.gz JDOBJMZRXFQXEF-OAHLLOKOSA-N 2 0 407.352 4.249 20 0 HIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3CCN(C(=O)NC4CCCCC4)CC3)CC2)C1 ZINC000539079041 938796762 /nfs/dbraw/zinc/79/67/62/938796762.db2.gz PASVXMLMGORLAW-AUSIDOKSSA-N 2 0 404.643 4.126 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(CN2CCO[C@@H](C)C2)c1)c1nc2ccc(Cl)cc2n1C ZINC000539203814 938818703 /nfs/dbraw/zinc/81/87/03/938818703.db2.gz ZFRZOIWDMUOKEL-IRXDYDNUSA-N 2 0 412.965 4.298 20 0 HIADRP COc1ccc([C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C(C)C)cc1 ZINC000539217191 938820252 /nfs/dbraw/zinc/82/02/52/938820252.db2.gz LBQYTYQKRDIXEM-DEOSSOPVSA-N 2 0 409.574 4.008 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H](NC[C@@H]1CC[N@H+](CCc3ccccc3)C1)c1ccccc1O2 ZINC000539378184 938851547 /nfs/dbraw/zinc/85/15/47/938851547.db2.gz YMSOTQGYYREXFN-ZCYQVOJMSA-N 3 0 419.613 4.129 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCc1ccn(-c3ccc(F)cc3)n1)c1ccccc1O2 ZINC000539396223 938854247 /nfs/dbraw/zinc/85/42/47/938854247.db2.gz FTYDSWCPCGFUBB-HSZRJFAPSA-N 2 0 420.532 4.132 20 0 HIADRP CC(=O)N1CC[C@@H]([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c2ccccc21 ZINC000539408058 938856142 /nfs/dbraw/zinc/85/61/42/938856142.db2.gz VEKPWVWMRAHOMZ-YADHBBJMSA-N 2 0 405.542 4.062 20 0 HIADRP CC1CC[NH+](C2CCC([NH2+]Cc3c(Cl)cccc3N3CCOCC3)CC2)CC1 ZINC000563552517 945213198 /nfs/dbraw/zinc/21/31/98/945213198.db2.gz RKHVWAZLNWEHNU-UHFFFAOYSA-N 2 0 406.014 4.309 20 0 HIADRP CN(CCC[NH+]1CCCC1)C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000539712288 938909088 /nfs/dbraw/zinc/90/90/88/938909088.db2.gz MILZFGMCOFRQDO-UHFFFAOYSA-N 2 0 400.611 4.078 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cnc(-c4ccccc4)s3)CC2)CC1 ZINC000539822975 938946256 /nfs/dbraw/zinc/94/62/56/938946256.db2.gz WYYFTTSZLHHFQY-UHFFFAOYSA-N 2 0 412.647 4.438 20 0 HIADRP CN(Cc1ccccc1N(C)C1CC[NH+](C)CC1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539828151 938949137 /nfs/dbraw/zinc/94/91/37/938949137.db2.gz DCPBZEKMEDSDOS-DEOSSOPVSA-N 2 0 420.645 4.171 20 0 HIADRP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc1F ZINC000563567026 945218121 /nfs/dbraw/zinc/21/81/21/945218121.db2.gz XUKOOAMKKARFIX-IRLDBZIGSA-N 2 0 415.553 4.376 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H](CO)Cc1ccccc1C(F)(F)F ZINC000540161845 939097212 /nfs/dbraw/zinc/09/72/12/939097212.db2.gz YWFONWLKXPAWQZ-RFWXGWTQSA-N 2 0 420.519 4.357 20 0 HIADRP CCOc1cccc2cc([C@@H](C)[NH2+]CC3CC[NH+](CC(=O)NC(C)(C)C)CC3)oc21 ZINC000540595514 939314064 /nfs/dbraw/zinc/31/40/64/939314064.db2.gz XCZMRNQTZUJGMZ-QGZVFWFLSA-N 2 0 415.578 4.109 20 0 HIADRP C[C@H](Nc1cccc(C[NH+]2CCSCC2)c1)[C@H](c1ccccc1)N1CCOCC1 ZINC000540787121 939372165 /nfs/dbraw/zinc/37/21/65/939372165.db2.gz CCZIQYUOYYDSPI-GBXCKJPGSA-N 2 0 411.615 4.109 20 0 HIADRP C[C@H](Nc1cccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000540790286 939373540 /nfs/dbraw/zinc/37/35/40/939373540.db2.gz YWVJBPSUPHYUAE-NJYVYQBISA-N 2 0 411.590 4.409 20 0 HIADRP CCOc1ccc([C@@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000540908175 939415435 /nfs/dbraw/zinc/41/54/35/939415435.db2.gz DDSLQPHMCAUYSV-XMMPIXPASA-N 2 0 416.009 4.445 20 0 HIADRP CCOc1ccc([C@@H](C)NC(=O)CCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000540984295 939424787 /nfs/dbraw/zinc/42/47/87/939424787.db2.gz IQUXREYFKBBOBV-HXUWFJFHSA-N 2 0 415.622 4.429 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3c(Br)cccc32)C1 ZINC000541246987 939487467 /nfs/dbraw/zinc/48/74/67/939487467.db2.gz OOQFBLPRDDFEIW-AVRDEDQJSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@H](CCNC(=O)NC[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1)[NH+]1CCCCC1 ZINC000541480281 939532130 /nfs/dbraw/zinc/53/21/30/939532130.db2.gz MSTABIQVJRMJBO-MMOPVJDHSA-N 2 0 424.992 4.036 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](c2ccc(F)cc2)c2ccccn2)[C@H](c2ccccc2)C1 ZINC000541548455 939551604 /nfs/dbraw/zinc/55/16/04/939551604.db2.gz DYCPSSGCZPPZII-IZZNHLLZSA-N 2 0 418.560 4.279 20 0 HIADRP CCc1ccc([C@@H](CN2CCOCC2)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1 ZINC000541552049 939552961 /nfs/dbraw/zinc/55/29/61/939552961.db2.gz CELOFJSCOPOAGG-AREMUKBSSA-N 2 0 407.602 4.008 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1ccc(-c2ccccc2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541601863 939565408 /nfs/dbraw/zinc/56/54/08/939565408.db2.gz SXVWBBRQKKCEJZ-OPHFCASCSA-N 2 0 408.586 4.336 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1ccc(-c2ccccc2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541601862 939565643 /nfs/dbraw/zinc/56/56/43/939565643.db2.gz SXVWBBRQKKCEJZ-GRYUFTJMSA-N 2 0 408.586 4.336 20 0 HIADRP C[C@H]1[NH+](Cc2ccc(C[N@@H+]3CCC4(CCOCC4)[C@H]3C)cc2)CCC12CCOCC2 ZINC000541719094 939613912 /nfs/dbraw/zinc/61/39/12/939613912.db2.gz YONICPZIYWNLKB-FGZHOGPDSA-N 2 0 412.618 4.469 20 0 HIADRP Clc1ccc(-c2cnc(C[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)o2)cc1 ZINC000541880870 939649009 /nfs/dbraw/zinc/64/90/09/939649009.db2.gz PQZNPUPYYJIVCX-UHFFFAOYSA-N 2 0 403.954 4.319 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(F)c(F)c1 ZINC000541913423 939652340 /nfs/dbraw/zinc/65/23/40/939652340.db2.gz JWWPTSFQRMHVOD-REWPJTCUSA-N 2 0 415.528 4.149 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000542473152 939828966 /nfs/dbraw/zinc/82/89/66/939828966.db2.gz TUAKBBGVBGLYQR-HXUWFJFHSA-N 2 0 410.558 4.465 20 0 HIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2cccc(Br)c21 ZINC000542845622 939862508 /nfs/dbraw/zinc/86/25/08/939862508.db2.gz DDNCBFXLZTUFFV-FQELHTAISA-N 2 0 415.375 4.354 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCCOc2ccc(Cl)cc21 ZINC000542845695 939862732 /nfs/dbraw/zinc/86/27/32/939862732.db2.gz HCXKRPYHBZWWQZ-IFMALSPDSA-N 2 0 400.950 4.300 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000542851061 939863043 /nfs/dbraw/zinc/86/30/43/939863043.db2.gz FSMYKFHGDYPHCK-UGKGYDQZSA-N 2 0 420.475 4.319 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+]([C@H](C)C(=O)Nc2ccc3c(c2)OCCCO3)CC1 ZINC000542944919 939883474 /nfs/dbraw/zinc/88/34/74/939883474.db2.gz HJAZUWKWWAKXAY-LJQANCHMSA-N 2 0 417.594 4.009 20 0 HIADRP Cc1ccc(C2CC[NH+](CCOCC[NH+]3CCC(c4ccc(C)nc4)CC3)CC2)cn1 ZINC000543061761 939916244 /nfs/dbraw/zinc/91/62/44/939916244.db2.gz ZHKHIBQBWOOGMF-UHFFFAOYSA-N 2 0 422.617 4.169 20 0 HIADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000543073081 939924595 /nfs/dbraw/zinc/92/45/95/939924595.db2.gz VSFMSDRFEXBFAD-KGLIPLIRSA-N 2 0 405.892 4.397 20 0 HIADRP C[NH+](C)Cc1ccc(CNC(=O)c2cccc(C[N@H+](C)Cc3ccccc3)c2)cc1F ZINC000543373844 940045412 /nfs/dbraw/zinc/04/54/12/940045412.db2.gz FZLKDYIAYQKCQD-UHFFFAOYSA-N 2 0 419.544 4.449 20 0 HIADRP CC1CC[NH+](C[C@H]2CCCN(C(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)C2)CC1 ZINC000543431649 940062237 /nfs/dbraw/zinc/06/22/37/940062237.db2.gz OOURSCBBLLETPX-XMMPIXPASA-N 2 0 411.634 4.259 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(-c4cccc(F)c4)s3)CC2)CC1 ZINC000543618177 940134082 /nfs/dbraw/zinc/13/40/82/940134082.db2.gz PZAJFWMMIRMUFF-UHFFFAOYSA-N 2 0 401.595 4.404 20 0 HIADRP COc1cc(CN2CC[C@@H](C[NH+](C)C)C2)ccc1OCCOc1ccccc1Cl ZINC000543768874 940180896 /nfs/dbraw/zinc/18/08/96/940180896.db2.gz SKSPFPIESPXXAF-IBGZPJMESA-N 2 0 418.965 4.190 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(Br)s1 ZINC000543777913 940184244 /nfs/dbraw/zinc/18/42/44/940184244.db2.gz XNUVOVBWJYBBAZ-YOEHRIQHSA-N 2 0 409.393 4.318 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]CCc1c[nH]c2ccc(Br)cc12 ZINC000544182766 940346656 /nfs/dbraw/zinc/34/66/56/940346656.db2.gz AAUIRTKRFCQCSM-UHFFFAOYSA-N 2 0 410.319 4.152 20 0 HIADRP CCC[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1cccnc1 ZINC000544568335 940481038 /nfs/dbraw/zinc/48/10/38/940481038.db2.gz GMWBXEUNBKPPHN-FQEVSTJZSA-N 2 0 406.496 4.483 20 0 HIADRP Cc1ccc(S(=O)(=O)C[C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000544604859 940488875 /nfs/dbraw/zinc/48/88/75/940488875.db2.gz JQVFPWJEMWEQFM-QNWVGRARSA-N 2 0 414.615 4.048 20 0 HIADRP C[C@@H]1C[NH+](CC2CC[NH+](Cc3ccc(OCC(F)(F)F)c(F)c3)CC2)C[C@@H](C)O1 ZINC000544611878 940490163 /nfs/dbraw/zinc/49/01/63/940490163.db2.gz MAMIIKCUVPICHE-HZPDHXFCSA-N 2 0 418.475 4.088 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000544631014 940494523 /nfs/dbraw/zinc/49/45/23/940494523.db2.gz UYZVLINTVXXXEU-CQSZACIVSA-N 2 0 402.917 4.157 20 0 HIADRP C[NH+](C)CCOc1cccc(-c2noc([C@@H]3CCC[N@H+](Cc4cccc(F)c4)C3)n2)c1 ZINC000544767646 940512434 /nfs/dbraw/zinc/51/24/34/940512434.db2.gz BPBPEIOPEFUXIX-HXUWFJFHSA-N 2 0 424.520 4.196 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000545459411 940570874 /nfs/dbraw/zinc/57/08/74/940570874.db2.gz VPIMEPZHPNKHOH-TZRRMPRUSA-N 2 0 413.993 4.376 20 0 HIADRP c1cncc(C[N@H+]2CCC[C@H](c3nc(-c4ccc(C[NH+]5CCCC5)cc4)no3)C2)c1 ZINC000546248762 940747908 /nfs/dbraw/zinc/74/79/08/940747908.db2.gz RKTXEBWJMNLKLI-QFIPXVFZSA-N 2 0 403.530 4.107 20 0 HIADRP C[C@@H](NCC1([NH2+][C@@H](C)c2ccccc2)CCOCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547503076 941066120 /nfs/dbraw/zinc/06/61/20/941066120.db2.gz CADBTYNOXCSKBC-UMFSSWHCSA-N 2 0 421.629 4.387 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1cccc(Cl)c1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547827713 941077361 /nfs/dbraw/zinc/07/73/61/941077361.db2.gz XCGNEORNQOMSFL-WDSOQIARSA-N 2 0 423.384 4.233 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000549037955 941147050 /nfs/dbraw/zinc/14/70/50/941147050.db2.gz LAJYCOFSNQGUFB-IZZNHLLZSA-N 2 0 417.597 4.409 20 0 HIADRP C[NH+](C)C[C@@H](NC(=O)NCc1cccc(C[NH+]2CCCC2)c1)c1ccc(Cl)cc1 ZINC000549104708 941159275 /nfs/dbraw/zinc/15/92/75/941159275.db2.gz QQKHNEWDQDHYJO-JOCHJYFZSA-N 2 0 414.981 4.038 20 0 HIADRP Fc1ccc(COc2ccc(C[NH+]3CCC(CC[NH+]4CCOCC4)CC3)cc2)cc1 ZINC000549201350 941170652 /nfs/dbraw/zinc/17/06/52/941170652.db2.gz IITIMBAAGDFQMO-UHFFFAOYSA-N 2 0 412.549 4.339 20 0 HIADRP C[C@H](c1ccc(F)cc1)N1CC[C@@H]([N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)C1=O ZINC000549536970 941198524 /nfs/dbraw/zinc/19/85/24/941198524.db2.gz PSUOUPOHQCKOEP-NTKDMRAZSA-N 2 0 424.564 4.121 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)CC2(C)C)CC1 ZINC000549588630 941200533 /nfs/dbraw/zinc/20/05/33/941200533.db2.gz HFADMIBIVNNEQR-HSZRJFAPSA-N 2 0 414.638 4.049 20 0 HIADRP Fc1ccc2cc(C[NH2+]C[C@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)[nH]c2c1 ZINC000549879879 941225121 /nfs/dbraw/zinc/22/51/21/941225121.db2.gz OEGUFBSAKDREFK-NRFANRHFSA-N 2 0 407.533 4.325 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+]([C@H]2CCN([C@@H](C)c3ccc(F)cc3)C2=O)CC1 ZINC000549932068 941241390 /nfs/dbraw/zinc/24/13/90/941241390.db2.gz PFBGCNQPSIMCKJ-CVDCTZTESA-N 2 0 403.586 4.322 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCC[C@H]2Cc2ccccc2Br)CC1 ZINC000550524630 941335218 /nfs/dbraw/zinc/33/52/18/941335218.db2.gz AJZABRRWWNFFDD-NRFANRHFSA-N 2 0 422.455 4.262 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)[C@@H]1C[N@@H+](C(C)(C)C)C[C@H]1C(F)(F)F ZINC000550545787 941337023 /nfs/dbraw/zinc/33/70/23/941337023.db2.gz XAKSFTIKFQPEEF-RTBURBONSA-N 2 0 413.528 4.006 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(C(=O)OC)cc1 ZINC000550605951 941345548 /nfs/dbraw/zinc/34/55/48/941345548.db2.gz IJZHPLVCEZWCFF-YDIMBITNSA-N 2 0 410.558 4.323 20 0 HIADRP CN1CC[C@@H]([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)C[C@H]1c1ccccc1 ZINC000550700361 941355538 /nfs/dbraw/zinc/35/55/38/941355538.db2.gz GCXDOGODEGCMCP-RSXGOPAZSA-N 2 0 407.602 4.129 20 0 HIADRP CC(C)[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccc(F)cn1 ZINC000550883328 941378393 /nfs/dbraw/zinc/37/83/93/941378393.db2.gz YPOXYHYYOKBCLO-URXFXBBRSA-N 2 0 411.565 4.436 20 0 HIADRP Cc1c([C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cnn1C(C)C ZINC000551264723 941438764 /nfs/dbraw/zinc/43/87/64/941438764.db2.gz MNHSTDGNNYGSSY-REWPJTCUSA-N 2 0 410.606 4.352 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@@H]3CCCOc4ccccc43)C3(C2)CCOCC3)cc1 ZINC000551265892 941439473 /nfs/dbraw/zinc/43/94/73/941439473.db2.gz ZVERXACISXPKLN-ISKFKSNPSA-N 2 0 406.570 4.419 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000551574297 941504880 /nfs/dbraw/zinc/50/48/80/941504880.db2.gz GVSVAFCARXUMTG-HSZRJFAPSA-N 2 0 409.530 4.493 20 0 HIADRP COc1cc(F)c([C@@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1OC ZINC000551814349 941550752 /nfs/dbraw/zinc/55/07/52/941550752.db2.gz VKOTXEFTIAUXGB-MRXNPFEDSA-N 2 0 402.510 4.167 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000551814571 941550935 /nfs/dbraw/zinc/55/09/35/941550935.db2.gz YEJNPGXHTMQBCT-QGZVFWFLSA-N 2 0 407.558 4.240 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(C(=O)OC(C)(C)C)cc3)cc2)CC1 ZINC000551813792 941550982 /nfs/dbraw/zinc/55/09/82/941550982.db2.gz SFPSVEMSMIERKV-UHFFFAOYSA-N 2 0 410.558 4.405 20 0 HIADRP COc1ccc(C[C@H](C)C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1F ZINC000551827074 941554122 /nfs/dbraw/zinc/55/41/22/941554122.db2.gz QDCGQZHYZXXPSO-SFHVURJKSA-N 2 0 400.538 4.276 20 0 HIADRP FC(F)(F)Cn1cc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000552034833 941570965 /nfs/dbraw/zinc/57/09/65/941570965.db2.gz GQWGNWUDERGHAL-NJDAHSKKSA-N 2 0 406.496 4.226 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)C[C@H]1C ZINC000552168933 941596042 /nfs/dbraw/zinc/59/60/42/941596042.db2.gz WLFILLDRZGJXSG-NFBKMPQASA-N 2 0 400.611 4.298 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)C[C@H]1C ZINC000552168935 941596200 /nfs/dbraw/zinc/59/62/00/941596200.db2.gz WLFILLDRZGJXSG-OFNKIYASSA-N 2 0 400.611 4.298 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1cccc(C(F)(F)F)c1 ZINC000552757106 941753824 /nfs/dbraw/zinc/75/38/24/941753824.db2.gz XABWRUKEFOBBPN-OAQYLSRUSA-N 2 0 421.507 4.484 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)CC1 ZINC000552864223 941791994 /nfs/dbraw/zinc/79/19/94/941791994.db2.gz YSZVGRIAZZZWBA-NRFANRHFSA-N 2 0 423.601 4.214 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H](C)c2ccccc2OC(C)C)CC1 ZINC000552875298 941796096 /nfs/dbraw/zinc/79/60/96/941796096.db2.gz MHBOAQTYYPXMGK-OAQYLSRUSA-N 2 0 423.601 4.214 20 0 HIADRP COc1cc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c2ccccc2n1 ZINC000553492283 941895816 /nfs/dbraw/zinc/89/58/16/941895816.db2.gz WWVUUYRJKYUTSX-JOCHJYFZSA-N 2 0 403.526 4.321 20 0 HIADRP CCc1ccc([C@@H](CNC(=O)C2CCN(c3cc[nH+]cc3C)CC2)[NH+](CC)CC)cc1 ZINC000554220512 942071123 /nfs/dbraw/zinc/07/11/23/942071123.db2.gz VZISIRRQDOOFBY-RUZDIDTESA-N 2 0 422.617 4.368 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000554388749 942122502 /nfs/dbraw/zinc/12/25/02/942122502.db2.gz DIBAXEUHENVZGS-GBXCKJPGSA-N 2 0 408.590 4.289 20 0 HIADRP Cc1ccccc1[C@@H](OC[C@H](O)C[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccccc1 ZINC000555889364 942767147 /nfs/dbraw/zinc/76/71/47/942767147.db2.gz RMOXWMKMSOWOIQ-VWNXMTODSA-N 2 0 410.602 4.361 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)CCN2CCOCC2)c1)c1cccc(C2CC2)c1 ZINC000556058588 942798121 /nfs/dbraw/zinc/79/81/21/942798121.db2.gz MTWMFQLPDYCPPW-IBGZPJMESA-N 2 0 407.558 4.076 20 0 HIADRP C[NH+](C)[C@@H]1CCN(c2ccc(NC3CCC([N@H+](C)Cc4ccccc4)CC3)nc2)C1 ZINC000556253017 942826796 /nfs/dbraw/zinc/82/67/96/942826796.db2.gz HQNQKIAZCNRMOS-UBVWURDFSA-N 2 0 407.606 4.077 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1 ZINC000556258130 942827406 /nfs/dbraw/zinc/82/74/06/942827406.db2.gz ZMSNIANKHVUZIB-GXUWAKPLSA-N 2 0 419.613 4.253 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1 ZINC000556258131 942827677 /nfs/dbraw/zinc/82/76/77/942827677.db2.gz ZMSNIANKHVUZIB-JNLGVIEDSA-N 2 0 419.613 4.253 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)CC1 ZINC000556386046 942854300 /nfs/dbraw/zinc/85/43/00/942854300.db2.gz LGQFNLZWRMMNPR-UHFFFAOYSA-N 2 0 406.961 4.444 20 0 HIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3cnc(-c4ccc(Cl)cc4)s3)C2)CC1 ZINC000556598111 942910409 /nfs/dbraw/zinc/91/04/09/942910409.db2.gz FQYWBRNOZFSFAZ-IBGZPJMESA-N 2 0 405.011 4.064 20 0 HIADRP c1ncn(-c2ccc(C[NH2+][C@@H]3CCCC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)cc2)n1 ZINC000556869884 942944385 /nfs/dbraw/zinc/94/43/85/942944385.db2.gz ACAYGRYXCUVMLZ-ZKMPZPQNSA-N 2 0 401.558 4.048 20 0 HIADRP COC1CCN(C2(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)CCCC2)CC1 ZINC000556868368 942944622 /nfs/dbraw/zinc/94/46/22/942944622.db2.gz UBWMLMFOUPMGOA-UHFFFAOYSA-N 2 0 413.650 4.443 20 0 HIADRP c1ncn(-c2ccc(C[NH2+][C@@H]3CCCC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)cc2)n1 ZINC000556869881 942944648 /nfs/dbraw/zinc/94/46/48/942944648.db2.gz ACAYGRYXCUVMLZ-ICDZXHCJSA-N 2 0 401.558 4.048 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@H]([NH2+]CCCc4nnc5n4CCCCC5)[C@@H]3C2)cc1 ZINC000556870683 942945336 /nfs/dbraw/zinc/94/53/36/942945336.db2.gz GUBSJRZUJFJUOI-VXNXHJTFSA-N 2 0 421.633 4.218 20 0 HIADRP O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000557640691 943245478 /nfs/dbraw/zinc/24/54/78/943245478.db2.gz SLLOBDXMZDDKDT-MHZLTWQESA-N 2 0 417.597 4.023 20 0 HIADRP C[N@H+](CCCN1CC[NH+](C)CC1)Cc1ccccc1Oc1ccc(F)cc1Cl ZINC000558422056 943555849 /nfs/dbraw/zinc/55/58/49/943555849.db2.gz HZEIWOUVAROTKD-UHFFFAOYSA-N 2 0 405.945 4.341 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000558781507 943661238 /nfs/dbraw/zinc/66/12/38/943661238.db2.gz UJEHADZZYLHGQG-CVDCTZTESA-N 2 0 403.574 4.274 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000558970621 943776351 /nfs/dbraw/zinc/77/63/51/943776351.db2.gz KPXKZBRRSACILH-QHAWAJNXSA-N 2 0 407.396 4.184 20 0 HIADRP Cc1ccc(C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c(-c2ccnn2C)c1 ZINC000559068594 943823256 /nfs/dbraw/zinc/82/32/56/943823256.db2.gz YFDOIQPZJYHARS-OYRHEFFESA-N 2 0 410.606 4.107 20 0 HIADRP COc1cccc2c1CC[C@H]([NH2+]C[C@@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)C2 ZINC000559891076 944076528 /nfs/dbraw/zinc/07/65/28/944076528.db2.gz NAZJQDMPOQBEMH-RPWUZVMVSA-N 2 0 420.597 4.071 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cccc(I)c1 ZINC000560057051 944143962 /nfs/dbraw/zinc/14/39/62/944143962.db2.gz CVXIHUZNAHGBNE-UHFFFAOYSA-N 2 0 408.327 4.421 20 0 HIADRP C[NH+](CCCC[N@@H+](C)C[C@H]1OCCc2ccccc21)C[C@@H]1OCCc2ccccc21 ZINC000560331533 944226966 /nfs/dbraw/zinc/22/69/66/944226966.db2.gz FCEKMVAHKVAOJS-WMPKNSHKSA-N 2 0 408.586 4.258 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)N3CCC[N@@H+](C(C)(C)C)CC3)c2)CC1 ZINC000560644995 944283197 /nfs/dbraw/zinc/28/31/97/944283197.db2.gz KMFSDEPRWHFRFD-UHFFFAOYSA-N 2 0 400.611 4.299 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NCc2ccc(OC3CC[NH+](C)CC3)cc2)cc1)C(C)C ZINC000560819626 944344092 /nfs/dbraw/zinc/34/40/92/944344092.db2.gz HELAITXOWBAMSS-UHFFFAOYSA-N 2 0 423.601 4.320 20 0 HIADRP Cc1ccncc1CCC[N@H+](CCn1ccnc1)Cc1ccc(Br)o1 ZINC000561980687 944884539 /nfs/dbraw/zinc/88/45/39/944884539.db2.gz IKRQPGXHNJLIRT-UHFFFAOYSA-N 2 0 403.324 4.077 20 0 HIADRP COc1ccc(C[NH2+]CC2(SC)CC[NH+](C)CC2)cc1OCc1ccccc1 ZINC000564420299 945571974 /nfs/dbraw/zinc/57/19/74/945571974.db2.gz XRCRSKVOWCJZAV-UHFFFAOYSA-N 2 0 400.588 4.191 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NC[C@@H]2CCCC[NH+](Cc3ccccc3)C2)CC1 ZINC000564658750 945720013 /nfs/dbraw/zinc/72/00/13/945720013.db2.gz QHWNVTAFOBSLOS-DEOSSOPVSA-N 2 0 414.638 4.051 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)C2CC[NH+](C3CC3)CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000565150719 945789567 /nfs/dbraw/zinc/78/95/67/945789567.db2.gz LBBDJZNHUPKIHS-GHTZIAJQSA-N 2 0 423.523 4.079 20 0 HIADRP CCO[C@@H]1C[C@@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C12CCCC2 ZINC000567128944 946246291 /nfs/dbraw/zinc/24/62/91/946246291.db2.gz NQXXYWSRDZHULS-RBZQAINGSA-N 2 0 412.618 4.243 20 0 HIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3nc(-c4cccc(Br)c4)c[nH]3)C2)CC1 ZINC000568814573 946713225 /nfs/dbraw/zinc/71/32/25/946713225.db2.gz PFJXMESGAXRMGN-KRWDZBQOSA-N 2 0 403.368 4.003 20 0 HIADRP CC(C)(C)[C@@H](CN1CCc2ccccc2C1)[NH2+]C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000569711680 946950382 /nfs/dbraw/zinc/95/03/82/946950382.db2.gz KGGDURHGKGMCQZ-PXDATVDWSA-N 2 0 419.613 4.211 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000570439698 947248543 /nfs/dbraw/zinc/24/85/43/947248543.db2.gz XCGRCCHQRKUJEJ-FPOVZHCZSA-N 2 0 415.603 4.011 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)Cc2ccc(F)cc2Br)[C@H](C)C1 ZINC000570480026 947261764 /nfs/dbraw/zinc/26/17/64/947261764.db2.gz NHBBMNXOTGMGPC-GUXCAODWSA-N 2 0 415.391 4.246 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000570690024 947327231 /nfs/dbraw/zinc/32/72/31/947327231.db2.gz JFZZAAVWFRYXNQ-HSZRJFAPSA-N 2 0 408.590 4.213 20 0 HIADRP Brc1cncc(Br)c1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000571608073 947728606 /nfs/dbraw/zinc/72/86/06/947728606.db2.gz PSICOYIIPUEPJY-UHFFFAOYSA-N 2 0 419.205 4.352 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000572440153 947905913 /nfs/dbraw/zinc/90/59/13/947905913.db2.gz SHKOJOSPGAREGL-RUZDIDTESA-N 2 0 402.586 4.391 20 0 HIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cccc(Br)c3OC(F)F)C2)CC1 ZINC000572445115 947909619 /nfs/dbraw/zinc/90/96/19/947909619.db2.gz UDOVUAOYXHXUFL-AWEZNQCLSA-N 2 0 403.311 4.214 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(Br)cn1 ZINC000572503064 947918196 /nfs/dbraw/zinc/91/81/96/947918196.db2.gz ZWTDKLLCIZNMIJ-OAHLLOKOSA-N 2 0 404.352 4.168 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]Cc1ccc(-n3ccnc3)c(F)c1)c1ccccc1O2 ZINC000574699912 948506444 /nfs/dbraw/zinc/50/64/44/948506444.db2.gz MTTRKGNXHLWWCT-NRFANRHFSA-N 2 0 406.505 4.089 20 0 HIADRP CN1CC[C@H]([NH2+]CCCCC[NH2+][C@@H]2CCN(C)[C@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000574945314 948562147 /nfs/dbraw/zinc/56/21/47/948562147.db2.gz BKQZDQKIIBDBIX-KNJLRNSFSA-N 2 0 420.645 4.227 20 0 HIADRP C[C@H]1C[C@@H]1[N@@H+]1CCN(C(=O)c2cccc(C[NH+](C)Cc3ccccc3)c2)C[C@@H](C)C1 ZINC000575773616 948702095 /nfs/dbraw/zinc/70/20/95/948702095.db2.gz ZWHBHWQTGZMQLO-WATLYSKOSA-N 2 0 405.586 4.121 20 0 HIADRP FC(F)(c1cnc(Cl)c(C2=CC[NH2+]CC2)c1)N1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001164418836 718893801 /nfs/dbraw/zinc/89/38/01/718893801.db2.gz FHHXHXATFIEXHG-IBGZPJMESA-N 2 0 410.940 4.015 20 0 HIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@@H]2CC[NH+]3Cc2cccnc2)nc1 ZINC001164732082 720472703 /nfs/dbraw/zinc/47/27/03/720472703.db2.gz YNTUFGGWCCMPAP-SGNDLWITSA-N 2 0 405.590 4.267 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000025702627 847022851 /nfs/dbraw/zinc/02/28/51/847022851.db2.gz GRGRLPGEDVSYGE-MRXNPFEDSA-N 2 0 418.379 4.408 20 0 HIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccc(OC)cc2)C1 ZINC000048745151 849261867 /nfs/dbraw/zinc/26/18/67/849261867.db2.gz ZMDIEIJDEGYCTQ-OAQYLSRUSA-N 2 0 404.558 4.038 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C2CCN(C(=O)c3ccccc3O)CC2)CC1 ZINC000436839554 862017952 /nfs/dbraw/zinc/01/79/52/862017952.db2.gz NUZKKTVUTXEXNP-UHFFFAOYSA-N 2 0 421.585 4.030 20 0 HIADRP Cc1ccc([C@H](OC[C@H](O)C[NH+]2CCC(CC[NH+](C)C)CC2)c2ccccc2)cc1 ZINC000056523033 850383144 /nfs/dbraw/zinc/38/31/44/850383144.db2.gz PFTXPUBFPCYMBV-CLJLJLNGSA-N 2 0 410.602 4.126 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)c1cccs1 ZINC000056764407 850471958 /nfs/dbraw/zinc/47/19/58/850471958.db2.gz NQVPEZHDSHZYJU-FQEVSTJZSA-N 2 0 400.592 4.201 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)c1cccc(OC)c1 ZINC000059951590 851026995 /nfs/dbraw/zinc/02/69/95/851026995.db2.gz KWYJMWWQPWPGTK-DEOSSOPVSA-N 2 0 409.574 4.104 20 0 HIADRP Clc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCCC[NH+]2CCOCC2)cc1 ZINC000060979291 851265131 /nfs/dbraw/zinc/26/51/31/851265131.db2.gz RHZNETXQZHJPDO-UHFFFAOYSA-N 2 0 424.976 4.395 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NCc1cccc(C[NH+](C)C)c1 ZINC000061868106 851464687 /nfs/dbraw/zinc/46/46/87/851464687.db2.gz REJNTJDGLOYLQS-HXUWFJFHSA-N 2 0 408.590 4.122 20 0 HIADRP FC(F)(F)CN1CCC(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000437071733 862267540 /nfs/dbraw/zinc/26/75/40/862267540.db2.gz IMLCHUXXXYFHOS-BHIFYINESA-N 2 0 409.540 4.151 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)NC1CC[NH+](CC2CCCC2)CC1 ZINC000063332070 851664135 /nfs/dbraw/zinc/66/41/35/851664135.db2.gz YKGYTSPWLRPISA-UHFFFAOYSA-N 2 0 412.622 4.126 20 0 HIADRP COc1ccc(Br)cc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000063551901 851712961 /nfs/dbraw/zinc/71/29/61/851712961.db2.gz QSNDQVURTLFWHT-UHFFFAOYSA-N 2 0 403.364 4.460 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)[NH+]2CCCC2)cc1 ZINC000064237491 851855328 /nfs/dbraw/zinc/85/53/28/851855328.db2.gz UYHZBZZOJIHNNM-RUZDIDTESA-N 2 0 420.601 4.227 20 0 HIADRP CC(C)[C@@H](CNC(=O)NCC1CC[NH+](Cc2cccs2)CC1)[NH+]1CCC(C)CC1 ZINC000064251208 851856659 /nfs/dbraw/zinc/85/66/59/851856659.db2.gz BZJGWUOLWKLOPD-JOCHJYFZSA-N 2 0 420.667 4.016 20 0 HIADRP O=C(NC[C@@H](c1ccccc1)[NH+]1CCCC1)NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000065517791 852164491 /nfs/dbraw/zinc/16/44/91/852164491.db2.gz SPEOASOIEHQZKB-ZCYQVOJMSA-N 2 0 420.601 4.035 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3cc(Cl)cc(Cl)c3OC)cc2)CC1 ZINC000065932099 852321889 /nfs/dbraw/zinc/32/18/89/852321889.db2.gz YOMKSNWMXMCHSO-UHFFFAOYSA-N 2 0 422.400 4.429 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000079308877 852541534 /nfs/dbraw/zinc/54/15/34/852541534.db2.gz IONVHZOXBZZVRS-FQEVSTJZSA-N 2 0 405.542 4.279 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1 ZINC000109339705 852955257 /nfs/dbraw/zinc/95/52/57/852955257.db2.gz ZKYKBUWJUPIWDI-HSZRJFAPSA-N 2 0 411.565 4.196 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@@H](c2ccc(OC)cc2)[NH+]2CCCC2)cc1)C(C)C ZINC000110126789 853064312 /nfs/dbraw/zinc/06/43/12/853064312.db2.gz KSMLJLZUEDUFQR-VWLOTQADSA-N 2 0 423.601 4.492 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(CN3CC[NH+](CC)CC3)cc2)cc1)C(C)C ZINC000110168178 853068441 /nfs/dbraw/zinc/06/84/41/853068441.db2.gz WJWGTMLAPSPJOM-UHFFFAOYSA-N 2 0 422.617 4.307 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)C(=O)NCc1ccc(F)cc1 ZINC000195538717 853673648 /nfs/dbraw/zinc/67/36/48/853673648.db2.gz JNZOBXDQQMEDBL-ZCNNSNEGSA-N 2 0 411.565 4.098 20 0 HIADRP CC1(C)CC([NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)CC(C)(C)[NH2+]1 ZINC000236687221 853911570 /nfs/dbraw/zinc/91/15/70/853911570.db2.gz BQSGHPLMGLBRBJ-UHFFFAOYSA-N 2 0 403.574 4.392 20 0 HIADRP CC(C)(C)C(=O)N1CCC([NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)CC1 ZINC000236765341 853920569 /nfs/dbraw/zinc/92/05/69/853920569.db2.gz VIXANOLKJQURED-UHFFFAOYSA-N 2 0 413.650 4.348 20 0 HIADRP CC(C)(C)n1cc(C[NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)c(-c2ccccc2Cl)n1 ZINC000236781768 853922358 /nfs/dbraw/zinc/92/23/58/853922358.db2.gz HQLVNKZNHZFONW-LJQANCHMSA-N 2 0 419.013 4.285 20 0 HIADRP CCC[NH+]1CCC(C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)CC1 ZINC000236812590 853925980 /nfs/dbraw/zinc/92/59/80/853925980.db2.gz MNDITOAQEMUCFY-UHFFFAOYSA-N 2 0 403.574 4.205 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)C1(c2ccccc2)CC[NH2+]CC1)c1ccccc1Cl ZINC000236819699 853926920 /nfs/dbraw/zinc/92/69/20/853926920.db2.gz UPVYUTRKIIZCAP-QFIPXVFZSA-N 2 0 413.993 4.161 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000236838232 853927555 /nfs/dbraw/zinc/92/75/55/853927555.db2.gz ZAGNGSLSNCFQPF-UHFFFAOYSA-N 2 0 417.601 4.047 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(-n3cccn3)cc2)CC1 ZINC000236853041 853928878 /nfs/dbraw/zinc/92/88/78/853928878.db2.gz ROYFVCDSMXYFIX-IBGZPJMESA-N 2 0 407.537 4.004 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2ccc(-c3ccccc3Br)s2)CC1 ZINC000236974287 853945271 /nfs/dbraw/zinc/94/52/71/853945271.db2.gz QHXGGRAMWJDHFJ-INIZCTEOSA-N 2 0 422.436 4.293 20 0 HIADRP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000237068201 853959955 /nfs/dbraw/zinc/95/99/55/853959955.db2.gz ZZUKSKMUULTVTE-UHFFFAOYSA-N 2 0 417.601 4.309 20 0 HIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]Cc1ccc(Cn2ccccc2=O)cc1 ZINC000237133090 853969683 /nfs/dbraw/zinc/96/96/83/853969683.db2.gz KFNDTTRKMYRGJV-UHFFFAOYSA-N 2 0 403.570 4.144 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+]Cc2ccc(-c3ccccc3Br)s2)CC1 ZINC000237172908 853975284 /nfs/dbraw/zinc/97/52/84/853975284.db2.gz PIVRYONBXOPVHQ-UHFFFAOYSA-N 2 0 422.436 4.295 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1OCc1cccnc1 ZINC000237227075 853986397 /nfs/dbraw/zinc/98/63/97/853986397.db2.gz YEUJOORHGYRCQE-UHFFFAOYSA-N 2 0 409.505 4.160 20 0 HIADRP C[C@@H](C[NH2+]Cc1ccc(-c2ccc(Br)cc2)s1)CN1CC[NH+](C)CC1 ZINC000237408267 854025616 /nfs/dbraw/zinc/02/56/16/854025616.db2.gz HXQABVMXJCGPPP-INIZCTEOSA-N 2 0 422.436 4.151 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1OC(F)F ZINC000237441024 854033604 /nfs/dbraw/zinc/03/36/04/854033604.db2.gz BBQBUJPHUMUTCE-IRXDYDNUSA-N 2 0 420.500 4.196 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2nc(-c3cccc(Br)c3)c[nH]2)C1 ZINC000237464734 854038095 /nfs/dbraw/zinc/03/80/95/854038095.db2.gz RHSVGWHHAZPWIH-MRXNPFEDSA-N 2 0 405.384 4.441 20 0 HIADRP Cc1ccc(NC(=O)C[C@H](C)[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)c(C)c1 ZINC000237583070 854058261 /nfs/dbraw/zinc/05/82/61/854058261.db2.gz XKXJTSOWLXXCTP-FKBYEOEOSA-N 2 0 423.601 4.420 20 0 HIADRP Cc1nn(Cc2ccccc2Cl)c(C)c1C[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000237608962 854061466 /nfs/dbraw/zinc/06/14/66/854061466.db2.gz RIQJEJSIQGHOFK-HDICACEKSA-N 2 0 419.013 4.181 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(OC(F)(F)F)cc2)C[C@H](C)O1 ZINC000237622393 854064114 /nfs/dbraw/zinc/06/41/14/854064114.db2.gz QRDXPRBPNSKNBS-IRXDYDNUSA-N 2 0 408.464 4.484 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2ccccc2OC2CCCC2)cc1 ZINC000238075882 854140884 /nfs/dbraw/zinc/14/08/84/854140884.db2.gz SXGMAEAFNPOXDO-UHFFFAOYSA-N 2 0 421.585 4.123 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2CNc2cc[nH+]c3cc(C(F)(F)F)ccc23)C1 ZINC000302067693 854525212 /nfs/dbraw/zinc/52/52/12/854525212.db2.gz WTFDVWBKAQRZOS-SFHVURJKSA-N 2 0 401.432 4.432 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)c2cccs2)CC1 ZINC000303276783 854847911 /nfs/dbraw/zinc/84/79/11/854847911.db2.gz IYMZMMWHZFNCIU-SFTDATJTSA-N 2 0 418.651 4.181 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000303551088 855034848 /nfs/dbraw/zinc/03/48/48/855034848.db2.gz VWWPBTMKVLBUMD-AAZCMCCISA-N 2 0 405.586 4.381 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCCN(C(=O)OC(C)(C)C)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309807027 855365513 /nfs/dbraw/zinc/36/55/13/855365513.db2.gz UUZSGTMVZYRLTI-ILWGZMRPSA-N 2 0 401.595 4.276 20 0 HIADRP COc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc(Br)c1O ZINC000388633291 855448023 /nfs/dbraw/zinc/44/80/23/855448023.db2.gz ILIXMUBFQZOFQF-CRAIPNDOSA-N 2 0 419.363 4.164 20 0 HIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000400511923 855478609 /nfs/dbraw/zinc/47/86/09/855478609.db2.gz JLXRJCWTGVPDHL-CTNGQTDRSA-N 2 0 401.595 4.134 20 0 HIADRP CSc1ccccc1[C@@H](C)[NH2+][C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000409848380 855685563 /nfs/dbraw/zinc/68/55/63/855685563.db2.gz CPBVJKUJHYSSFX-RTBURBONSA-N 2 0 411.615 4.228 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000410313748 855923037 /nfs/dbraw/zinc/92/30/37/855923037.db2.gz WTCZWQKAIZCQPP-RUZDIDTESA-N 2 0 422.617 4.076 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)c1ccccc1 ZINC000410327618 855930201 /nfs/dbraw/zinc/93/02/01/855930201.db2.gz KQZDPUKIUHOCLK-RUZDIDTESA-N 2 0 422.617 4.342 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)CC1 ZINC000410334856 855934353 /nfs/dbraw/zinc/93/43/53/855934353.db2.gz YBVTZXDHSKSMMR-UHFFFAOYSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)cc1 ZINC000410336873 855935490 /nfs/dbraw/zinc/93/54/90/855935490.db2.gz KAKPRMCCHMIDTJ-RXVVDRJESA-N 2 0 414.619 4.225 20 0 HIADRP C[C@@H]1CCCC[NH+]1Cc1ccc(CNC(=O)NCCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC000410337760 855936497 /nfs/dbraw/zinc/93/64/97/855936497.db2.gz PSCNBOBLAYSWRI-FCHUYYIVSA-N 2 0 414.638 4.372 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NC[C@H](c3ccsc3)[NH+](C)C)cc2)CC1 ZINC000410341214 855938353 /nfs/dbraw/zinc/93/83/53/855938353.db2.gz UTUUZBZDUYKHRI-JOCHJYFZSA-N 2 0 414.619 4.082 20 0 HIADRP CCc1ccc([C@@H](CNC(=O)NCc2ccccc2C[N@H+](C)C(C)C)[NH+](C)C)cc1 ZINC000410358836 855948908 /nfs/dbraw/zinc/94/89/08/855948908.db2.gz ITBMPMVNYASIMW-XMMPIXPASA-N 2 0 410.606 4.191 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC[C@@H](c3ccccc3)[NH+](C)C)cc2)C1 ZINC000410359704 855949537 /nfs/dbraw/zinc/94/95/37/855949537.db2.gz OCBFSMUATRWBEU-RDPSFJRHSA-N 2 0 408.590 4.021 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)CC1 ZINC000410374733 855959563 /nfs/dbraw/zinc/95/95/63/855959563.db2.gz NLEYNFQGNOFNGG-NRFANRHFSA-N 2 0 414.638 4.182 20 0 HIADRP Cc1ccc2cc([C@@H](C)[NH2+]Cc3ccc(C(=O)NCC[NH+]4CCCC4)cc3)oc2c1 ZINC000426060342 856079796 /nfs/dbraw/zinc/07/97/96/856079796.db2.gz HCSWKSISYRDXLT-LJQANCHMSA-N 2 0 405.542 4.418 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)Nc2ccc(OCC[NH+]3CCCCC3)cc2)CC1 ZINC000426152363 856142193 /nfs/dbraw/zinc/14/21/93/856142193.db2.gz FXIWEFYXXIZMKR-UHFFFAOYSA-N 2 0 416.610 4.137 20 0 HIADRP C[C@@H]1CCN(C(=O)[C@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000437463442 862826719 /nfs/dbraw/zinc/82/67/19/862826719.db2.gz SMYPUXNUIFJPOY-RDGATRHJSA-N 2 0 405.586 4.022 20 0 HIADRP C[C@H]1CCN(C(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000437463443 862827154 /nfs/dbraw/zinc/82/71/54/862827154.db2.gz SMYPUXNUIFJPOY-WIOPSUGQSA-N 2 0 405.586 4.022 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000428260417 857130907 /nfs/dbraw/zinc/13/09/07/857130907.db2.gz LJFCUEQWBUXPDY-PXDATVDWSA-N 2 0 422.617 4.381 20 0 HIADRP C[C@@H]([NH2+]CCC[NH2+][C@@H](C)[C@H]1OCCc2sccc21)[C@@H]1OCCc2sccc21 ZINC000429119981 857518894 /nfs/dbraw/zinc/51/88/94/857518894.db2.gz BFVOZXFLXQDLHZ-ZFJWPNLUSA-N 2 0 406.617 4.084 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429422413 857657417 /nfs/dbraw/zinc/65/74/17/857657417.db2.gz XCMKEXLVKMGSPT-AZGAKELHSA-N 2 0 404.529 4.466 20 0 HIADRP CC[NH+](CC)CCO[C@@H]1CCN([C@@H](c2nc(-c3ccccc3)no2)c2ccccc2)C1 ZINC000430000434 857991074 /nfs/dbraw/zinc/99/10/74/857991074.db2.gz PKGSUSRHGKYDCV-DHIUTWEWSA-N 2 0 420.557 4.259 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)C2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000430620734 858238154 /nfs/dbraw/zinc/23/81/54/858238154.db2.gz BQAXPVZAGMTFGU-PXDATVDWSA-N 2 0 405.586 4.068 20 0 HIADRP CC(=O)c1c(C)cc(C)c(C[N@@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c1C ZINC000430922635 858371497 /nfs/dbraw/zinc/37/14/97/858371497.db2.gz BRFUXVWBNCTVPA-UHFFFAOYSA-N 2 0 413.650 4.443 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cc(-c4cccs4)on3)CC2)CC1 ZINC000430951427 858380555 /nfs/dbraw/zinc/38/05/55/858380555.db2.gz LIBSEKWATPTFEP-UHFFFAOYSA-N 2 0 402.608 4.031 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000431039341 858413913 /nfs/dbraw/zinc/41/39/13/858413913.db2.gz HVPGMVZKWRAPME-NTKDMRAZSA-N 2 0 400.526 4.030 20 0 HIADRP C[C@@H](CCN1CC[NH+](CC2CCCCC2)CC1)N1CC[NH+](CC2CCCCC2)CC1 ZINC000431595124 858681318 /nfs/dbraw/zinc/68/13/18/858681318.db2.gz IFDAJWQRRHIAIF-DEOSSOPVSA-N 2 0 418.714 4.161 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000431623180 858695842 /nfs/dbraw/zinc/69/58/42/858695842.db2.gz RYWOFDYNKBYCMQ-XUZZJYLKSA-N 2 0 414.638 4.097 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)CC1 ZINC000431626618 858698138 /nfs/dbraw/zinc/69/81/38/858698138.db2.gz WMQRYSLVPFDGMA-RBBKRZOGSA-N 2 0 420.667 4.188 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000431678961 858734455 /nfs/dbraw/zinc/73/44/55/858734455.db2.gz OBXOSDXPDWBDHR-IEZKXTBUSA-N 2 0 420.601 4.176 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccco1 ZINC000431697479 858746703 /nfs/dbraw/zinc/74/67/03/858746703.db2.gz IDZALAPNPQKZNV-KSEOMHKRSA-N 2 0 412.578 4.015 20 0 HIADRP C[NH+](C)CC[C@@H](NC(=O)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2)C(C)(C)C ZINC000431950406 858883487 /nfs/dbraw/zinc/88/34/87/858883487.db2.gz LRBLLIOZDBCVCB-JOCHJYFZSA-N 2 0 414.638 4.051 20 0 HIADRP COc1cc(C[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)ccc1OCc1ccc(F)cc1 ZINC000432353530 859116769 /nfs/dbraw/zinc/11/67/69/859116769.db2.gz MQGTZFYMZFRFEW-IBGZPJMESA-N 2 0 416.537 4.004 20 0 HIADRP C[C@H]1CN(CCC[NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCCO1 ZINC000432424567 859159089 /nfs/dbraw/zinc/15/90/89/859159089.db2.gz PFIXTRMFURJOPO-QFBILLFUSA-N 2 0 403.567 4.417 20 0 HIADRP C[NH+](C)[C@@H]1CCOc2c(NCc3c(Cl)cccc3N3CC[NH+](C)CC3)cccc21 ZINC000433204158 859566001 /nfs/dbraw/zinc/56/60/01/859566001.db2.gz FDXNFPLXPWJACS-OAQYLSRUSA-N 2 0 414.981 4.089 20 0 HIADRP CN1CCO[C@H]([C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c2ccc(Cl)cc2)C1 ZINC000467736040 881539866 /nfs/dbraw/zinc/53/98/66/881539866.db2.gz TWXGKSZDXZWXCS-BJKOFHAPSA-N 2 0 413.993 4.097 20 0 HIADRP C[C@@H]([NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1)c1nc(C(F)(F)F)cs1 ZINC000467738101 881541600 /nfs/dbraw/zinc/54/16/00/881541600.db2.gz RFFQOPMAJFYUMV-WBVHZDCISA-N 2 0 412.525 4.191 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000434898591 860543191 /nfs/dbraw/zinc/54/31/91/860543191.db2.gz VZAWTQQWPHAQKG-BPYKYCOYSA-N 2 0 405.586 4.034 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)CC1 ZINC000438830673 864324282 /nfs/dbraw/zinc/32/42/82/864324282.db2.gz OVZWTZAEFFKTJR-UHFFFAOYSA-N 3 0 421.629 4.176 20 0 HIADRP CCN(C(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccccc1 ZINC000439594763 864917894 /nfs/dbraw/zinc/91/78/94/864917894.db2.gz KQRKIRCELYMDMC-FQEVSTJZSA-N 2 0 405.542 4.443 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2CCCCOc1cccc(C(F)(F)F)c1 ZINC000441266999 866341958 /nfs/dbraw/zinc/34/19/58/866341958.db2.gz OQWCXGSBISFRCC-HOJAQTOUSA-N 2 0 400.485 4.048 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1(C)C ZINC000441368335 866437922 /nfs/dbraw/zinc/43/79/22/866437922.db2.gz JZQXMNAUJFHINB-UHFFFAOYSA-N 2 0 401.982 4.035 20 0 HIADRP O=C(CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)N(Cc1ccccc1)c1ccccc1 ZINC000441401344 866475281 /nfs/dbraw/zinc/47/52/81/866475281.db2.gz MGHCINRITXPMFR-DHLKQENFSA-N 2 0 403.570 4.169 20 0 HIADRP O[C@H](COc1ccc(-c2ccccc2)cc1)C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441408708 866482112 /nfs/dbraw/zinc/48/21/12/866482112.db2.gz XOEDILFAFKTFSF-CWDLOFLHSA-N 2 0 406.570 4.042 20 0 HIADRP C[N@H+](C[C@H](O)Cc1ccccc1C(F)(F)F)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000443609411 868170162 /nfs/dbraw/zinc/17/01/62/868170162.db2.gz MCYQQLIRWHRCAX-PZJWPPBQSA-N 2 0 406.492 4.063 20 0 HIADRP C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000443634156 868212401 /nfs/dbraw/zinc/21/24/01/868212401.db2.gz UTQIAUAJSYCECP-QGZVFWFLSA-N 2 0 403.954 4.490 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)Nc2ccccc2CC[NH+](C)C)c2cccs2)CC1 ZINC000446595587 870502532 /nfs/dbraw/zinc/50/25/32/870502532.db2.gz WJBMMELWDOQLPG-NRFANRHFSA-N 2 0 414.619 4.447 20 0 HIADRP COc1ccc([C@H](CCn2cncn2)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC000446747340 870654243 /nfs/dbraw/zinc/65/42/43/870654243.db2.gz CJCUKPGKDOUJSL-VWLOTQADSA-N 2 0 419.573 4.194 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cc2ccccc2s1 ZINC000446819623 870734374 /nfs/dbraw/zinc/73/43/74/870734374.db2.gz YTQPARBWXVCPBP-UTKZUKDTSA-N 2 0 407.583 4.449 20 0 HIADRP c1ccc(CC[NH+]2CCC(N[C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)CC2)cc1 ZINC000447563073 871458463 /nfs/dbraw/zinc/45/84/63/871458463.db2.gz NYRVLYXVRVPGQR-LGKQTMLJSA-N 2 0 403.614 4.479 20 0 HIADRP OCC1CC[NH+](Cc2cccc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2)CC1 ZINC000447596215 871499775 /nfs/dbraw/zinc/49/97/75/871499775.db2.gz BWDIIXFPMVHWLJ-OJXFFNQFSA-N 2 0 419.613 4.498 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC000448212159 872113988 /nfs/dbraw/zinc/11/39/88/872113988.db2.gz GUPDIBAXYQJKNO-PBXXJUDPSA-N 2 0 424.633 4.077 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)N3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)cc2)C1 ZINC000448216636 872122271 /nfs/dbraw/zinc/12/22/71/872122271.db2.gz FFCBSIORTQXZRF-XRODADMRSA-N 2 0 424.633 4.077 20 0 HIADRP C[NH+](C)CC1(C(=O)NC[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)c(F)c2)CCCCC1 ZINC000460110383 872575400 /nfs/dbraw/zinc/57/54/00/872575400.db2.gz DQDLIFQNQCTVMX-PXNSSMCTSA-N 2 0 409.977 4.100 20 0 HIADRP C[C@H](C[NH2+]Cc1ccccc1Oc1ccc(F)cc1Cl)CN1CC[NH+](C)CC1 ZINC000461412480 874429040 /nfs/dbraw/zinc/42/90/40/874429040.db2.gz COQJWKBHAUSVPA-QGZVFWFLSA-N 2 0 405.945 4.245 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N2C[C@@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC000461435846 874487376 /nfs/dbraw/zinc/48/73/76/874487376.db2.gz KQJPHJKKSSLNJL-DQEYMECFSA-N 2 0 405.586 4.123 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2cccc(CN3CC[NH+](C)CC3)c2)cc1 ZINC000461867300 875018027 /nfs/dbraw/zinc/01/80/27/875018027.db2.gz PNIWYGBNFTXYGT-OAQYLSRUSA-N 2 0 420.601 4.061 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@@H](C)C1 ZINC000462813583 875856295 /nfs/dbraw/zinc/85/62/95/875856295.db2.gz APQWSWARTWNLMG-GIUOSPMZSA-N 2 0 409.412 4.422 20 0 HIADRP C[C@H]([NH2+]Cc1cc(Br)cc2c1OCC2)c1ccc(OCC[NH+](C)C)cc1 ZINC000462845364 875880422 /nfs/dbraw/zinc/88/04/22/875880422.db2.gz LQHMQGAWBCVWQD-HNNXBMFYSA-N 2 0 419.363 4.175 20 0 HIADRP COc1cccc([C@@H](C)N2CCN(C(=O)c3oc4ccccc4c3C[NH+](C)C)CC2)c1 ZINC000468991828 883058774 /nfs/dbraw/zinc/05/87/74/883058774.db2.gz OYWAGYFKHJJFPC-GOSISDBHSA-N 2 0 421.541 4.022 20 0 HIADRP C[N@H+](C[C@H](O)COc1c(Cl)cccc1Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464853494 878134706 /nfs/dbraw/zinc/13/47/06/878134706.db2.gz RZGHZVQBJMNUTP-MOPGFXCFSA-N 2 0 423.384 4.187 20 0 HIADRP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2ccc(C)cc2)[C@H]2CCc3ccccc32)CC1 ZINC000464864881 878148371 /nfs/dbraw/zinc/14/83/71/878148371.db2.gz BNOGIXSGVJUZJX-VWLOTQADSA-N 2 0 405.586 4.085 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc3ccn(CC[NH+](C)C)c3c2)cc1)C1CC1 ZINC000465140454 878522546 /nfs/dbraw/zinc/52/25/46/878522546.db2.gz RWZXWWXDGPGWQM-UHFFFAOYSA-N 2 0 404.558 4.440 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](C1CCCCC1)[NH+](C)C ZINC000465533097 878989497 /nfs/dbraw/zinc/98/94/97/878989497.db2.gz IULGMQBBDVOEPO-UPVQGACJSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)C1 ZINC000465540514 879000731 /nfs/dbraw/zinc/00/07/31/879000731.db2.gz LLJQDRMXEFCOHR-LGVFNWMJSA-N 2 0 414.638 4.180 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1C ZINC000465567803 879042561 /nfs/dbraw/zinc/04/25/61/879042561.db2.gz IWKDUFIINCFCAH-RDPSFJRHSA-N 2 0 420.601 4.231 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N(C)CC[C@@H]1CCCC[NH+]1C ZINC000465571753 879047103 /nfs/dbraw/zinc/04/71/03/879047103.db2.gz OCUIPHMGPJWNMS-OFNKIYASSA-N 2 0 400.611 4.077 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)CC(C)C ZINC000465581208 879062166 /nfs/dbraw/zinc/06/21/66/879062166.db2.gz ZEFVTHHDMNQUAO-ZJOUEHCJSA-N 2 0 408.656 4.187 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC[C@H]1CCC[NH+](C)[C@@H]1c1cccs1 ZINC000465591929 879075706 /nfs/dbraw/zinc/07/57/06/879075706.db2.gz GACAFLQXKMCFOM-SBHAEUEKSA-N 2 0 406.640 4.085 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)NC[C@H]2CCC[NH+](C)[C@@H]2c2cccs2)C1 ZINC000465594695 879080441 /nfs/dbraw/zinc/08/04/41/879080441.db2.gz IMXPGVPLGLVEBV-DYQZNNLLSA-N 2 0 420.667 4.188 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@@]1([NH+](C)C)CCC[C@@H](C)C1 ZINC000465715872 879289039 /nfs/dbraw/zinc/28/90/39/879289039.db2.gz VNOIYGUMXCJUJS-GZGNHOFSSA-N 2 0 414.638 4.051 20 0 HIADRP C[C@H](C(=O)Nc1ccccc1-c1ccccc1)[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000467212346 880942360 /nfs/dbraw/zinc/94/23/60/880942360.db2.gz WEXPVTDYIQWIRM-OAQYLSRUSA-N 2 0 421.585 4.257 20 0 HIADRP Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C1 ZINC000467336090 881085531 /nfs/dbraw/zinc/08/55/31/881085531.db2.gz NSDUOBASHXPQDA-BJKOFHAPSA-N 2 0 420.601 4.032 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]CCCC[NH+]1CCN(c3ccccc3)CC1)CCS2 ZINC000467396076 881179996 /nfs/dbraw/zinc/17/99/96/881179996.db2.gz WGNJDOGQWUILNW-HSZRJFAPSA-N 2 0 411.615 4.424 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H]2CCSc3ccc(OC)cc32)CC1 ZINC000467416535 881205593 /nfs/dbraw/zinc/20/55/93/881205593.db2.gz GVNHTSAGSZBDOK-HSZRJFAPSA-N 2 0 411.615 4.159 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2c(-c3ccccc3)nc3ccccn32)[C@H](C)C1 ZINC000469770687 883944558 /nfs/dbraw/zinc/94/45/58/883944558.db2.gz VWJXGCRBTYIDIA-IFMALSPDSA-N 2 0 406.574 4.228 20 0 HIADRP CC1(C)[C@H](C(F)(F)F)CC[NH+]1CCOCC[N@H+]1CC[C@@H](C(F)(F)F)C1(C)C ZINC000469992641 884208302 /nfs/dbraw/zinc/20/83/02/884208302.db2.gz SKTKANGMYOWJEY-ZIAGYGMSSA-N 2 0 404.439 4.329 20 0 HIADRP CCC[NH+]1CCC(N(C)C(=O)NCC(CC)(CC)[NH2+][C@H](C)c2ccccc2)CC1 ZINC000503710858 912806129 /nfs/dbraw/zinc/80/61/29/912806129.db2.gz YUVBQOSCSWVJCG-HXUWFJFHSA-N 2 0 402.627 4.412 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000503723998 912810659 /nfs/dbraw/zinc/81/06/59/912810659.db2.gz HQVJYAVOMHMCMS-RBBKRZOGSA-N 2 0 400.611 4.166 20 0 HIADRP CC[NH+](CC)C[C@H]1CCN(C(=O)[C@@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)C1 ZINC000470545056 884954427 /nfs/dbraw/zinc/95/44/27/884954427.db2.gz BESLBWCUSVXTCM-YLJYHZDGSA-N 2 0 413.528 4.279 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000472145474 886942806 /nfs/dbraw/zinc/94/28/06/886942806.db2.gz HWHBBLFTWDUAPU-CQSZACIVSA-N 2 0 413.418 4.233 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1ccc(-c2cccc(Br)c2)s1 ZINC000472148283 886946763 /nfs/dbraw/zinc/94/67/63/886946763.db2.gz YVQBVGDQEZTYMR-MRXNPFEDSA-N 2 0 422.436 4.293 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N2CCC([NH+]3CCCCC3)CC2)c1 ZINC000473739941 888520621 /nfs/dbraw/zinc/52/06/21/888520621.db2.gz VZUQAEUCDMGIIN-UHFFFAOYSA-N 2 0 414.638 4.469 20 0 HIADRP CCN(C(=O)NCc1ccc(C[NH+](C)C)cc1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473875464 888739130 /nfs/dbraw/zinc/73/91/30/888739130.db2.gz NQJOQKMHCCLYJQ-RDPSFJRHSA-N 2 0 408.590 4.115 20 0 HIADRP CCN(C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473886809 888755912 /nfs/dbraw/zinc/75/59/12/888755912.db2.gz NVKVBDQTFNMYSV-RXVVDRJESA-N 2 0 400.611 4.163 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)N[C@H]2[C@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000474005141 888863652 /nfs/dbraw/zinc/86/36/52/888863652.db2.gz CDXMIVJRUDPNOX-ZZYHAFTGSA-N 2 0 422.617 4.094 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc(Cl)cc3-n3cncn3)cc2)C1 ZINC000474464133 889329037 /nfs/dbraw/zinc/32/90/37/889329037.db2.gz LBWJBAURSCNXNA-SFHVURJKSA-N 2 0 409.965 4.442 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NC2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000475119071 889975337 /nfs/dbraw/zinc/97/53/37/889975337.db2.gz NKNBWBKDQWJNCW-UHFFFAOYSA-N 2 0 412.622 4.056 20 0 HIADRP FC(F)(F)Oc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1Br ZINC000475192231 890061550 /nfs/dbraw/zinc/06/15/50/890061550.db2.gz LMBCOCSSAVQPTI-UHFFFAOYSA-N 2 0 407.274 4.312 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1cc2cccc(F)c2o1 ZINC000475712868 890649812 /nfs/dbraw/zinc/64/98/12/890649812.db2.gz GWRXUZLMCPWNSY-MSOLQXFVSA-N 2 0 423.532 4.392 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000476006863 890935683 /nfs/dbraw/zinc/93/56/83/890935683.db2.gz OFUXPCFSOWBSDC-NRFANRHFSA-N 2 0 412.622 4.090 20 0 HIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000476775941 891751811 /nfs/dbraw/zinc/75/18/11/891751811.db2.gz JIMSEBNJGSCOHX-SUMDDJOVSA-N 2 0 413.528 4.371 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)[C@H]2CC[NH+](C3CCCCC3)C2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000476977604 891903542 /nfs/dbraw/zinc/90/35/42/891903542.db2.gz ASKXHEPWSUOTAN-KGVIQGDOSA-N 2 0 421.988 4.243 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000477918480 893002120 /nfs/dbraw/zinc/00/21/20/893002120.db2.gz PTIOUWWGIHOMOV-LJQANCHMSA-N 2 0 415.603 4.141 20 0 HIADRP Cc1ccccc1[C@@H]([C@H](C)NC(=O)[C@@H]1C[N@@H+](C(C)(C)C)C[C@H]1C(F)(F)F)[NH+](C)C ZINC000504984595 913730132 /nfs/dbraw/zinc/73/01/32/913730132.db2.gz GXUPHVKESPTQSI-JCHJZTRSSA-N 2 0 413.528 4.011 20 0 HIADRP Cc1ccccc1[C@H]([C@H](C)NC(=O)[C@@H]1C[N@@H+](C(C)(C)C)C[C@H]1C(F)(F)F)[NH+](C)C ZINC000504984594 913730913 /nfs/dbraw/zinc/73/09/13/913730913.db2.gz GXUPHVKESPTQSI-AITUJVMLSA-N 2 0 413.528 4.011 20 0 HIADRP C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479284742 894563470 /nfs/dbraw/zinc/56/34/70/894563470.db2.gz QEIJAYNORQYPSP-CYBMUJFWSA-N 2 0 422.333 4.145 20 0 HIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)c1ccc(Br)cc1C(F)(F)F ZINC000479297299 894580128 /nfs/dbraw/zinc/58/01/28/894580128.db2.gz RFGOESIUDHTZFQ-HIFRSBDPSA-N 2 0 423.317 4.355 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000480225431 895629006 /nfs/dbraw/zinc/62/90/06/895629006.db2.gz KMHXIVIXGVPQMC-NJYVYQBISA-N 2 0 421.585 4.273 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000480225430 895629638 /nfs/dbraw/zinc/62/96/38/895629638.db2.gz KMHXIVIXGVPQMC-NJDAHSKKSA-N 2 0 421.585 4.273 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(-n2cccn2)cc1 ZINC000480231695 895636688 /nfs/dbraw/zinc/63/66/88/895636688.db2.gz SQHSPVAZEQIEBA-NJDAHSKKSA-N 2 0 404.558 4.332 20 0 HIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCN(Cc4ccccn4)C[C@H]3C)cc2)CC1 ZINC000480256289 895667053 /nfs/dbraw/zinc/66/70/53/895667053.db2.gz ACENQHLYTYGUPE-GJZUVCINSA-N 2 0 406.618 4.314 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000480265302 895673648 /nfs/dbraw/zinc/67/36/48/895673648.db2.gz MJVWJDISEYGACC-IBGZPJMESA-N 2 0 415.603 4.141 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H](Cc1cccc(F)c1)c1cccc(F)c1)N1CC[NH+](C)CC1 ZINC000480539199 895901932 /nfs/dbraw/zinc/90/19/32/895901932.db2.gz JVOKSZFHPIJCNC-BJKOFHAPSA-N 2 0 401.545 4.110 20 0 HIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C[C@@H](C(C)C)N3CC[NH+](C)CC3)s2)cc1 ZINC000480542884 895903841 /nfs/dbraw/zinc/90/38/41/895903841.db2.gz UUODFVGGKAYGKF-UWJYYQICSA-N 2 0 416.635 4.050 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000480599713 895962790 /nfs/dbraw/zinc/96/27/90/895962790.db2.gz CNTPGOHCNMOLJB-OALUTQOASA-N 2 0 415.603 4.283 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCC[C@H]2C)[C@@H](C)C1 ZINC000480610279 895974837 /nfs/dbraw/zinc/97/48/37/895974837.db2.gz NFBRKRMSFWFUFR-FBLLAGFSSA-N 3 0 401.639 4.288 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000480612358 895978596 /nfs/dbraw/zinc/97/85/96/895978596.db2.gz LQCYVTJIFXSIQP-UFPGJGBJSA-N 2 0 406.618 4.456 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cccc(NS(C)(=O)=O)c1 ZINC000480613912 895980957 /nfs/dbraw/zinc/98/09/57/895980957.db2.gz NFPGHHQGECKHQM-RBUKOAKNSA-N 2 0 415.603 4.283 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000480619841 895987628 /nfs/dbraw/zinc/98/76/28/895987628.db2.gz QPZLURIDUWIWKG-OALUTQOASA-N 2 0 415.603 4.141 20 0 HIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H](c1ccccc1)N1CCOCC1 ZINC000480621172 895990140 /nfs/dbraw/zinc/99/01/40/895990140.db2.gz JBTRAVZFQVJIMC-SNTDPOMNSA-N 2 0 419.613 4.234 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2cc(Br)c(Cl)s2)cc1 ZINC000480658540 896025456 /nfs/dbraw/zinc/02/54/56/896025456.db2.gz DIGOZFZFRKLYRY-UHFFFAOYSA-N 2 0 403.773 4.394 20 0 HIADRP C[C@H](Nc1cccc2c1CC[N@H+](CC(C)(C)O)C2)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000480671428 896035503 /nfs/dbraw/zinc/03/55/03/896035503.db2.gz MSZZPWYFVAPQLK-RBBKRZOGSA-N 2 0 407.602 4.138 20 0 HIADRP Cc1ccc(OCCCC(=O)Nc2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000480708237 896070852 /nfs/dbraw/zinc/07/08/52/896070852.db2.gz IKRXTEBKNJUQKC-REWPJTCUSA-N 2 0 409.574 4.365 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000480739891 896100369 /nfs/dbraw/zinc/10/03/69/896100369.db2.gz OEAOXKODHWHBBH-QGZVFWFLSA-N 2 0 407.587 4.116 20 0 HIADRP Cc1ccccc1OCCCC(=O)Nc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000480741151 896102279 /nfs/dbraw/zinc/10/22/79/896102279.db2.gz RJZSEZABISQPNC-REWPJTCUSA-N 2 0 409.574 4.365 20 0 HIADRP Cc1ncc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)c(C)n1 ZINC000480746906 896109487 /nfs/dbraw/zinc/10/94/87/896109487.db2.gz SHPRUOWQNPMEHC-HXUWFJFHSA-N 2 0 415.585 4.266 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](C)[C@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000480776528 896140363 /nfs/dbraw/zinc/14/03/63/896140363.db2.gz CICRUSBNZDIQHX-IRXDYDNUSA-N 2 0 402.410 4.157 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1cncs1 ZINC000480777389 896143156 /nfs/dbraw/zinc/14/31/56/896143156.db2.gz IKKWVRGTPABFMX-MRXNPFEDSA-N 2 0 412.525 4.415 20 0 HIADRP COc1ccc2ccccc2c1-c1cc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)on1 ZINC000480780881 896146157 /nfs/dbraw/zinc/14/61/57/896146157.db2.gz PCPLRKQPIFBMPK-UHFFFAOYSA-N 2 0 421.541 4.048 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](c3ccccc3)c3ccc(F)cc3)cn2)CC1 ZINC000480790764 896158604 /nfs/dbraw/zinc/15/86/04/896158604.db2.gz JEIAAVIVIZVYDB-VWLOTQADSA-N 2 0 404.533 4.242 20 0 HIADRP COc1ccc2oc([C@H](C)[NH2+]Cc3ccc(CN4CC[NH+](C)CC4)cc3)c(C)c2c1 ZINC000480907123 896262890 /nfs/dbraw/zinc/26/28/90/896262890.db2.gz KAUHHVDDXDTJCK-IBGZPJMESA-N 2 0 407.558 4.348 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H](O)Cc1ccccc1C(F)(F)F ZINC000481180672 896521866 /nfs/dbraw/zinc/52/18/66/896521866.db2.gz XKAYSSGUNACEPY-NQSCKRDGSA-N 2 0 406.492 4.109 20 0 HIADRP C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000481301396 896645598 /nfs/dbraw/zinc/64/55/98/896645598.db2.gz YYTJNXBHPWJFFZ-DFBJGRDBSA-N 2 0 413.556 4.429 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1 ZINC000482111365 897562107 /nfs/dbraw/zinc/56/21/07/897562107.db2.gz BGKOEIUGJLRWAU-CPJSRVTESA-N 2 0 414.553 4.334 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000482117935 897571420 /nfs/dbraw/zinc/57/14/20/897571420.db2.gz DEINLSYMXILGCZ-IBGZPJMESA-N 2 0 421.614 4.376 20 0 HIADRP C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000482228745 897707137 /nfs/dbraw/zinc/70/71/37/897707137.db2.gz DMGRSJVGTLGNNS-AVRWGWEMSA-N 2 0 412.549 4.338 20 0 HIADRP CCc1nc(C)c([C@@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)s1 ZINC000482253097 897734797 /nfs/dbraw/zinc/73/47/97/897734797.db2.gz DMWBEYZLSHGXSA-QGZVFWFLSA-N 2 0 417.619 4.354 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc(F)cc1F ZINC000482255592 897736782 /nfs/dbraw/zinc/73/67/82/897736782.db2.gz APUPJBDLKMSUCM-QGZVFWFLSA-N 2 0 404.501 4.305 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)c(F)c1 ZINC000482271544 897757981 /nfs/dbraw/zinc/75/79/81/897757981.db2.gz TXHKTHMTVGFTLQ-GOSISDBHSA-N 2 0 416.537 4.175 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000482332055 897836925 /nfs/dbraw/zinc/83/69/25/897836925.db2.gz KYPKWDPKSNRNOJ-HZPDHXFCSA-N 2 0 402.410 4.012 20 0 HIADRP COc1ccc(Cc2nc(C)c([C@@H](C)[NH2+]CCC3CC[NH+](C)CC3)s2)cc1OC ZINC000482351688 897864703 /nfs/dbraw/zinc/86/47/03/897864703.db2.gz ZJAFRUKFWMNXQZ-MRXNPFEDSA-N 2 0 417.619 4.442 20 0 HIADRP CCC[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1 ZINC000482451583 898017554 /nfs/dbraw/zinc/01/75/54/898017554.db2.gz JUOPPBCDLAFRLH-OAQYLSRUSA-N 2 0 401.986 4.163 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000482455309 898024217 /nfs/dbraw/zinc/02/42/17/898024217.db2.gz XZPZRTAUHYHPOO-FPOVZHCZSA-N 2 0 406.574 4.186 20 0 HIADRP CC(C)Sc1ccc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3ncccn3)CC2)cc1 ZINC000482460535 898032635 /nfs/dbraw/zinc/03/26/35/898032635.db2.gz QCNGRQNJMUTSIV-FQEVSTJZSA-N 2 0 413.635 4.230 20 0 HIADRP C[C@H](C[NH2+][C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)CN1CC[NH+](C)CC1 ZINC000482462486 898036399 /nfs/dbraw/zinc/03/63/99/898036399.db2.gz KFVFVUVLOLYZPE-ZIAGYGMSSA-N 2 0 411.434 4.258 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2ccc(OCc3ccc(F)cc3)cc2)CC1 ZINC000482495909 898075961 /nfs/dbraw/zinc/07/59/61/898075961.db2.gz LHMCHKIPBWNLJM-RTWAWAEBSA-N 2 0 413.581 4.329 20 0 HIADRP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1ccc(-c2ccccc2Cl)s1 ZINC000482547656 898136774 /nfs/dbraw/zinc/13/67/74/898136774.db2.gz CMJSPWATHZERFB-HZPDHXFCSA-N 2 0 405.995 4.307 20 0 HIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)ccc1OC(F)F ZINC000482563722 898156155 /nfs/dbraw/zinc/15/61/55/898156155.db2.gz UHRKHXCFCIJKMJ-INIZCTEOSA-N 2 0 420.500 4.104 20 0 HIADRP CC(C)Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000482631110 898233602 /nfs/dbraw/zinc/23/36/02/898233602.db2.gz CORLDNJWBPDQHJ-CPJSRVTESA-N 2 0 407.602 4.433 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccc(-n2cncn2)cc1 ZINC000482634114 898237632 /nfs/dbraw/zinc/23/76/32/898237632.db2.gz UBMUPZREDKGWEA-SFHVURJKSA-N 2 0 409.965 4.484 20 0 HIADRP C[C@H]1C[C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c2ccsc2S1 ZINC000482652374 898255721 /nfs/dbraw/zinc/25/57/21/898255721.db2.gz RCCWFWWUXLWJMR-CVAIRZPRSA-N 2 0 415.628 4.161 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000482871259 898484844 /nfs/dbraw/zinc/48/48/44/898484844.db2.gz WXLYNKGEHOXTBG-LPHOPBHVSA-N 2 0 403.567 4.153 20 0 HIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000482953364 898581845 /nfs/dbraw/zinc/58/18/45/898581845.db2.gz WQIGWHMVEVWUNQ-NRFANRHFSA-N 2 0 421.651 4.168 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NC(C)(C)CC[NH+]2CCCCCC2)[C@H]1c1cccs1 ZINC000483105115 898797060 /nfs/dbraw/zinc/79/70/60/898797060.db2.gz XUZYDBBNOQTVCW-CTNGQTDRSA-N 2 0 420.667 4.475 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](N[C@H](C)c2ccc(F)cc2Br)[C@@H](C)C1 ZINC000483131793 898814068 /nfs/dbraw/zinc/81/40/68/898814068.db2.gz RKCVKLTYNOMVPP-KHYOSLBOSA-N 2 0 401.364 4.376 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)[C@H](C)C1 ZINC000483158053 898829949 /nfs/dbraw/zinc/82/99/49/898829949.db2.gz PRGVOYYZUFRRQH-XPGWFJOJSA-N 2 0 400.485 4.299 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)[C@@H](C)C1 ZINC000483158049 898830063 /nfs/dbraw/zinc/83/00/63/898830063.db2.gz PRGVOYYZUFRRQH-RYGJVYDSSA-N 2 0 400.485 4.299 20 0 HIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000483218597 898865020 /nfs/dbraw/zinc/86/50/20/898865020.db2.gz PXDZZDLKDOCJPL-CPJSRVTESA-N 2 0 412.549 4.209 20 0 HIADRP C[C@H](NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000483375835 899012443 /nfs/dbraw/zinc/01/24/43/899012443.db2.gz JACXYBOJKMLWCE-WIOPSUGQSA-N 2 0 419.613 4.316 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(C)[C@H]1CC[N@H+](CC)[C@@H](C)C1)c1ccccc1Cl ZINC000483521496 899183382 /nfs/dbraw/zinc/18/33/82/899183382.db2.gz YJCMXOYVCIDHTG-BBTUJRGHSA-N 2 0 409.018 4.237 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccccc3Br)CC2)[C@H](C)C1 ZINC000484138683 899759602 /nfs/dbraw/zinc/75/96/02/899759602.db2.gz FEENLGLGEIOTJI-XLIONFOSSA-N 2 0 409.412 4.207 20 0 HIADRP CC(C)Sc1ccc([C@H](C)[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)cc1 ZINC000484308302 899867797 /nfs/dbraw/zinc/86/77/97/899867797.db2.gz ZTRBXWBNDAVRLM-SFHVURJKSA-N 2 0 405.652 4.464 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000484487186 899979942 /nfs/dbraw/zinc/97/99/42/899979942.db2.gz MFZUWLHVTICTOM-QHCPKHFHSA-N 2 0 403.973 4.379 20 0 HIADRP CC(C)[NH+]1CCC([N@H+](C)CCC(=O)Nc2ccc(OCc3ccccc3)cc2)CC1 ZINC000485103028 900411145 /nfs/dbraw/zinc/41/11/45/900411145.db2.gz HMRZJFUKNVRMBW-UHFFFAOYSA-N 2 0 409.574 4.399 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1 ZINC000485295311 900573372 /nfs/dbraw/zinc/57/33/72/900573372.db2.gz PFYYHORMVAXLCZ-ILBGXUMGSA-N 2 0 420.601 4.041 20 0 HIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCC(=O)Nc2ccc(OCc3ccccc3)cc2)[C@@H](C)C1 ZINC000485678179 900930237 /nfs/dbraw/zinc/93/02/37/900930237.db2.gz INBOEFQCGHHXFR-GBXCKJPGSA-N 2 0 409.574 4.256 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2cc(F)cc(Cl)c2)c1)C1CCOCC1 ZINC000485708338 900957400 /nfs/dbraw/zinc/95/74/00/900957400.db2.gz HFLFVVMJGBSUJD-UHFFFAOYSA-N 2 0 406.929 4.259 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCC(c2ccsc2)CC1 ZINC000485984951 901203277 /nfs/dbraw/zinc/20/32/77/901203277.db2.gz AXTDWJCSPWJEBI-LJQANCHMSA-N 2 0 411.615 4.097 20 0 HIADRP C[C@H](NC(=O)N[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000486325039 901501862 /nfs/dbraw/zinc/50/18/62/901501862.db2.gz UEKYQQVXTWGDIO-KXTAGPOFSA-N 2 0 420.601 4.032 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1 ZINC000505931076 914582708 /nfs/dbraw/zinc/58/27/08/914582708.db2.gz WERUGXSTAQEVCS-VXKWHMMOSA-N 2 0 415.622 4.134 20 0 HIADRP C[C@@H](CCSc1ccccc1)[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000487788189 902365121 /nfs/dbraw/zinc/36/51/21/902365121.db2.gz GVVKEXJMQHHJAR-NRFANRHFSA-N 2 0 417.663 4.262 20 0 HIADRP O=C([C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000487870174 902416831 /nfs/dbraw/zinc/41/68/31/902416831.db2.gz FKGQLPKVTMDROC-XZOQPEGZSA-N 2 0 415.597 4.152 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CC[NH+](C2CCC2)C[C@@H](C)C1 ZINC000488139333 902635485 /nfs/dbraw/zinc/63/54/85/902635485.db2.gz YKXUQGALLDBWIR-NHCUHLMSSA-N 2 0 412.622 4.077 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](CC(=O)N(C)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000488297708 902758736 /nfs/dbraw/zinc/75/87/36/902758736.db2.gz VANOOJGXUZXHQA-UHFFFAOYSA-N 2 0 400.394 4.006 20 0 HIADRP COc1ccccc1-c1nc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)cs1 ZINC000506011597 914686823 /nfs/dbraw/zinc/68/68/23/914686823.db2.gz CBXYIQFUZWQZOY-UHFFFAOYSA-N 2 0 415.603 4.143 20 0 HIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)CCCO2 ZINC000489484156 903413048 /nfs/dbraw/zinc/41/30/48/903413048.db2.gz QAIMZJKGFLKYIA-JOCHJYFZSA-N 2 0 415.622 4.240 20 0 HIADRP CCOc1ccc(-c2nc(C[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)co2)cc1 ZINC000506031553 914715725 /nfs/dbraw/zinc/71/57/25/914715725.db2.gz MFDUAFXVXRSBIK-UHFFFAOYSA-N 2 0 413.562 4.065 20 0 HIADRP COc1ccccc1[C@@H](C)N(C)C(=O)C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000489635645 903509573 /nfs/dbraw/zinc/50/95/73/903509573.db2.gz QHOSNAIKGBVPLC-OAQYLSRUSA-N 2 0 423.601 4.059 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000489852096 903630429 /nfs/dbraw/zinc/63/04/29/903630429.db2.gz XKXUJBPEEICASA-BWKNWUBXSA-N 2 0 422.617 4.190 20 0 HIADRP COc1ccc([C@H]([NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)c2ccc(F)cc2)cc1 ZINC000490119829 903777050 /nfs/dbraw/zinc/77/70/50/903777050.db2.gz QIVAAJAQQOVQEM-KHCICDEESA-N 2 0 400.538 4.403 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000490167741 903806482 /nfs/dbraw/zinc/80/64/82/903806482.db2.gz NAOZKVNSTMZRAU-FDDCHVKYSA-N 2 0 401.982 4.054 20 0 HIADRP C[NH+](C)CCNC(=O)C1CC[NH+](Cc2c(Cl)cccc2Oc2ccccc2)CC1 ZINC000491116023 904438940 /nfs/dbraw/zinc/43/89/40/904438940.db2.gz TUMPWAABJFNVBV-UHFFFAOYSA-N 2 0 415.965 4.022 20 0 HIADRP C[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CC1 ZINC000491356316 904553341 /nfs/dbraw/zinc/55/33/41/904553341.db2.gz LOYJACKRKKXLGN-NRFANRHFSA-N 2 0 423.935 4.258 20 0 HIADRP CC[NH+]1CCC(CC[NH2+][C@H](c2ccc(C)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000493276403 905073086 /nfs/dbraw/zinc/07/30/86/905073086.db2.gz JFRCZFFFLAGYAS-XMMPIXPASA-N 2 0 414.615 4.200 20 0 HIADRP COc1cc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1OCc1ccncc1 ZINC000512388710 921124701 /nfs/dbraw/zinc/12/47/01/921124701.db2.gz YCNFMKPYSJLNLX-KNQAVFIVSA-N 2 0 409.574 4.412 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000512407299 921141197 /nfs/dbraw/zinc/14/11/97/921141197.db2.gz VGTMIAPMTBMSRN-ZJSXRUAMSA-N 2 0 414.638 4.051 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)[C@H](C)C1 ZINC000495186286 906296462 /nfs/dbraw/zinc/29/64/62/906296462.db2.gz WNQQWNNALSDDCR-WWMYMODYSA-N 2 0 414.421 4.299 20 0 HIADRP C[C@H]1C[C@@H](CCNC(=O)c2cccc(C[NH+]3CCCC3)c2)C[N@@H+]1Cc1ccccc1 ZINC000512575415 921246080 /nfs/dbraw/zinc/24/60/80/921246080.db2.gz ZCMLWFSSVFJHJP-XUZZJYLKSA-N 2 0 405.586 4.313 20 0 HIADRP O=C1CCCN1Cc1cccc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000512636729 921269477 /nfs/dbraw/zinc/26/94/77/921269477.db2.gz NNOWVLVZXVVSJX-KKUQBAQOSA-N 2 0 417.597 4.199 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)NC[C@@H](C)c1ccccc1 ZINC000497297237 906829005 /nfs/dbraw/zinc/82/90/05/906829005.db2.gz UTEYXTVUXBGJMS-FGZHOGPDSA-N 2 0 407.602 4.461 20 0 HIADRP c1cn(Cc2cccc(C[NH2+][C@@H]3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)c2)cn1 ZINC000512643111 921271369 /nfs/dbraw/zinc/27/13/69/921271369.db2.gz VRZGCOQPMLOVNB-KKUQBAQOSA-N 2 0 400.570 4.322 20 0 HIADRP C[C@@H](C[NH2+][C@@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1)N1CC[NH+](C)CC1 ZINC000512668576 921281656 /nfs/dbraw/zinc/28/16/56/921281656.db2.gz VUMIKXOAXNWHID-HRAATJIYSA-N 2 0 409.471 4.159 20 0 HIADRP CC[C@@H](c1ccc(Br)cc1)N1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000497491683 906975214 /nfs/dbraw/zinc/97/52/14/906975214.db2.gz GFCQCDHLMAJYLL-JKWVGCSGSA-N 2 0 406.412 4.143 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCNC(=O)NCc1ccccc1C[NH+]1CCCCCC1 ZINC000497717544 907219401 /nfs/dbraw/zinc/21/94/01/907219401.db2.gz RMWLDAXFDFNCOV-OAQYLSRUSA-N 2 0 400.611 4.126 20 0 HIADRP CCS[C@H]1CCCC[NH+](CC2(C[N@H+]3CCCC[C@H](SCC)C3)COC2)C1 ZINC000497849238 907328565 /nfs/dbraw/zinc/32/85/65/907328565.db2.gz WJRTZGPUBHOZEM-PMACEKPBSA-N 2 0 400.698 4.218 20 0 HIADRP CC[NH+](CC)CCOc1ccc(NC(=O)N[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000512842720 921345234 /nfs/dbraw/zinc/34/52/34/921345234.db2.gz ASQOGSYOOFDKNT-VQTJNVASSA-N 2 0 416.610 4.182 20 0 HIADRP CCC[C@H]([NH2+]C(C)C)C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000498377841 907866784 /nfs/dbraw/zinc/86/67/84/907866784.db2.gz OFJZBDIASXYSCO-HOJAQTOUSA-N 2 0 413.528 4.371 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)N[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)C[C@@H]1C ZINC000498671867 908102231 /nfs/dbraw/zinc/10/22/31/908102231.db2.gz PFPYWQBTBWIEST-FBRLZHCOSA-N 2 0 422.564 4.003 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccco1 ZINC000498901002 908308978 /nfs/dbraw/zinc/30/89/78/908308978.db2.gz LALMKWKTABNGDC-SEIRJHJZSA-N 2 0 412.578 4.061 20 0 HIADRP Cc1nc(CN2CCC(C[NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)CC2)oc1C ZINC000499151790 908510737 /nfs/dbraw/zinc/51/07/37/908510737.db2.gz ZGMVUABFUURRCI-QEIWAGNOSA-N 2 0 422.617 4.289 20 0 HIADRP O=C(NC1CCCCC1)N1CCC([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499219090 908575670 /nfs/dbraw/zinc/57/56/70/908575670.db2.gz OILJHTFXYZCWHG-QEIWAGNOSA-N 2 0 424.633 4.278 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2cccc(OCc3ccc(F)cc3)c2)CC1 ZINC000499686718 908877366 /nfs/dbraw/zinc/87/73/66/908877366.db2.gz VAAJVFNOOSKOBI-LOSJGSFVSA-N 2 0 412.549 4.262 20 0 HIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000500442242 909860857 /nfs/dbraw/zinc/86/08/57/909860857.db2.gz SMOGZBNAXQCMAF-ZIBIDDQLSA-N 2 0 404.476 4.465 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NCC1([NH2+][C@H](C)c2ccccc2)CCOCC1)c1ccccc1 ZINC000500495171 909890556 /nfs/dbraw/zinc/89/05/56/909890556.db2.gz UORZLLRQAUWDEY-ZJSXRUAMSA-N 2 0 423.601 4.086 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)NCc3cccc(C[NH+](C)C)c3)cc2)C1 ZINC000500694084 910026021 /nfs/dbraw/zinc/02/60/21/910026021.db2.gz GINMCOZCNVXCKJ-NHCUHLMSSA-N 2 0 422.617 4.226 20 0 HIADRP Brc1cccc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c1 ZINC000513098638 921547613 /nfs/dbraw/zinc/54/76/13/921547613.db2.gz JSMFFHRXPUNKJH-UHFFFAOYSA-N 2 0 402.380 4.141 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)N2CCC(CCC[NH+](C)C)CC2)CC1 ZINC000500818637 910100105 /nfs/dbraw/zinc/10/01/05/910100105.db2.gz QTZZKDBVMAXEKT-UHFFFAOYSA-N 2 0 414.638 4.182 20 0 HIADRP C[C@@H](C(=O)Nc1cccc2ccccc21)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501022793 910241222 /nfs/dbraw/zinc/24/12/22/910241222.db2.gz JCPWDSJVGBVLRE-IBGZPJMESA-N 2 0 402.542 4.410 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000501049277 910258703 /nfs/dbraw/zinc/25/87/03/910258703.db2.gz ASFQRPFYHVQPMW-KNQAVFIVSA-N 2 0 421.029 4.288 20 0 HIADRP C[N@@H+](Cc1cn2cc(Cl)cc(Cl)c2n1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501061644 910271208 /nfs/dbraw/zinc/27/12/08/910271208.db2.gz GLIWZWAXCQBQHU-UHFFFAOYSA-N 2 0 404.345 4.385 20 0 HIADRP COc1ccc(Br)cc1[C@@H]1CCC[N@@H+]1CCCN1CC[NH+](C(C)C)CC1 ZINC000501112007 910299803 /nfs/dbraw/zinc/29/98/03/910299803.db2.gz XPACWLPDZHAWLM-FQEVSTJZSA-N 2 0 424.427 4.011 20 0 HIADRP CSc1ccccc1[C@@H](C)[NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000501536139 910644048 /nfs/dbraw/zinc/64/40/48/910644048.db2.gz OUOKFYZONIYTPJ-QGZVFWFLSA-N 2 0 415.628 4.247 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)c3ccc(C[NH+]4CCSCC4)cc3)CC2)CC1 ZINC000502242258 911195761 /nfs/dbraw/zinc/19/57/61/911195761.db2.gz QAXWCDDXUKSXOF-UHFFFAOYSA-N 2 0 415.647 4.008 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1)C1CC[NH+](C)CC1 ZINC000502331647 911311698 /nfs/dbraw/zinc/31/16/98/911311698.db2.gz JHDMDRFZTQBCTO-JOCHJYFZSA-N 2 0 421.633 4.129 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)Nc2ccccc2NC2CC[NH+](C)CC2)cc1 ZINC000502611495 911634336 /nfs/dbraw/zinc/63/43/36/911634336.db2.gz BWLAXAZNDYNRTK-UHFFFAOYSA-N 2 0 424.589 4.166 20 0 HIADRP C[NH+]1CCC(Nc2ccccc2NC(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000502624075 911653126 /nfs/dbraw/zinc/65/31/26/911653126.db2.gz UQVCFSFVEVULGJ-NRFANRHFSA-N 2 0 406.574 4.043 20 0 HIADRP CCC[NH+]1CCC(CNC(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)CC1 ZINC000502813058 911829669 /nfs/dbraw/zinc/82/96/69/911829669.db2.gz NDNXCVRZYCHASN-HXUWFJFHSA-N 2 0 400.611 4.071 20 0 HIADRP Cc1cc(NC(=O)CCCCCC(=O)Nc2cc(C)c3nccn3c2)cn2ccnc12 ZINC000502815999 911831044 /nfs/dbraw/zinc/83/10/44/911831044.db2.gz RCEQVVVLQUPCGV-UHFFFAOYSA-N 2 0 418.501 4.127 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)CC1 ZINC000502850211 911859125 /nfs/dbraw/zinc/85/91/25/911859125.db2.gz OVBZDBSERBSBHV-HXUWFJFHSA-N 2 0 400.611 4.214 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)CC(C)C ZINC000502927813 911913754 /nfs/dbraw/zinc/91/37/54/911913754.db2.gz FHMMJNGAJZEGFQ-QHCPKHFHSA-N 2 0 402.627 4.049 20 0 HIADRP C[C@@H]1CC[N@H+](C)CCN1C(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000502930646 911917797 /nfs/dbraw/zinc/91/77/97/911917797.db2.gz RHGGPRZRWTXVBD-OAQYLSRUSA-N 2 0 420.601 4.185 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1)c1ccccc1 ZINC000502930803 911917922 /nfs/dbraw/zinc/91/79/22/911917922.db2.gz AAKMYRXODUFHAA-NFBKMPQASA-N 2 0 408.590 4.252 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccccc1 ZINC000502974010 911955299 /nfs/dbraw/zinc/95/52/99/911955299.db2.gz ZNGCCFBZYZIWQM-NJDAHSKKSA-N 2 0 402.627 4.173 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1)c1ccccc1 ZINC000503151199 912115868 /nfs/dbraw/zinc/11/58/68/912115868.db2.gz JUXYCNQZSGDCRH-ICSRJNTNSA-N 2 0 414.619 4.314 20 0 HIADRP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000506321850 914923282 /nfs/dbraw/zinc/92/32/82/914923282.db2.gz OABOHGCPTBXTDO-UHFFFAOYSA-N 2 0 404.643 4.081 20 0 HIADRP COc1ccccc1[C@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)[NH+]1CCCCC1 ZINC000513372811 921745360 /nfs/dbraw/zinc/74/53/60/921745360.db2.gz VSETXVIIKWZPPY-DEOSSOPVSA-N 2 0 421.585 4.248 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1)c1ccsc1 ZINC000506928241 915730882 /nfs/dbraw/zinc/73/08/82/915730882.db2.gz AMEKTLWSZOMZET-RZUBCFFCSA-N 2 0 420.667 4.427 20 0 HIADRP Cc1cccc([C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C(=O)N2CCC[C@H]([NH+](C)C)CC2)c1 ZINC000507391875 916154609 /nfs/dbraw/zinc/15/46/09/916154609.db2.gz XPWWPGSADBIAJI-NXCFDTQHSA-N 2 0 419.613 4.153 20 0 HIADRP FC(F)n1c2ccccc2nc1CC[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000507469395 916239039 /nfs/dbraw/zinc/23/90/39/916239039.db2.gz KAIRUQKKFFUBEF-SLFFLAALSA-N 2 0 410.512 4.474 20 0 HIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCc4nnc(-c5ccc(F)cc5)n4C3)CC2)C1 ZINC000507604848 916360544 /nfs/dbraw/zinc/36/05/44/916360544.db2.gz IVLCEXFRDKHGMF-ZPMCFJSWSA-N 2 0 411.569 4.032 20 0 HIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)CC1 ZINC000507625653 916384538 /nfs/dbraw/zinc/38/45/38/916384538.db2.gz PJQYJFSIIMXXDK-ZPMCFJSWSA-N 2 0 411.569 4.032 20 0 HIADRP Cc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(OC[C@H]2CCOC2)c1 ZINC000508691542 917454777 /nfs/dbraw/zinc/45/47/77/917454777.db2.gz NKODDSQVNLZTFF-VTZPFEBOSA-N 2 0 408.586 4.411 20 0 HIADRP CCc1noc(-c2ccc(CC[NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)cc2)n1 ZINC000508715666 917477146 /nfs/dbraw/zinc/47/71/46/917477146.db2.gz DVOKSQKVIVZJQP-CVDCTZTESA-N 2 0 404.558 4.342 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@H](C)[C@H](c2ccccc2C)[NH+](C)C)CC1 ZINC000508856853 917609881 /nfs/dbraw/zinc/60/98/81/917609881.db2.gz WPMSKCJZKHLNQS-NFBKMPQASA-N 2 0 402.627 4.140 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2ccc(-c3ccccc3Br)cc2)CC1 ZINC000509533820 918183784 /nfs/dbraw/zinc/18/37/84/918183784.db2.gz UNMVSVXZYHKNAV-SFHVURJKSA-N 2 0 416.407 4.232 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]Cc2ccc3c(c2)NC(=O)CO3)cc1 ZINC000509834732 918435821 /nfs/dbraw/zinc/43/58/21/918435821.db2.gz WJZOYODWYIBGMN-UHFFFAOYSA-N 2 0 401.510 4.036 20 0 HIADRP CC[C@H](CNC(=O)c1oc2ccccc2c1C[NH+](C)C)[N@@H+]1CCc2ccccc2C1 ZINC000510305083 918820069 /nfs/dbraw/zinc/82/00/69/918820069.db2.gz FCRVXDXMEJLGKT-HXUWFJFHSA-N 2 0 405.542 4.061 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)N(C)C1CC[NH+](C(C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000510376244 918861777 /nfs/dbraw/zinc/86/17/77/918861777.db2.gz ICWWDKMKBVRKDQ-HXUWFJFHSA-N 2 0 413.528 4.420 20 0 HIADRP C[C@@H]1C[C@@H](CCNC(=O)Nc2cccc(OCC[NH+](C)C)c2)C[N@@H+]1Cc1ccccc1 ZINC000510658539 919099723 /nfs/dbraw/zinc/09/97/23/919099723.db2.gz UNKHRDQJDCYPLV-IFMALSPDSA-N 2 0 424.589 4.049 20 0 HIADRP O=C(Nc1ccccc1)N1CC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000511030416 919607727 /nfs/dbraw/zinc/60/77/27/919607727.db2.gz LGYAWUNXQBXKNG-JLLPCOHGSA-N 2 0 404.558 4.078 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)c1cccc(C[N@H+](C)Cc2ccccc2)c1)c1cccs1 ZINC000511064348 919662032 /nfs/dbraw/zinc/66/20/32/919662032.db2.gz NZHRHMGDMCSTCQ-JOCHJYFZSA-N 2 0 407.583 4.413 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000511159841 919779711 /nfs/dbraw/zinc/77/97/11/919779711.db2.gz IWVRAMGQRQCDPM-UHFFFAOYSA-N 2 0 419.613 4.447 20 0 HIADRP C[C@@H](NC(=O)NCC(C)(C)[NH2+][C@@H](C)c1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511265005 919862640 /nfs/dbraw/zinc/86/26/40/919862640.db2.gz JGCLCGBEKFZPDO-SVFBPWRDSA-N 2 0 400.611 4.068 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000511939886 920691971 /nfs/dbraw/zinc/69/19/71/920691971.db2.gz QPLJNUUDHWZQLR-CYBMUJFWSA-N 2 0 405.892 4.397 20 0 HIADRP O=C(NC[C@@H]1CCCC[N@@H+]1Cc1ccccc1)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000511962922 920727440 /nfs/dbraw/zinc/72/74/40/920727440.db2.gz YRNCKLDIQSAQSE-DEOSSOPVSA-N 2 0 423.626 4.020 20 0 HIADRP FC(F)(F)c1ccc(-n2cc(C[NH2+]CC3CCN(c4cc[nH+]cc4)CC3)cn2)cc1 ZINC000511987599 920757324 /nfs/dbraw/zinc/75/73/24/920757324.db2.gz GUMURUUAGIDNTN-UHFFFAOYSA-N 2 0 415.463 4.292 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)CC1(C)C ZINC000512124412 920875570 /nfs/dbraw/zinc/87/55/70/920875570.db2.gz ULHHRZCVVGRXFA-GGAORHGYSA-N 2 0 414.638 4.241 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]C/C=C\c2ccc(F)c(F)c2)c1)C1CCOCC1 ZINC000512127336 920876351 /nfs/dbraw/zinc/87/63/51/920876351.db2.gz BKFKZPVZGZLFEW-HYXAFXHYSA-N 2 0 416.512 4.257 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3cc(C)c(Br)s3)cn2)CC1 ZINC000512130491 920879036 /nfs/dbraw/zinc/87/90/36/920879036.db2.gz LVACEXKYYLZAFZ-OAHLLOKOSA-N 2 0 423.424 4.207 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000512132465 920880458 /nfs/dbraw/zinc/88/04/58/920880458.db2.gz SCMKJTCGFBUVGB-YUELXQCFSA-N 2 0 403.876 4.292 20 0 HIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)sc1Br ZINC000512135807 920882780 /nfs/dbraw/zinc/88/27/80/920882780.db2.gz OXLZGGAQFCEVHC-INIZCTEOSA-N 2 0 422.436 4.417 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512327248 921077655 /nfs/dbraw/zinc/07/76/55/921077655.db2.gz CSOQJPAZSKEBBC-CEXWTWQISA-N 2 0 406.014 4.320 20 0 HIADRP Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513495272 921845432 /nfs/dbraw/zinc/84/54/32/921845432.db2.gz NMTZSMCJFWAREQ-QFBILLFUSA-N 2 0 424.511 4.060 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@@H](Cc2ccccn2)c2cccnc2)C[C@@H](C)O1 ZINC000513498531 921848627 /nfs/dbraw/zinc/84/86/27/921848627.db2.gz AMTIQPGAEIPMCR-YPCDYVTLSA-N 2 0 416.569 4.159 20 0 HIADRP C/C(=C/c1ccc(Cl)cc1)C[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000513545340 921883347 /nfs/dbraw/zinc/88/33/47/921883347.db2.gz PTDLBKYSKGYGJO-VWOYCULZSA-N 2 0 411.977 4.230 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2csc(Br)c2)C[C@H](C)O1 ZINC000513587811 921919947 /nfs/dbraw/zinc/91/99/47/921919947.db2.gz BDXBUJRLPSNQIZ-GJZGRUSLSA-N 2 0 409.393 4.410 20 0 HIADRP CCOc1cc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc(Cl)c1O ZINC000513612920 921943008 /nfs/dbraw/zinc/94/30/08/921943008.db2.gz KEPYGRUFPKIQNW-CALCHBBNSA-N 2 0 418.965 4.343 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCS(=O)(=O)c2ccc(Cl)cc2)CC1 ZINC000513692043 922012199 /nfs/dbraw/zinc/01/21/99/922012199.db2.gz XWSBYQPJFQGSRV-UHFFFAOYSA-N 2 0 421.006 4.147 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c(C)c1OC ZINC000513713162 922032489 /nfs/dbraw/zinc/03/24/89/922032489.db2.gz LHRARWUVJCSWQS-OAQYLSRUSA-N 2 0 411.590 4.265 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)c1 ZINC000513783636 922108997 /nfs/dbraw/zinc/10/89/97/922108997.db2.gz BWXBUKJKFLWAOG-HSZRJFAPSA-N 2 0 421.585 4.294 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000513915816 922238656 /nfs/dbraw/zinc/23/86/56/922238656.db2.gz XRHHCNIMHDZPOF-DEOSSOPVSA-N 2 0 405.586 4.313 20 0 HIADRP C[NH+](C)Cc1cccc(C(=O)N[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2c2ccccc2)c1 ZINC000513940415 922259449 /nfs/dbraw/zinc/25/94/49/922259449.db2.gz PGGQZFOEPZHBHA-IZZNHLLZSA-N 2 0 413.565 4.146 20 0 HIADRP CCC1(CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000513986626 922308776 /nfs/dbraw/zinc/30/87/76/922308776.db2.gz BSXRCZWOKIFANU-UHFFFAOYSA-N 2 0 414.638 4.241 20 0 HIADRP O=C(c1ccccc1)N1CC[C@H](C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000514082098 922406074 /nfs/dbraw/zinc/40/60/74/922406074.db2.gz FPWWWKSLONUVEW-LGPLSSKUSA-N 2 0 417.597 4.135 20 0 HIADRP C[C@@H]1CCCC[NH+]1C[C@@H]1CCCN(CCN2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)C1 ZINC000514111678 922442259 /nfs/dbraw/zinc/44/22/59/922442259.db2.gz AQIDVMZHNHUORA-VEYUFSJPSA-N 2 0 418.714 4.159 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)NC[C@@H](c2cccs2)[NH+]2CCC(C)CC2)CC1 ZINC000514197091 922535243 /nfs/dbraw/zinc/53/52/43/922535243.db2.gz ITWKCOGLSZADHL-FQEVSTJZSA-N 2 0 406.640 4.085 20 0 HIADRP CC(C)(C)c1nn(-c2ccccc2)cc1C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000514233622 922570881 /nfs/dbraw/zinc/57/08/81/922570881.db2.gz CKHITTDGMZDIDB-DEOSSOPVSA-N 2 0 418.585 4.026 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1CC[NH+](CC2CCCC2)CC1)c1ccsc1 ZINC000514244463 922586124 /nfs/dbraw/zinc/58/61/24/922586124.db2.gz IRPMORWMPRMKKS-OAQYLSRUSA-N 2 0 406.640 4.085 20 0 HIADRP CCC1(CC)[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C[C@@H]1OC ZINC000515316306 923045668 /nfs/dbraw/zinc/04/56/68/923045668.db2.gz UVJIPWHYELDQLE-ZRBLBEILSA-N 2 0 400.607 4.099 20 0 HIADRP Cc1ccccc1CCNC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000515518811 923149350 /nfs/dbraw/zinc/14/93/50/923149350.db2.gz OIUOWHQOHVPDHF-YADHBBJMSA-N 2 0 407.602 4.206 20 0 HIADRP COc1ccc(NC(=O)[C@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000515523507 923152884 /nfs/dbraw/zinc/15/28/84/923152884.db2.gz QNQDPUVNNRUFIC-ZCNNSNEGSA-N 2 0 409.574 4.290 20 0 HIADRP C[NH+](C)CCC1CC[NH+](CC(=O)N(Cc2ccc(F)cc2)C2CCCCC2)CC1 ZINC000515776628 923344244 /nfs/dbraw/zinc/34/42/44/923344244.db2.gz HLEWKRGIJMZFMI-UHFFFAOYSA-N 2 0 403.586 4.151 20 0 HIADRP O[C@H](C[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)COCc1ccccc1Cl ZINC000516709657 923857384 /nfs/dbraw/zinc/85/73/84/923857384.db2.gz NPFWILIUCAEBIQ-JTHBVZDNSA-N 2 0 416.993 4.109 20 0 HIADRP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000516765770 923882321 /nfs/dbraw/zinc/88/23/21/923882321.db2.gz QKBBTWADVRTMNX-CTNGQTDRSA-N 2 0 415.578 4.053 20 0 HIADRP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000517140145 924021926 /nfs/dbraw/zinc/02/19/26/924021926.db2.gz DMCZIGUQUCJADN-BDTNDASRSA-N 2 0 414.638 4.084 20 0 HIADRP O=C(NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000518631548 927391599 /nfs/dbraw/zinc/39/15/99/927391599.db2.gz CWXUOXXBIMHCLM-UGKGYDQZSA-N 2 0 419.013 4.137 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(=O)N(C)Cc1cccc(F)c1 ZINC000518842292 927542430 /nfs/dbraw/zinc/54/24/30/927542430.db2.gz QJOWXLSWFCEGSU-VQTJNVASSA-N 2 0 411.565 4.337 20 0 HIADRP Fc1cncc([C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C2CC2)c1 ZINC000519192131 927819413 /nfs/dbraw/zinc/81/94/13/927819413.db2.gz ARQICTZXQUPAAP-LADGPHEKSA-N 2 0 409.549 4.190 20 0 HIADRP C[NH+](C)Cc1ccc(CNC(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)cc1 ZINC000519935831 928170227 /nfs/dbraw/zinc/17/02/27/928170227.db2.gz CWWHPDISCTYNRV-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP CCOc1c(Br)cc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1OC ZINC000520205251 928387713 /nfs/dbraw/zinc/38/77/13/928387713.db2.gz DZCBNFHQCCRVGQ-INIZCTEOSA-N 2 0 413.400 4.458 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 ZINC000521430342 929218269 /nfs/dbraw/zinc/21/82/69/929218269.db2.gz ZEHJHTWVLCFUFL-MRXNPFEDSA-N 2 0 415.500 4.356 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000525402059 930221016 /nfs/dbraw/zinc/22/10/16/930221016.db2.gz SJZNFFXHVQCUID-JOCHJYFZSA-N 2 0 422.617 4.334 20 0 HIADRP CCc1ccc(-c2ccc(C[NH2+]Cc3ccc(C(=O)NCC[NH+](C)C)cc3)o2)cc1 ZINC000525802693 930449508 /nfs/dbraw/zinc/44/95/08/930449508.db2.gz OJJMIQICQRPJPI-UHFFFAOYSA-N 2 0 405.542 4.090 20 0 HIADRP Cc1ccc(NC(=O)NC[C@@H](c2ccc(Cl)cc2)[NH+](C)C)c(OCC[NH+](C)C)c1 ZINC000530845262 930839614 /nfs/dbraw/zinc/83/96/14/930839614.db2.gz GTVOJVSRHPPKSY-FQEVSTJZSA-N 2 0 418.969 4.013 20 0 HIADRP O=C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCCC[NH+]1Cc1ccccc1 ZINC000531057353 930899795 /nfs/dbraw/zinc/89/97/95/930899795.db2.gz RMSINVSXIXDSDV-SBZWWDHJSA-N 2 0 417.597 4.353 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C(=O)Nc3ccc(C[NH+]4CCCCCC4)cc3)cc2)CC1 ZINC000531290648 931004166 /nfs/dbraw/zinc/00/41/66/931004166.db2.gz KIHWNINYVDLYAD-UHFFFAOYSA-N 2 0 420.601 4.062 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)CC1 ZINC000531442158 931057540 /nfs/dbraw/zinc/05/75/40/931057540.db2.gz MSSAQRMZSHFQKA-OAQYLSRUSA-N 2 0 420.601 4.386 20 0 HIADRP CC[C@H](C)NC(=O)c1cccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000531598060 931116895 /nfs/dbraw/zinc/11/68/95/931116895.db2.gz YHWBVCZJRAAPLA-FQEVSTJZSA-N 2 0 422.617 4.035 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531682250 931150666 /nfs/dbraw/zinc/15/06/66/931150666.db2.gz XVFJVRWSPOIUKD-RBUKOAKNSA-N 2 0 400.588 4.173 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000531692057 931156364 /nfs/dbraw/zinc/15/63/64/931156364.db2.gz DCLLEGAQCKYGLA-KRWDZBQOSA-N 2 0 410.400 4.268 20 0 HIADRP CC[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000531710472 931168971 /nfs/dbraw/zinc/16/89/71/931168971.db2.gz OEELYYAOIXBRIG-FCHUYYIVSA-N 2 0 403.517 4.317 20 0 HIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000531723813 931174247 /nfs/dbraw/zinc/17/42/47/931174247.db2.gz HXYCUSMOONIOBC-PGRDOPGGSA-N 2 0 406.014 4.435 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000531737591 931178936 /nfs/dbraw/zinc/17/89/36/931178936.db2.gz BLUCAPLGGCKUHL-HNNXBMFYSA-N 2 0 408.384 4.163 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2cnc(C3CCC3)s2)CC1 ZINC000531866655 931228395 /nfs/dbraw/zinc/22/83/95/931228395.db2.gz XDSFUFQETXPZBI-UHFFFAOYSA-N 2 0 424.536 4.471 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000531936222 931252918 /nfs/dbraw/zinc/25/29/18/931252918.db2.gz YBRZRRDEQUQSKS-DLBZAZTESA-N 2 0 410.400 4.268 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc(NC(=O)[C@@H](C)CC)c2)CC1 ZINC000532042574 931295355 /nfs/dbraw/zinc/29/53/55/931295355.db2.gz ZCYUGWFFFBUKQU-NRFANRHFSA-N 2 0 422.617 4.493 20 0 HIADRP CN(c1ccccc1C[NH2+][C@H]1CCCN(c2cccc(F)c2)C1)C1CC[NH+](C)CC1 ZINC000532105106 931313356 /nfs/dbraw/zinc/31/33/56/931313356.db2.gz XVZISYUJBRVBKA-QFIPXVFZSA-N 2 0 410.581 4.115 20 0 HIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)ccc1SC ZINC000532214895 931355841 /nfs/dbraw/zinc/35/58/41/931355841.db2.gz YSOWUGINKOYIQG-KRWDZBQOSA-N 2 0 400.588 4.225 20 0 HIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 ZINC000532215464 931357329 /nfs/dbraw/zinc/35/73/29/931357329.db2.gz RJAJDRIQRSRDNA-OAHLLOKOSA-N 2 0 401.473 4.014 20 0 HIADRP CCCOc1ccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1OC ZINC000532361660 931409577 /nfs/dbraw/zinc/40/95/77/931409577.db2.gz JJSXQENXVXYVKB-UHFFFAOYSA-N 2 0 411.590 4.304 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000532460766 931444558 /nfs/dbraw/zinc/44/45/58/931444558.db2.gz BQBSDIMMEXNMTJ-ZDUSSCGKSA-N 2 0 401.473 4.201 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(NC(=O)c2ccco2)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000532471796 931450669 /nfs/dbraw/zinc/45/06/69/931450669.db2.gz CLSMCPWPXGRKCR-SFHVURJKSA-N 2 0 407.514 4.323 20 0 HIADRP COc1ccc([C@H](C)[NH2+][C@@H](CN2CC[NH+](C)CC2)c2ccccc2)c2ccccc12 ZINC000532498290 931462735 /nfs/dbraw/zinc/46/27/35/931462735.db2.gz XRFPSMLXWIIRAG-CPJSRVTESA-N 2 0 403.570 4.488 20 0 HIADRP COc1ccc([C@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)c2ccccc12 ZINC000532498291 931463160 /nfs/dbraw/zinc/46/31/60/931463160.db2.gz XRFPSMLXWIIRAG-NBGIEHNGSA-N 2 0 403.570 4.488 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccnc2)C1 ZINC000532566721 931527879 /nfs/dbraw/zinc/52/78/79/931527879.db2.gz TZOIRPIHQSZDFO-NRFANRHFSA-N 2 0 403.574 4.392 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 ZINC000532804907 931634607 /nfs/dbraw/zinc/63/46/07/931634607.db2.gz JBWPVSADJMDWHR-AWEZNQCLSA-N 2 0 413.418 4.233 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2(CC)CC[NH+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC000532814238 931637020 /nfs/dbraw/zinc/63/70/20/931637020.db2.gz VIXKAZJEYRTIFN-GGAORHGYSA-N 2 0 414.638 4.051 20 0 HIADRP C(CC[NH+]1CCC[C@H]1CN1CCCCC1)CC[N@@H+]1CCC[C@H]1CN1CCCCC1 ZINC000532954957 931710449 /nfs/dbraw/zinc/71/04/49/931710449.db2.gz HBXOVYYFJMCVMH-DQEYMECFSA-N 2 0 404.687 4.057 20 0 HIADRP C[C@@H]([NH2+][C@@H](c1ccccc1)C1CCC1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000533505608 931887425 /nfs/dbraw/zinc/88/74/25/931887425.db2.gz RAXYRQYRCGTWKN-NLFFAJNJSA-N 2 0 405.586 4.287 20 0 HIADRP CCC1(C[NH2+]Cc2ccc(-n3cncn3)c(F)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000533608291 931921681 /nfs/dbraw/zinc/92/16/81/931921681.db2.gz QPHCHAMZFPDLSA-UHFFFAOYSA-N 2 0 407.537 4.188 20 0 HIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000533755979 932012088 /nfs/dbraw/zinc/01/20/88/932012088.db2.gz JEPIMPNANQJKLQ-UHFFFAOYSA-N 2 0 412.622 4.416 20 0 HIADRP Cc1c(F)cccc1NC(=O)CC[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534228690 932347410 /nfs/dbraw/zinc/34/74/10/932347410.db2.gz GNTGAGGMYAXRSY-UHFFFAOYSA-N 2 0 409.549 4.451 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000535088131 932903111 /nfs/dbraw/zinc/90/31/11/932903111.db2.gz LKMDICAXOAVKIA-NVQXNPDNSA-N 2 0 407.602 4.082 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C[C@H]3CCOC3)c3ccccc3)cc2)CC1 ZINC000535838742 933424728 /nfs/dbraw/zinc/42/47/28/933424728.db2.gz DXWWZIXWECIAIB-RSXGOPAZSA-N 2 0 407.602 4.082 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)N2CC[C@@H](C3CC[NH+](C)CC3)C2)CCCC1)c1ccccc1 ZINC000535939823 933506344 /nfs/dbraw/zinc/50/63/44/933506344.db2.gz YVKLFIZFFGFDHB-NFBKMPQASA-N 2 0 412.622 4.023 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(CNCc2c(Cl)cccc2N2CC[NH+](C)CC2)c1 ZINC000536130141 933678487 /nfs/dbraw/zinc/67/84/87/933678487.db2.gz GQYDSHYTCXLFHO-UHFFFAOYSA-N 2 0 415.025 4.222 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)c(Br)c1 ZINC000537289459 933699610 /nfs/dbraw/zinc/69/96/10/933699610.db2.gz WTAQNVINCPHMHL-QGZVFWFLSA-N 2 0 424.427 4.059 20 0 HIADRP Cn1nccc1[C@H]1CCC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000562617678 945108883 /nfs/dbraw/zinc/10/88/83/945108883.db2.gz RXEIXVROQPOISE-GOTSBHOMSA-N 2 0 410.606 4.107 20 0 HIADRP CN(C(=O)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCCc2ccccc21 ZINC000537843463 938387607 /nfs/dbraw/zinc/38/76/07/938387607.db2.gz QWLUQLFTTASJNI-RUZDIDTESA-N 2 0 420.601 4.156 20 0 HIADRP C[C@@H](C(=O)Nc1ccc(Cl)cc1)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537844264 938388057 /nfs/dbraw/zinc/38/80/57/938388057.db2.gz XFGFJYYLLHRNEZ-KRWDZBQOSA-N 2 0 400.954 4.301 20 0 HIADRP C[C@H]1C[C@H](CC[NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)C[N@@H+]1Cc1ccccc1 ZINC000537940332 938425582 /nfs/dbraw/zinc/42/55/82/938425582.db2.gz FMLUBHJBJKFMRS-MXRVMPPXSA-N 2 0 406.618 4.182 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCc3c2cc(Cl)cc3Br)CC1 ZINC000537956874 938432582 /nfs/dbraw/zinc/43/25/82/938432582.db2.gz JJNDEAGOZWCWFM-GUDVDZBRSA-N 2 0 413.787 4.057 20 0 HIADRP Brc1ccc(N2CC[C@@H](C[NH2+]C3CC[NH+](C4CCCC4)CC3)C2)cc1 ZINC000537989533 938451088 /nfs/dbraw/zinc/45/10/88/938451088.db2.gz BTOGOUQNPJTITH-KRWDZBQOSA-N 2 0 406.412 4.272 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000563314347 945176194 /nfs/dbraw/zinc/17/61/94/945176194.db2.gz IXNHOWFOEUZFSX-FPOVZHCZSA-N 2 0 415.603 4.011 20 0 HIADRP C[NH+]1CCN(C[C@@H]([NH2+][C@@H]2CCc3c2cccc3Br)c2ccccc2)CC1 ZINC000538100525 938502621 /nfs/dbraw/zinc/50/26/21/938502621.db2.gz PHGVAYSJCQRXCF-FGZHOGPDSA-N 2 0 414.391 4.015 20 0 HIADRP COc1ccccc1[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)C1CCCC1 ZINC000538115581 938506302 /nfs/dbraw/zinc/50/63/02/938506302.db2.gz AKPSRRSPZMPGHJ-DEOSSOPVSA-N 2 0 415.622 4.143 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)c1 ZINC000538216978 938560550 /nfs/dbraw/zinc/56/05/50/938560550.db2.gz GXUIVDDXJGKEPR-QFIPXVFZSA-N 2 0 418.965 4.301 20 0 HIADRP Cc1cc(Br)cc2cc([C@@H]([NH2+][C@H](C)CN3CC[NH+](C)CC3)C(C)C)oc21 ZINC000538447017 938623759 /nfs/dbraw/zinc/62/37/59/938623759.db2.gz SUIMLDWPDOJNCF-UZLBHIALSA-N 2 0 422.411 4.426 20 0 HIADRP CC(C)[NH+]1CCN(c2cccc(N[C@H](C)c3ccc(OCC[NH+](C)C)cc3)c2)CC1 ZINC000538548169 938646412 /nfs/dbraw/zinc/64/64/12/938646412.db2.gz GRYUYSQOAPLGIT-OAQYLSRUSA-N 2 0 410.606 4.331 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)Nc2ccc(N3CCC([NH+](C)C)CC3)cn2)cc1 ZINC000538591050 938657170 /nfs/dbraw/zinc/65/71/70/938657170.db2.gz WSVMVFLMZMZRIT-GOSISDBHSA-N 2 0 424.593 4.315 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(Br)c(OC(F)F)c(OC)c2)[C@@H](C)C1 ZINC000538718320 938689567 /nfs/dbraw/zinc/68/95/67/938689567.db2.gz JXHGSZUAYFAGRF-WFASDCNBSA-N 2 0 421.326 4.221 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cccc(-c4ccncc4)c3)CC2)CC1 ZINC000538722594 938691210 /nfs/dbraw/zinc/69/12/10/938691210.db2.gz YYDFAHXJEWVWPV-UHFFFAOYSA-N 2 0 406.618 4.377 20 0 HIADRP C[NH+](C)CCOC1CC[NH+](Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 ZINC000538731608 938695322 /nfs/dbraw/zinc/69/53/22/938695322.db2.gz YROANQBPBDWSNI-UHFFFAOYSA-N 2 0 422.548 4.221 20 0 HIADRP C[NH+](C)CCOC1CC[NH+](Cc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 ZINC000538732337 938695583 /nfs/dbraw/zinc/69/55/83/938695583.db2.gz DKCBOWKKHYWEHW-UHFFFAOYSA-N 2 0 404.558 4.082 20 0 HIADRP Cc1cc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)ccc1-n1cncn1 ZINC000538797908 938714752 /nfs/dbraw/zinc/71/47/52/938714752.db2.gz FAIZOIXSHZDBBV-ZCYQVOJMSA-N 2 0 401.558 4.062 20 0 HIADRP Cc1cc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)ccc1-n1cncn1 ZINC000538797905 938714832 /nfs/dbraw/zinc/71/48/32/938714832.db2.gz FAIZOIXSHZDBBV-ILBGXUMGSA-N 2 0 401.558 4.062 20 0 HIADRP Fc1ccc(Br)c2c1CC[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000539038628 938777482 /nfs/dbraw/zinc/77/74/82/938777482.db2.gz GZEAJWBZWPFXBE-LJQANCHMSA-N 2 0 404.327 4.477 20 0 HIADRP COc1ccccc1NC(=O)C[C@H](C)[NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000539045984 938780820 /nfs/dbraw/zinc/78/08/20/938780820.db2.gz DTXHHRTUGMPMBE-VWPQPMDRSA-N 2 0 409.574 4.303 20 0 HIADRP COc1ccc(NC(=O)C[C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000539045560 938781073 /nfs/dbraw/zinc/78/10/73/938781073.db2.gz BCPGJMZZRPPLDI-VWPQPMDRSA-N 2 0 409.574 4.303 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)ccn1 ZINC000539046852 938781677 /nfs/dbraw/zinc/78/16/77/938781677.db2.gz HLQZPZVZIDWDSJ-KRWDZBQOSA-N 2 0 410.345 4.332 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(Br)cc2)C1 ZINC000539052680 938784215 /nfs/dbraw/zinc/78/42/15/938784215.db2.gz KJIXMIRHPCYUFE-IRXDYDNUSA-N 2 0 410.400 4.124 20 0 HIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)CCCO2 ZINC000539072733 938794231 /nfs/dbraw/zinc/79/42/31/938794231.db2.gz GPDDUAUZLLZAGF-QHCPKHFHSA-N 2 0 409.574 4.105 20 0 HIADRP COc1cccc(N2CC[C@H](C[NH2+][C@H]3CC4(CC[NH+](C)CC4)Oc4ccccc43)C2)c1 ZINC000539363711 938849057 /nfs/dbraw/zinc/84/90/57/938849057.db2.gz QSWZXPDSKAJQRK-YKSBVNFPSA-N 2 0 421.585 4.099 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H](NCCC[N@@H+]1CCc3ccccc3C1)c1ccccc1O2 ZINC000539368469 938849753 /nfs/dbraw/zinc/84/97/53/938849753.db2.gz ADCWIOYMZHGAFN-DEOSSOPVSA-N 2 0 405.586 4.013 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]Cc1ccc(Cn3cccn3)cc1)c1ccccc1O2 ZINC000539369252 938850124 /nfs/dbraw/zinc/85/01/24/938850124.db2.gz QXAWDWGLILKSKU-HSZRJFAPSA-N 2 0 402.542 4.009 20 0 HIADRP C[C@@H](CS(=O)(=O)c1ccccc1)[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000539377228 938851151 /nfs/dbraw/zinc/85/11/51/938851151.db2.gz ONHWGCDZQOXWSX-FQEVSTJZSA-N 2 0 400.588 4.015 20 0 HIADRP C[C@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1nc(-c2ccccc2)no1 ZINC000539409061 938856542 /nfs/dbraw/zinc/85/65/42/938856542.db2.gz IAPINBRKMVZVRB-WIYYLYMNSA-N 2 0 418.541 4.418 20 0 HIADRP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000539497369 938868886 /nfs/dbraw/zinc/86/88/86/938868886.db2.gz YUWZYSIPUSWTNT-SFHVURJKSA-N 2 0 407.558 4.446 20 0 HIADRP COCCOCc1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000563564203 945216224 /nfs/dbraw/zinc/21/62/24/945216224.db2.gz HYMZEPATNBSPIU-TWJOJJKGSA-N 2 0 408.586 4.240 20 0 HIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](CCSc3ccnc4cc(Cl)ccc43)C2)CC1 ZINC000539808864 938939252 /nfs/dbraw/zinc/93/92/52/938939252.db2.gz FOLZWOVNMXQJMK-IBGZPJMESA-N 2 0 419.038 4.081 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2c(C)nn(Cc3ccc(C)cc3)c2C)CC1 ZINC000539861412 938959831 /nfs/dbraw/zinc/95/98/31/938959831.db2.gz PITTWOONAURSMQ-UHFFFAOYSA-N 2 0 412.622 4.179 20 0 HIADRP C[C@@H](CC[NH+]1CCC(Cc2cccnc2)CC1)[NH+]1CCC(Cc2cccnc2)CC1 ZINC000540044266 939047950 /nfs/dbraw/zinc/04/79/50/939047950.db2.gz SGGASAMODGKVSY-QFIPXVFZSA-N 2 0 406.618 4.464 20 0 HIADRP C[C@H](CC[NH+]1CCC(Cc2cccnc2)CC1)[NH+]1CCC(Cc2cccnc2)CC1 ZINC000540044265 939048155 /nfs/dbraw/zinc/04/81/55/939048155.db2.gz SGGASAMODGKVSY-JOCHJYFZSA-N 2 0 406.618 4.464 20 0 HIADRP O=C(NCC1CCN(c2cc[nH+]cc2)CC1)Nc1ccc(CC[NH+]2CCCCC2)cc1 ZINC000540129648 939084104 /nfs/dbraw/zinc/08/41/04/939084104.db2.gz LMGVCGOSMNBQMI-UHFFFAOYSA-N 2 0 421.589 4.148 20 0 HIADRP C[C@H]([NH2+]CCc1nc(-c2ccc(Cl)cc2)no1)c1cccc(OCC[NH+](C)C)c1 ZINC000540182691 939108710 /nfs/dbraw/zinc/10/87/10/939108710.db2.gz LRYFPFLIDUZHBS-INIZCTEOSA-N 2 0 414.937 4.224 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000540316547 939192156 /nfs/dbraw/zinc/19/21/56/939192156.db2.gz WMVPEQMHMQZNSH-OAQYLSRUSA-N 2 0 419.491 4.238 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CC1(c3ccc(F)cc3)CCOCC1)c1ccccc1O2 ZINC000540474819 939266269 /nfs/dbraw/zinc/26/62/69/939266269.db2.gz FGWHBENIONRLDX-HSZRJFAPSA-N 2 0 424.560 4.452 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CC1(c3ccc(F)cc3)CCOCC1)c1ccccc1O2 ZINC000540474820 939266469 /nfs/dbraw/zinc/26/64/69/939266469.db2.gz FGWHBENIONRLDX-QHCPKHFHSA-N 2 0 424.560 4.452 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C1CCC(C(=O)OC(C)(C)C)CC1)c1ccccc1O2 ZINC000540507146 939281090 /nfs/dbraw/zinc/28/10/90/939281090.db2.gz WKWWRYXYJOYHQQ-GRERDSQWSA-N 2 0 414.590 4.465 20 0 HIADRP CC(C)N1CC[C@@H](NC(=O)NCCC2CC[NH+](C)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000540718671 939348024 /nfs/dbraw/zinc/34/80/24/939348024.db2.gz URUCWTRGOLYVAY-RTWAWAEBSA-N 2 0 424.992 4.034 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1cccc(C[NH+]2CCC(CO)CC2)c1 ZINC000540749967 939358215 /nfs/dbraw/zinc/35/82/15/939358215.db2.gz RRMFHMMRLYMXET-LVXARBLLSA-N 2 0 407.602 4.213 20 0 HIADRP COc1ccc([C@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2ccccc2Cl)cc1 ZINC000540908543 939415146 /nfs/dbraw/zinc/41/51/46/939415146.db2.gz HFZOFIVCNVHQPO-QHCPKHFHSA-N 2 0 401.982 4.055 20 0 HIADRP CSC[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(C(F)(F)F)cc1 ZINC000540986268 939425214 /nfs/dbraw/zinc/42/52/14/939425214.db2.gz CYUMSMGWIGFMPL-IBGZPJMESA-N 2 0 424.536 4.046 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(SCC(F)F)cc1 ZINC000540987911 939425774 /nfs/dbraw/zinc/42/57/74/939425774.db2.gz BZEZNDKXFDCXGS-UZLBHIALSA-N 2 0 406.542 4.461 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N[C@@H]2CC[NH+](C)[C@H](C)C2)cc1)C[C@H]1CCCCO1 ZINC000541034154 939436851 /nfs/dbraw/zinc/43/68/51/939436851.db2.gz YLYGBFGVUWUAKL-UEVCKROQSA-N 2 0 416.610 4.070 20 0 HIADRP C[C@@H]1[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C[C@@H]1c1ccccc1 ZINC000541238639 939487143 /nfs/dbraw/zinc/48/71/43/939487143.db2.gz YBFNRTWQCCNEKZ-YMSRPXOMSA-N 2 0 408.586 4.458 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 ZINC000541534436 939546716 /nfs/dbraw/zinc/54/67/16/939546716.db2.gz PXGOGWDTJCNLLC-SFHVURJKSA-N 2 0 418.476 4.144 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](CC/C=C/c3ccc(Br)cc3)CC2)CC1 ZINC000541663566 939594578 /nfs/dbraw/zinc/59/45/78/939594578.db2.gz VTHFCMWXDFPOGB-HWKANZROSA-N 2 0 420.439 4.202 20 0 HIADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000541785627 939629727 /nfs/dbraw/zinc/62/97/27/939629727.db2.gz WJRHSENRWAQDNF-NJDAHSKKSA-N 2 0 414.638 4.036 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(F)c(F)c1 ZINC000541913420 939652251 /nfs/dbraw/zinc/65/22/51/939652251.db2.gz JWWPTSFQRMHVOD-NFBKMPQASA-N 2 0 415.528 4.149 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000541914750 939652287 /nfs/dbraw/zinc/65/22/87/939652287.db2.gz JEHSYTUIXATPAL-VXKWHMMOSA-N 2 0 415.375 4.257 20 0 HIADRP Cc1ccc(NC(=O)COc2ccc(CC[NH2+]C3CC[NH+](C(C)C)CC3)cc2)cc1 ZINC000542019525 939687898 /nfs/dbraw/zinc/68/78/98/939687898.db2.gz ZJEVERSXSASIPV-UHFFFAOYSA-N 2 0 409.574 4.017 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)CC1 ZINC000542080463 939704178 /nfs/dbraw/zinc/70/41/78/939704178.db2.gz WULOJOKWZYGNDS-NRFANRHFSA-N 2 0 420.667 4.429 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)Cn1c2ccccc2c2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542534729 939839173 /nfs/dbraw/zinc/83/91/73/939839173.db2.gz WBXWXCOHYJEXMW-ONTIZHBOSA-N 2 0 405.586 4.398 20 0 HIADRP CC[C@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Cl)s1 ZINC000542556111 939843055 /nfs/dbraw/zinc/84/30/55/939843055.db2.gz MAWIPBSWWDEPJG-SFHVURJKSA-N 2 0 405.995 4.354 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)NCCC[NH+]2CCCC2)cc1)C[C@H]1CCCCO1 ZINC000542891290 939865718 /nfs/dbraw/zinc/86/57/18/939865718.db2.gz VKIDJYSVXUIBCW-HSZRJFAPSA-N 2 0 416.610 4.074 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000543394222 940050369 /nfs/dbraw/zinc/05/03/69/940050369.db2.gz SLMFJNAUVMBXHY-UHFFFAOYSA-N 2 0 404.493 4.170 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000543406309 940054817 /nfs/dbraw/zinc/05/48/17/940054817.db2.gz GYVXASCXKFNQOA-HXUWFJFHSA-N 2 0 410.558 4.321 20 0 HIADRP CC(C)Oc1ccc2ccccc2c1C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000543520686 940095518 /nfs/dbraw/zinc/09/55/18/940095518.db2.gz OLKHVJJSVNAJKF-UHFFFAOYSA-N 2 0 409.618 4.477 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2ccc(NC(C)=O)cc2)CC1 ZINC000543776661 940183408 /nfs/dbraw/zinc/18/34/08/940183408.db2.gz ZQGXMIFHYJOHDD-ROUUACIJSA-N 2 0 412.553 4.338 20 0 HIADRP CSC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(C(F)(F)F)cc1 ZINC000543777278 940183577 /nfs/dbraw/zinc/18/35/77/940183577.db2.gz SUMUXYKUMDZXMQ-RTWAWAEBSA-N 2 0 424.532 4.466 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(F)c(Br)c1 ZINC000543778253 940184093 /nfs/dbraw/zinc/18/40/93/940184093.db2.gz ZQIBLXNVBUNSKH-KBXCAEBGSA-N 2 0 407.327 4.006 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCOc3cc4c(cc32)CCCC4)C1 ZINC000543777609 940184605 /nfs/dbraw/zinc/18/46/05/940184605.db2.gz URGBUPAZUIIOAD-ZCYQVOJMSA-N 2 0 406.570 4.136 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N(C)CC[NH+]2CCCC2)cc1)C[C@H]1CCCCO1 ZINC000543818549 940197227 /nfs/dbraw/zinc/19/72/27/940197227.db2.gz GKWIJQQOZHRIFJ-HSZRJFAPSA-N 2 0 416.610 4.026 20 0 HIADRP CCOC(=O)c1c(C)c(C)sc1NC(=O)C[C@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000543996343 940289567 /nfs/dbraw/zinc/28/95/67/940289567.db2.gz GJSMOYHGGFWLBK-AWEZNQCLSA-N 2 0 423.623 4.111 20 0 HIADRP COc1ccc(Oc2ccc(C[NH2+]C3CC[NH+]([C@H]4CCCC[C@@H]4O)CC3)cc2)cc1 ZINC000544179814 940345553 /nfs/dbraw/zinc/34/55/53/940345553.db2.gz NFHHMQHAYKWJJJ-DQEYMECFSA-N 2 0 410.558 4.345 20 0 HIADRP COc1cc(C[NH2+]Cc2cn(-c3cc[nH+]cc3)nc2C)ccc1OCc1ccccc1 ZINC000544187835 940347890 /nfs/dbraw/zinc/34/78/90/940347890.db2.gz XHBFHBRJGYPAEA-UHFFFAOYSA-N 2 0 414.509 4.453 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000544188033 940348062 /nfs/dbraw/zinc/34/80/62/940348062.db2.gz MUQJHIAMXYGPQK-UHFFFAOYSA-N 3 0 417.601 4.400 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)C[C@@H](C)O1 ZINC000544828911 940518003 /nfs/dbraw/zinc/51/80/03/940518003.db2.gz COQCUMBTAUBXBK-PWHSHALESA-N 2 0 401.982 4.498 20 0 HIADRP c1ccc(-c2noc([C@@H]3CCC[N@H+](Cc4cccnc4)C3)n2)c(C[NH+]2CCCC2)c1 ZINC000544915708 940524957 /nfs/dbraw/zinc/52/49/57/940524957.db2.gz PZAUKMXDOMNCQL-OAQYLSRUSA-N 2 0 403.530 4.107 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)N1CCC2(CCC[N@@H+]2C)CC1)c1cccc(C(F)(F)F)c1 ZINC000544943893 940526796 /nfs/dbraw/zinc/52/67/96/940526796.db2.gz YIJCFMBOAUNZSY-LJQANCHMSA-N 2 0 411.512 4.175 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)N[C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[NH+]3C)CC[N@@H+]1C ZINC000548970939 941135968 /nfs/dbraw/zinc/13/59/68/941135968.db2.gz KIWNMOQHKPYGQE-OJFPFPAYSA-N 2 0 419.013 4.036 20 0 HIADRP Cc1ccc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c(-c2cnn(C)c2)c1 ZINC000549253017 941174518 /nfs/dbraw/zinc/17/45/18/941174518.db2.gz LJWKCQDIVWBPTH-UHFFFAOYSA-N 2 0 404.558 4.160 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)c2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000549381712 941184393 /nfs/dbraw/zinc/18/43/93/941184393.db2.gz UDWVSOSWFCOMFC-PXDATVDWSA-N 2 0 405.586 4.408 20 0 HIADRP C[C@@H](c1ccc(F)cc1)N1CC[C@H]([N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)C1=O ZINC000549536968 941198553 /nfs/dbraw/zinc/19/85/53/941198553.db2.gz PSUOUPOHQCKOEP-CYFREDJKSA-N 2 0 424.564 4.121 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+]([C@H]2CCN([C@H](C)c3ccc(F)cc3)C2=O)CC1 ZINC000549932070 941241615 /nfs/dbraw/zinc/24/16/15/941241615.db2.gz PFBGCNQPSIMCKJ-XXBNENTESA-N 2 0 403.586 4.322 20 0 HIADRP COc1cc(C[NH+]2CCCO[C@H](C(C)C)C2)cc(C[N@@H+]2CCCO[C@@H](C(C)C)C2)c1 ZINC000550186419 941295606 /nfs/dbraw/zinc/29/56/06/941295606.db2.gz RNQXMIJOVRZSJP-PLQXJYEYSA-N 2 0 418.622 4.189 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1)c1ccc(C(=O)OC)cc1 ZINC000550605950 941345641 /nfs/dbraw/zinc/34/56/41/941345641.db2.gz IJZHPLVCEZWCFF-JXQFQVJHSA-N 2 0 410.558 4.323 20 0 HIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccccc2N2CCO[C@@H](C)C2)CC1 ZINC000550750886 941363067 /nfs/dbraw/zinc/36/30/67/941363067.db2.gz QTCATWWSKVAYSL-QFIPXVFZSA-N 2 0 407.602 4.433 20 0 HIADRP CC(=O)N1CCC[C@H](C[NH2+][C@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)C1 ZINC000550901429 941380798 /nfs/dbraw/zinc/38/07/98/941380798.db2.gz HRSDRYLPGYZIHT-ZJSXRUAMSA-N 2 0 403.586 4.227 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(F)c2ccccc21 ZINC000551029223 941397489 /nfs/dbraw/zinc/39/74/89/941397489.db2.gz AQIGHKCVAVAVKV-IBGZPJMESA-N 2 0 407.537 4.022 20 0 HIADRP Cc1nn(Cc2ccccc2)c(C)c1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551269634 941440422 /nfs/dbraw/zinc/44/04/22/941440422.db2.gz ZBEYFWHWPLZJQJ-UHFFFAOYSA-N 2 0 418.585 4.311 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000551815851 941551525 /nfs/dbraw/zinc/55/15/25/941551525.db2.gz DCZCWAKPFSOSBG-LJQANCHMSA-N 2 0 407.558 4.137 20 0 HIADRP FC(F)(F)Cn1cc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000552034836 941571428 /nfs/dbraw/zinc/57/14/28/941571428.db2.gz GQWGNWUDERGHAL-QHAWAJNXSA-N 2 0 406.496 4.226 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)C[C@@H]1C ZINC000552168936 941596106 /nfs/dbraw/zinc/59/61/06/941596106.db2.gz WLFILLDRZGJXSG-REWPJTCUSA-N 2 0 400.611 4.298 20 0 HIADRP CCOc1ccc([C@@H](C)NC(=O)CCC[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000552582784 941713254 /nfs/dbraw/zinc/71/32/54/941713254.db2.gz WXDLOCNHLBCZDI-LJQANCHMSA-N 2 0 401.595 4.039 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nn(-c2ccccc2)c2c1CCC2 ZINC000552783885 941761585 /nfs/dbraw/zinc/76/15/85/941761585.db2.gz BDXKKHTXEXQHRT-UHFFFAOYSA-N 2 0 415.585 4.495 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000552904722 941800727 /nfs/dbraw/zinc/80/07/27/941800727.db2.gz UOJCTZYBLKHJCA-DYESRHJHSA-N 2 0 410.949 4.433 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+]C2(c3ccc(Cl)cc3)CC2)CC1 ZINC000553002785 941813811 /nfs/dbraw/zinc/81/38/11/941813811.db2.gz JNXSAEJYXIERSG-UHFFFAOYSA-N 2 0 411.977 4.008 20 0 HIADRP C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000553394223 941878731 /nfs/dbraw/zinc/87/87/31/941878731.db2.gz IXXRCVULBXSTET-HYBUGGRVSA-N 2 0 420.601 4.183 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000554809786 942253075 /nfs/dbraw/zinc/25/30/75/942253075.db2.gz DDCQTMWLTYJNBC-MSOLQXFVSA-N 2 0 422.411 4.364 20 0 HIADRP C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000554961102 942335111 /nfs/dbraw/zinc/33/51/11/942335111.db2.gz SHLQOFJWVPDPFP-XBYSBRQOSA-N 2 0 423.626 4.254 20 0 HIADRP FC(F)Oc1cccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000555612584 942669497 /nfs/dbraw/zinc/66/94/97/942669497.db2.gz UWGFHPSWAHTIAH-OAQYLSRUSA-N 2 0 416.512 4.306 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000556223593 942820612 /nfs/dbraw/zinc/82/06/12/942820612.db2.gz KLSJGZVLFCXTLY-VCWGXOKSSA-N 2 0 423.576 4.378 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NCc2ccc(OC3CC[NH+](C)CC3)cc2)cc1 ZINC000557183475 943043226 /nfs/dbraw/zinc/04/32/26/943043226.db2.gz JLAGPVHKEUBPQV-UHFFFAOYSA-N 2 0 423.601 4.322 20 0 HIADRP CN(CCC[NH+]1CCCC1)C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000558108760 943382309 /nfs/dbraw/zinc/38/23/09/943382309.db2.gz HALDACGVFLJFLM-UHFFFAOYSA-N 2 0 408.590 4.043 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@H](C[NH+](C)C)c1ccc(Cl)cc1 ZINC000558886456 943720762 /nfs/dbraw/zinc/72/07/62/943720762.db2.gz GBPMCUDUIHSPSL-JOCHJYFZSA-N 2 0 416.997 4.282 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CNC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000558893236 943724946 /nfs/dbraw/zinc/72/49/46/943724946.db2.gz XUZRSARVIZDZSI-DOKCZXGGSA-N 2 0 419.013 4.037 20 0 HIADRP C[NH+](C)CCN(Cc1ccccc1)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000558956762 943771239 /nfs/dbraw/zinc/77/12/39/943771239.db2.gz KOTCIXGQDHFPMD-XMMPIXPASA-N 2 0 422.617 4.061 20 0 HIADRP COc1ccsc1[C@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000559892529 944077469 /nfs/dbraw/zinc/07/74/69/944077469.db2.gz KNEWVGZBMWOFLL-AZUAARDMSA-N 2 0 400.588 4.336 20 0 HIADRP CCc1nn(-c2ccccc2)c(CC)c1C[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000560024343 944132193 /nfs/dbraw/zinc/13/21/93/944132193.db2.gz DUXPRFVZMOIELW-UHFFFAOYSA-N 2 0 400.530 4.176 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N(C)C[C@@H]2CC[N@H+](Cc3ccc(C)s3)C2)cc1 ZINC000560483588 944236984 /nfs/dbraw/zinc/23/69/84/944236984.db2.gz KWFCSZIOWKULGD-NRFANRHFSA-N 2 0 413.631 4.492 20 0 HIADRP O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000560912284 944368619 /nfs/dbraw/zinc/36/86/19/944368619.db2.gz ZCIKEIIGWVGGSI-FGZHOGPDSA-N 2 0 423.601 4.228 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)C[C@@H](c2ncc[nH]2)c2ccccc2)C1 ZINC000561155222 944484882 /nfs/dbraw/zinc/48/48/82/944484882.db2.gz GUQODTSWVOJLDT-GBXCKJPGSA-N 2 0 416.569 4.480 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000561279750 944537306 /nfs/dbraw/zinc/53/73/06/944537306.db2.gz RMYSJLZCAXFNEY-SANMLTNESA-N 2 0 403.570 4.021 20 0 HIADRP CC(C)C[C@@H]1C[N@H+](CCCc2ccccc2)CCN1C(=O)C1CC[NH+](C2CC2)CC1 ZINC000561545752 944667207 /nfs/dbraw/zinc/66/72/07/944667207.db2.gz DLWGKVMWORGXHJ-RUZDIDTESA-N 2 0 411.634 4.053 20 0 HIADRP CCC[NH+](C)[C@H](CNC(=O)N1CC[C@H](C[N@@H+](C)CCC)C1)c1ccc(Cl)cc1 ZINC000561872230 944829668 /nfs/dbraw/zinc/82/96/68/944829668.db2.gz ZPEDLAYDJAOEHD-WIYYLYMNSA-N 2 0 409.018 4.096 20 0 HIADRP CC(C)Oc1ccc([C@H](CNC2CC[NH+](CCc3ccccc3)CC2)[NH+](C)C)cc1 ZINC000562057570 944915191 /nfs/dbraw/zinc/91/51/91/944915191.db2.gz XJTFKDXWTHGIKM-SANMLTNESA-N 2 0 409.618 4.373 20 0 HIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cn(Cc4ccccc4)nc3-c3cccnc3)C2)CC1 ZINC000564317209 945512610 /nfs/dbraw/zinc/51/26/10/945512610.db2.gz HNOKPHKJZJZBMV-DEOSSOPVSA-N 2 0 415.585 4.157 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC[NH+](C2CCCC2)CC1 ZINC000564374310 945540614 /nfs/dbraw/zinc/54/06/14/945540614.db2.gz WUDIHSPJKBSGLG-OAQYLSRUSA-N 2 0 412.622 4.221 20 0 HIADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000564387356 945547925 /nfs/dbraw/zinc/54/79/25/945547925.db2.gz JMQAPCBWAOICMF-QHAWAJNXSA-N 2 0 414.638 4.036 20 0 HIADRP Oc1ccc2c(c1)C1(CC1)C[NH+](CCCC[N@H+]1Cc3ccc(O)cc3C3(CC3)C1)C2 ZINC000564673293 945723086 /nfs/dbraw/zinc/72/30/86/945723086.db2.gz YFZDNMKBKASJHI-UHFFFAOYSA-N 2 0 404.554 4.273 20 0 HIADRP C[NH+](C)Cc1ccc(C[NH2+]C2CCN(Cc3c(F)cccc3Cl)CC2)cc1F ZINC000565320757 945809275 /nfs/dbraw/zinc/80/92/75/945809275.db2.gz GJGZUFRQYQSDLC-UHFFFAOYSA-N 2 0 407.936 4.434 20 0 HIADRP CSc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1F ZINC000566587401 946048270 /nfs/dbraw/zinc/04/82/70/946048270.db2.gz HKIDVBJRIFWYLE-OXJNMPFZSA-N 2 0 415.578 4.096 20 0 HIADRP CCO[C@@H]1C[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C12CCCC2 ZINC000567128945 946246754 /nfs/dbraw/zinc/24/67/54/946246754.db2.gz NQXXYWSRDZHULS-TZRRMPRUSA-N 2 0 412.618 4.243 20 0 HIADRP CCCC[NH+]1CCC(NC(=O)N(CCC)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000568015654 946444204 /nfs/dbraw/zinc/44/42/04/946444204.db2.gz YWYPLIXVZZOYTE-XMMPIXPASA-N 2 0 414.638 4.337 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)cc(OC)c1O ZINC000569041134 946805244 /nfs/dbraw/zinc/80/52/44/946805244.db2.gz MRESBXOJLPFZJS-UHFFFAOYSA-N 2 0 406.526 4.428 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000570439699 947247919 /nfs/dbraw/zinc/24/79/19/947247919.db2.gz XCGRCCHQRKUJEJ-PZJWPPBQSA-N 2 0 415.603 4.011 20 0 HIADRP Cc1ccc(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)c(-c2cnn(C)c2)c1 ZINC000571098249 947494690 /nfs/dbraw/zinc/49/46/90/947494690.db2.gz LDFKYZOCMWPTQW-RCZVLFRGSA-N 2 0 400.570 4.349 20 0 HIADRP Cc1nn(-c2ccc(Br)cc2)cc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000571182394 947533926 /nfs/dbraw/zinc/53/39/26/947533926.db2.gz CTUVQOOFHRMMAW-UHFFFAOYSA-N 2 0 405.384 4.299 20 0 HIADRP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000571692221 947750807 /nfs/dbraw/zinc/75/08/07/947750807.db2.gz DZBWPSZWABQBLA-UHFFFAOYSA-N 2 0 404.558 4.252 20 0 HIADRP CN(CC[N@H+](C)CC(c1ccc(F)cc1)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000571722074 947762824 /nfs/dbraw/zinc/76/28/24/947762824.db2.gz XXWURJKVJZEJJF-UHFFFAOYSA-N 2 0 401.545 4.055 20 0 HIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cccc(Br)c3OC(F)F)C2)CC1 ZINC000572445116 947909737 /nfs/dbraw/zinc/90/97/37/947909737.db2.gz UDOVUAOYXHXUFL-CQSZACIVSA-N 2 0 403.311 4.214 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000573942885 948329146 /nfs/dbraw/zinc/32/91/46/948329146.db2.gz HBSPTLKDDHDONB-IFMALSPDSA-N 2 0 420.475 4.393 20 0 HIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)cc1 ZINC000575010936 948572638 /nfs/dbraw/zinc/57/26/38/948572638.db2.gz HZVVINVILMXNOO-FQEVSTJZSA-N 2 0 409.574 4.150 20 0 HIADRP CC[C@H](C(=O)Nc1ccc(C[NH+]2CCSCC2)cc1C)[N@H+](C)Cc1ccccc1 ZINC000575023762 948575733 /nfs/dbraw/zinc/57/57/33/948575733.db2.gz ZYSYOEVKXBKCIO-HSZRJFAPSA-N 2 0 411.615 4.393 20 0 HIADRP C[C@@H]1C[C@@H]1[N@@H+]1CCN(C(=O)c2cccc(C[NH+](C)Cc3ccccc3)c2)C[C@@H](C)C1 ZINC000575773613 948702705 /nfs/dbraw/zinc/70/27/05/948702705.db2.gz ZWHBHWQTGZMQLO-BKSPAHHJSA-N 2 0 405.586 4.121 20 0 HIADRP CC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCn3c(C[NH+](C)C(C)C)cnc3[C@@H]2C)nc1 ZINC001164862348 721017107 /nfs/dbraw/zinc/01/71/07/721017107.db2.gz PYPZLRHDGZCSAG-SIKLNZKXSA-N 2 0 410.610 4.246 20 0 HIADRP Cc1ccc(C[NH+]2CCC3(CCN(c4nccc(C5CC[NH2+]CC5)n4)CC3)CC2)cc1 ZINC001164760612 721045147 /nfs/dbraw/zinc/04/51/47/721045147.db2.gz XZTSSWRVZBRGLC-UHFFFAOYSA-N 2 0 419.617 4.135 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1 ZINC000436284002 861591780 /nfs/dbraw/zinc/59/17/80/861591780.db2.gz XOKZYMNGIVKNNE-UHFFFAOYSA-N 2 0 419.569 4.225 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)cc2)CC1 ZINC000029732212 847611123 /nfs/dbraw/zinc/61/11/23/847611123.db2.gz OMPHRXCNPSVSNZ-UHFFFAOYSA-N 2 0 400.611 4.027 20 0 HIADRP C[N@H+](Cc1ccccc1NC(=O)N1CCN(c2cc[nH+]cc2)CC1)C1CCCCC1 ZINC000043391218 848417110 /nfs/dbraw/zinc/41/71/10/848417110.db2.gz NNMBSJDOEMRDJQ-UHFFFAOYSA-N 2 0 407.562 4.200 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)NC[C@H](c2ccccc2Cl)[NH+]2CCCC2)c1 ZINC000044291810 848540189 /nfs/dbraw/zinc/54/01/89/848540189.db2.gz GEUUBZATXZLJJL-OAQYLSRUSA-N 2 0 400.954 4.360 20 0 HIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000048717148 849258844 /nfs/dbraw/zinc/25/88/44/849258844.db2.gz XDYDWRAGAIRUHZ-UHFFFAOYSA-N 2 0 412.965 4.373 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2ccc(C[NH+]3CCC[C@@H](C)C3)cc2)CC1 ZINC000056846249 850500035 /nfs/dbraw/zinc/50/00/35/850500035.db2.gz ITDJDTRIVUATCC-OAQYLSRUSA-N 2 0 414.638 4.180 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)N2CCC([NH+]3CCCCC3)CC2)c2ccccc2)CC1 ZINC000057854553 850733162 /nfs/dbraw/zinc/73/31/62/850733162.db2.gz MPODUJISNQLCGV-XMMPIXPASA-N 2 0 412.622 4.120 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)cc1 ZINC000058467385 850832861 /nfs/dbraw/zinc/83/28/61/850832861.db2.gz DBCYUTXALOYYEK-OAQYLSRUSA-N 2 0 414.619 4.226 20 0 HIADRP CC1CC[NH+](C[C@@H]2CCCN(C(=O)[C@H]3CCC[N@H+](Cc4cccc(F)c4)C3)C2)CC1 ZINC000060275555 851058363 /nfs/dbraw/zinc/05/83/63/851058363.db2.gz BHFYXAGSZJLJPB-GOTSBHOMSA-N 2 0 415.597 4.008 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1)c1ccsc1 ZINC000060566672 851149608 /nfs/dbraw/zinc/14/96/08/851149608.db2.gz SDJLPLVITAMSOR-QFIPXVFZSA-N 2 0 414.619 4.226 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc4cc(OC)ccc4c3)cc2)CC1 ZINC000061070074 851287245 /nfs/dbraw/zinc/28/72/45/851287245.db2.gz VJMVHQWNKAVKEE-UHFFFAOYSA-N 2 0 403.570 4.276 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@@H](c1cccs1)[NH+](C)C ZINC000061112978 851296587 /nfs/dbraw/zinc/29/65/87/851296587.db2.gz KIOLKYWQGJCSLO-NQIIRXRSSA-N 2 0 414.619 4.225 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1 ZINC000061230323 851323590 /nfs/dbraw/zinc/32/35/90/851323590.db2.gz RDZPKOIVHNSPNW-XMMPIXPASA-N 2 0 408.590 4.165 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000061520907 851394627 /nfs/dbraw/zinc/39/46/27/851394627.db2.gz AJJABKRRQGZHJF-UHFFFAOYSA-N 2 0 408.590 4.122 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1CC[NH+](CC2CCCCC2)CC1)c1ccsc1 ZINC000062528589 851570721 /nfs/dbraw/zinc/57/07/21/851570721.db2.gz HZISFYZAXUDSAE-QFIPXVFZSA-N 2 0 420.667 4.475 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)NC2CC[NH+](CC3CCCCC3)CC2)c1 ZINC000062528635 851570772 /nfs/dbraw/zinc/57/07/72/851570772.db2.gz FUPFRLINZNIUFI-UHFFFAOYSA-N 2 0 414.638 4.372 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)c2ccccc2)CC1 ZINC000062646742 851584278 /nfs/dbraw/zinc/58/42/78/851584278.db2.gz FTDCNIRWZIRGFO-FCHUYYIVSA-N 2 0 414.619 4.123 20 0 HIADRP CCCc1cc[n+](C(C(=O)c2cc(C)ccc2C)C(=S)NC2CC[NH+](C)CC2)cc1 ZINC000063441564 851691171 /nfs/dbraw/zinc/69/11/71/851691171.db2.gz JVZSHLFSKAWDCA-UHFFFAOYSA-O 2 0 424.634 4.166 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NC[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000063463889 851695804 /nfs/dbraw/zinc/69/58/04/851695804.db2.gz TUYIGJSQXQUTJB-HSZRJFAPSA-N 2 0 422.617 4.238 20 0 HIADRP COc1cc(C[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)ccc1SC ZINC000063912414 851792518 /nfs/dbraw/zinc/79/25/18/851792518.db2.gz NMWVYKNFFFNFGS-UHFFFAOYSA-N 2 0 413.631 4.418 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)CC1 ZINC000071919665 852431514 /nfs/dbraw/zinc/43/15/14/852431514.db2.gz YTBFAAZOGCHDNC-VWLOTQADSA-N 2 0 420.601 4.096 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cc2ccccc2nc1N1CCOCC1 ZINC000139533714 853414031 /nfs/dbraw/zinc/41/40/31/853414031.db2.gz DGPUYFVQXQTUNQ-UHFFFAOYSA-N 2 0 418.585 4.201 20 0 HIADRP c1ccc(CN2CCC([NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)CC2)cc1 ZINC000236710211 853914282 /nfs/dbraw/zinc/91/42/82/853914282.db2.gz CDOYUYBECOSZGL-UHFFFAOYSA-N 2 0 421.629 4.312 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(NC(=O)C(C)C)cc2)CC1 ZINC000236802598 853924760 /nfs/dbraw/zinc/92/47/60/853924760.db2.gz LWLMEOUTHNJJBL-UHFFFAOYSA-N 2 0 408.590 4.103 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(-c4ccccc4OC)cc3)cn2)CC1 ZINC000236866428 853931088 /nfs/dbraw/zinc/93/10/88/853931088.db2.gz LMEIONAQDPJXSG-UHFFFAOYSA-N 2 0 416.569 4.189 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+]Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000236941220 853940165 /nfs/dbraw/zinc/94/01/65/853940165.db2.gz CPZDTIUWBRPXSI-UHFFFAOYSA-N 2 0 420.395 4.216 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000236978002 853945326 /nfs/dbraw/zinc/94/53/26/853945326.db2.gz DCJYNSYHBPWXLD-LJQANCHMSA-N 2 0 401.982 4.035 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+]Cc2ccc(-c3ccccc3Br)s2)CC1 ZINC000237167518 853975449 /nfs/dbraw/zinc/97/54/49/853975449.db2.gz VOQHUBJFGUVOBH-UHFFFAOYSA-N 2 0 422.436 4.293 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2ccc3c(c2)CC(C)(C)O3)c1)C1CCOCC1 ZINC000237206402 853982054 /nfs/dbraw/zinc/98/20/54/853982054.db2.gz MKRPCMOMSQOBHG-UHFFFAOYSA-N 2 0 424.585 4.180 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc(Cl)c1OC ZINC000237215472 853984873 /nfs/dbraw/zinc/98/48/73/853984873.db2.gz UJTRPGZTZIOKIN-IAGOWNOFSA-N 2 0 418.965 4.256 20 0 HIADRP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)ccc1OCc1c(C)noc1C ZINC000237241557 853989082 /nfs/dbraw/zinc/98/90/82/853989082.db2.gz LBZVKVXGLASNSF-FQEVSTJZSA-N 2 0 401.551 4.089 20 0 HIADRP COCc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)cc1 ZINC000237283321 853997232 /nfs/dbraw/zinc/99/72/32/853997232.db2.gz WXQVCZJHRPSJFE-UHFFFAOYSA-N 2 0 415.581 4.445 20 0 HIADRP CSc1ccc(C[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000237389985 854020195 /nfs/dbraw/zinc/02/01/95/854020195.db2.gz IMTCWROLHCCRKU-UHFFFAOYSA-N 2 0 409.521 4.469 20 0 HIADRP Clc1nc2ccccn2c1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000237803515 854099896 /nfs/dbraw/zinc/09/98/96/854099896.db2.gz XIIWIWSBLRBDOW-UHFFFAOYSA-N 2 0 412.965 4.149 20 0 HIADRP O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000237826002 854104457 /nfs/dbraw/zinc/10/44/57/854104457.db2.gz PKPOIJVZNQVPJL-UHFFFAOYSA-N 2 0 417.937 4.409 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)N2CCC[N@H+](CC3CCCCC3)CC2)[NH+]2CCCC2)o1 ZINC000303110348 854765249 /nfs/dbraw/zinc/76/52/49/854765249.db2.gz FXVSPWXOWQJBTA-JOCHJYFZSA-N 2 0 416.610 4.023 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1)c1ccccc1 ZINC000303249596 854835563 /nfs/dbraw/zinc/83/55/63/854835563.db2.gz MSKHEYPZRQLHTH-KNQAVFIVSA-N 2 0 411.565 4.283 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NCc2ccccc2C[NH+]2CCCCCC2)C1 ZINC000303473732 854969715 /nfs/dbraw/zinc/96/97/15/854969715.db2.gz HYUHWAZAJOWTSQ-JOCHJYFZSA-N 2 0 414.638 4.374 20 0 HIADRP C[C@H]1C[C@@H](N(C)C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1Cc1ccccc1 ZINC000303725053 855152593 /nfs/dbraw/zinc/15/25/93/855152593.db2.gz BUVBWRNANKAKGO-OFVILXPXSA-N 2 0 405.586 4.408 20 0 HIADRP C[C@@H]([NH2+]C1CCC(NC(=O)OC(C)(C)C)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309722475 855364522 /nfs/dbraw/zinc/36/45/22/855364522.db2.gz OGLDSAHXOGJMBA-JSFXGIFRSA-N 2 0 401.595 4.323 20 0 HIADRP C[C@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309805433 855364992 /nfs/dbraw/zinc/36/49/92/855364992.db2.gz UFGNIXHSRZCZCL-WAGURGNTSA-N 2 0 401.595 4.132 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309906948 855365341 /nfs/dbraw/zinc/36/53/41/855365341.db2.gz KRSAUYKAOCEPRC-PDGJWGCVSA-N 2 0 401.595 4.323 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(I)cc1 ZINC000319583410 855386248 /nfs/dbraw/zinc/38/62/48/855386248.db2.gz SLSCGXWPPJFCRW-UHFFFAOYSA-N 2 0 408.327 4.423 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H](C)c1cc2cc(Br)ccc2o1)N1CC[NH+](C)CC1 ZINC000326501733 855410478 /nfs/dbraw/zinc/41/04/78/855410478.db2.gz PPRNVCWZSAANMO-QAPCUYQASA-N 2 0 408.384 4.118 20 0 HIADRP CC(C)(C)OC(=O)N1CCC(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000390733181 855456194 /nfs/dbraw/zinc/45/61/94/855456194.db2.gz ZCFMVROUBWVMSE-QFIPXVFZSA-N 2 0 401.595 4.135 20 0 HIADRP C[C@H]1CC[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CN1C(=O)OC(C)(C)C ZINC000399221214 855478384 /nfs/dbraw/zinc/47/83/84/855478384.db2.gz BYXNPBRLQYBLES-UGKGYDQZSA-N 2 0 401.595 4.276 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)cc1 ZINC000410344083 855939332 /nfs/dbraw/zinc/93/93/32/855939332.db2.gz HIXXEGFBWFDCQK-RDPSFJRHSA-N 2 0 408.590 4.163 20 0 HIADRP C[C@@H]1CCC[NH+](Cc2ccc(CNC(=O)NCCCC[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC000410357901 855947548 /nfs/dbraw/zinc/94/75/48/855947548.db2.gz GLNFJVYNMUOCJT-FCHUYYIVSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC[C@H](c3ccccc3)[NH+](C)C)cc2)C1 ZINC000410359702 855949674 /nfs/dbraw/zinc/94/96/74/855949674.db2.gz OCBFSMUATRWBEU-GBXCKJPGSA-N 2 0 408.590 4.021 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000410363446 855951487 /nfs/dbraw/zinc/95/14/87/855951487.db2.gz FZPBELJEJIDWEL-RDPSFJRHSA-N 2 0 408.590 4.163 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)Nc1ccc(OCC[NH+]2CCCCC2)cc1)c1ccsc1 ZINC000426148020 856140262 /nfs/dbraw/zinc/14/02/62/856140262.db2.gz JFAVFLWQSYFUTR-NRFANRHFSA-N 2 0 416.591 4.037 20 0 HIADRP COc1ccc(CC[C@@H](C)[NH2+]Cc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1O ZINC000426357815 856258404 /nfs/dbraw/zinc/25/84/04/856258404.db2.gz FICZIQZTNRDWHC-AQNXPRMDSA-N 2 0 412.574 4.121 20 0 HIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]3CCCC3)cc1)CCS2 ZINC000427697645 856913714 /nfs/dbraw/zinc/91/37/14/856913714.db2.gz NKWSOBDJGLFYMK-QHCPKHFHSA-N 2 0 423.626 4.456 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)NCc2ccccc2C[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000428110190 857075774 /nfs/dbraw/zinc/07/57/74/857075774.db2.gz GAEJNLZKCGHPFH-BWKNWUBXSA-N 2 0 420.601 4.135 20 0 HIADRP Cn1cc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c(C(F)(F)F)n1 ZINC000428457426 857208740 /nfs/dbraw/zinc/20/87/40/857208740.db2.gz WZDCZGVOQWLERX-YSIASYRMSA-N 2 0 406.496 4.219 20 0 HIADRP Cc1noc(C[C@H]([NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c2ccccc2)n1 ZINC000429461035 857682981 /nfs/dbraw/zinc/68/29/81/857682981.db2.gz GKWGWRRCADOMRD-XQUALCHDSA-N 2 0 402.542 4.162 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(O)c3nc(C)ccc23)CC1 ZINC000429700029 857840736 /nfs/dbraw/zinc/84/07/36/857840736.db2.gz PXRNNNDVJWUYMI-SFHVURJKSA-N 2 0 422.548 4.381 20 0 HIADRP COc1ccccc1-n1nccc1C[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000430016436 857998740 /nfs/dbraw/zinc/99/87/40/857998740.db2.gz QHWHGOQDRUVVJN-UHFFFAOYSA-N 2 0 416.525 4.396 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)cc1)C1CC1 ZINC000430622276 858239180 /nfs/dbraw/zinc/23/91/80/858239180.db2.gz FGMUXCFPKOIOOX-GBXCKJPGSA-N 2 0 405.586 4.454 20 0 HIADRP Cc1cccc(C)c1OCCC[N@@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430946246 858378723 /nfs/dbraw/zinc/37/87/23/858378723.db2.gz ZZVJZKKLOZUYSN-UHFFFAOYSA-N 2 0 401.639 4.200 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCOc4c(C)cc(Cl)cc43)cn2)CC1 ZINC000431326379 858566894 /nfs/dbraw/zinc/56/68/94/858566894.db2.gz BSNOYIQRSHXNBY-OAQYLSRUSA-N 2 0 414.981 4.189 20 0 HIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1 ZINC000431333415 858570100 /nfs/dbraw/zinc/57/01/00/858570100.db2.gz OKVCPVSBJSSWIE-QHCPKHFHSA-N 2 0 423.605 4.006 20 0 HIADRP C[N@@H+]1CCCC[C@H]1CCC(=O)N1CCC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000431630524 858700285 /nfs/dbraw/zinc/70/02/85/858700285.db2.gz LJKZEUDTBLCHBL-FQEVSTJZSA-N 2 0 411.512 4.004 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000431674337 858731414 /nfs/dbraw/zinc/73/14/14/858731414.db2.gz DBYKWSFYJWRMQE-BWKNWUBXSA-N 2 0 422.617 4.333 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2CNc2cccc3c2OCC[C@@H]3[NH+](C)C)CC1 ZINC000433174243 859553790 /nfs/dbraw/zinc/55/37/90/859553790.db2.gz KNJWFWBFRRLLBM-DEOSSOPVSA-N 2 0 408.590 4.216 20 0 HIADRP CSc1ccc([C@@H](C)[NH2+]CC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)cc1 ZINC000433204759 859565950 /nfs/dbraw/zinc/56/59/50/859565950.db2.gz APUOJCMHBQSXNP-LJQANCHMSA-N 2 0 411.615 4.148 20 0 HIADRP O=C(CN1CCC(c2ncc3n2CCCC3)CC1)Nc1nc(-c2ccccc2)cs1 ZINC000434745054 860478673 /nfs/dbraw/zinc/47/86/73/860478673.db2.gz JILJNVXBXNZKOD-UHFFFAOYSA-N 2 0 421.570 4.161 20 0 HIADRP Cc1ccc(NC(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)c(OCC[NH+](C)C)c1 ZINC000438296366 863775177 /nfs/dbraw/zinc/77/51/77/863775177.db2.gz DANRRYQTSQZWNA-RTWAWAEBSA-N 2 0 416.610 4.054 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](c2ccc(Br)s2)C2CC2)C1 ZINC000439137632 864570875 /nfs/dbraw/zinc/57/08/75/864570875.db2.gz BAHAHZLAFTWPNW-FXAWDEMLSA-N 2 0 421.404 4.318 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H](c2ccc(Br)s2)C2CC2)ccn1 ZINC000439138354 864571323 /nfs/dbraw/zinc/57/13/23/864571323.db2.gz VCDJAEBNRTWPEM-SFHVURJKSA-N 2 0 410.381 4.087 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2cccc(-c3ccncc3)c2)[C@@H](c2ccccc2)C1 ZINC000439466171 864842812 /nfs/dbraw/zinc/84/28/12/864842812.db2.gz GWWAIWNWRUHSGJ-AREMUKBSSA-N 2 0 400.570 4.217 20 0 HIADRP Cc1ccc(NC(=O)[C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)cc1F ZINC000439592800 864914794 /nfs/dbraw/zinc/91/47/94/864914794.db2.gz HVKHEVJIPCZBEC-SFHVURJKSA-N 2 0 409.505 4.476 20 0 HIADRP Cc1ccc(F)cc1NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000439608689 864930704 /nfs/dbraw/zinc/93/07/04/864930704.db2.gz BABPMSYVXKQKFH-SFHVURJKSA-N 2 0 409.505 4.476 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(Cl)c(Cl)cc1F ZINC000439967319 865259145 /nfs/dbraw/zinc/25/91/45/865259145.db2.gz NMTVQDWGMXPFIA-CYBMUJFWSA-N 2 0 405.345 4.012 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](CC(C)C)[NH2+][C@H](C)c2ccccc2)C[C@@H]1C ZINC000468025568 881859756 /nfs/dbraw/zinc/85/97/56/881859756.db2.gz IZUFQEQHUOIBMT-MQFRRQCYSA-N 2 0 402.627 4.266 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc3cc(Br)ccc3[nH]2)[C@@H](C)C1 ZINC000468049643 881875717 /nfs/dbraw/zinc/87/57/17/881875717.db2.gz OSNOLZISIKFKBI-KXBFYZLASA-N 2 0 408.384 4.157 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+]Cc2ccc(-c3ccccc3Br)s2)CC1(C)C ZINC000441369045 866438123 /nfs/dbraw/zinc/43/81/23/866438123.db2.gz MGMHKDKALLHKTI-UHFFFAOYSA-N 2 0 422.436 4.293 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2Cc3[nH]c4ccccc4c3C2)cc1OC ZINC000442711977 867642931 /nfs/dbraw/zinc/64/29/31/867642931.db2.gz FUUURONKRBBZJB-LJQANCHMSA-N 2 0 407.558 4.154 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1(C)C ZINC000442864809 867704645 /nfs/dbraw/zinc/70/46/45/867704645.db2.gz DOJPQOJXOHMDID-DEOSSOPVSA-N 2 0 406.549 4.079 20 0 HIADRP C[C@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)NCCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000443693038 868292646 /nfs/dbraw/zinc/29/26/46/868292646.db2.gz LLTCJDVIYLBTRS-DHLKQENFSA-N 2 0 422.617 4.061 20 0 HIADRP C[C@H](CCc1ccc(Cl)s1)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000468427223 882370104 /nfs/dbraw/zinc/37/01/04/882370104.db2.gz IRIXIDPOEMYGAY-APWZRJJASA-N 2 0 420.022 4.210 20 0 HIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(Br)cc1F ZINC000446843689 870763333 /nfs/dbraw/zinc/76/33/33/870763333.db2.gz OUOFZUDSOYWTSC-INIZCTEOSA-N 2 0 412.391 4.189 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)c1 ZINC000447534814 871399531 /nfs/dbraw/zinc/39/95/31/871399531.db2.gz AESBXRWVPWJMJR-RUZDIDTESA-N 2 0 419.544 4.191 20 0 HIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](NC[C@H]2C[NH+](Cc4ccccc4)CCCO2)C3)cc1 ZINC000447595503 871500214 /nfs/dbraw/zinc/50/02/14/871500214.db2.gz NYNXLSNGXVXRKC-XUJYPJAKSA-N 2 0 419.613 4.063 20 0 HIADRP C[C@H](CC[NH+]1CCC(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000447732885 871681586 /nfs/dbraw/zinc/68/15/86/871681586.db2.gz YQPBFWNJXIIRIE-JOCHJYFZSA-N 2 0 407.602 4.140 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000448208916 872106553 /nfs/dbraw/zinc/10/65/53/872106553.db2.gz MDRQRTONBNXOMH-ILBGXUMGSA-N 2 0 424.633 4.221 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000448212824 872114376 /nfs/dbraw/zinc/11/43/76/872114376.db2.gz MAYJSLSHJLKBNP-ZCYQVOJMSA-N 2 0 424.633 4.221 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC(CC)(CC)[NH2+][C@H](C)c2ccccc2)[C@H](C)C1 ZINC000448524979 872520757 /nfs/dbraw/zinc/52/07/57/872520757.db2.gz MQSVKSAOWQZFOX-SJBKTWHCSA-N 2 0 402.627 4.268 20 0 HIADRP CC[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cccc(Cl)c1F ZINC000461105526 874025169 /nfs/dbraw/zinc/02/51/69/874025169.db2.gz XQXMVHNJFGBHSP-NQIIRXRSSA-N 2 0 417.956 4.417 20 0 HIADRP CC[NH+](CC)CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)C1CC[NH+](C)CC1 ZINC000468707652 882823152 /nfs/dbraw/zinc/82/31/52/882823152.db2.gz ACIGTRMWSSIFAV-UHFFFAOYSA-N 2 0 400.394 4.006 20 0 HIADRP O=C(NC[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccc(C[NH+]2CCCC2)cc1 ZINC000461469246 874525772 /nfs/dbraw/zinc/52/57/72/874525772.db2.gz WCAJIZRMUBUYLV-XMMPIXPASA-N 2 0 405.586 4.315 20 0 HIADRP CC(C)[NH+]1CCC(C(=O)N(CCC[NH+](C)C)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000461984835 875103363 /nfs/dbraw/zinc/10/33/63/875103363.db2.gz HASAGAVGUXDPBG-UHFFFAOYSA-N 2 0 414.421 4.394 20 0 HIADRP CC[NH+]1CCN(c2ccc(NC(=O)[C@H]3CCCC[N@@H+]3Cc3ccccc3)c(C)c2)CC1 ZINC000462046056 875158493 /nfs/dbraw/zinc/15/84/93/875158493.db2.gz RBMGHQATSHRIET-RUZDIDTESA-N 2 0 420.601 4.130 20 0 HIADRP CC1CC[NH+](CCC[C@@H]([NH2+]C2CCC(S(C)(=O)=O)CC2)c2ccc(F)cc2)CC1 ZINC000462807313 875852852 /nfs/dbraw/zinc/85/28/52/875852852.db2.gz AJSBEUPPBOBLKH-XPPIMPSXSA-N 2 0 424.626 4.324 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(OC(C)(C)C)cc1 ZINC000463027038 876046368 /nfs/dbraw/zinc/04/63/68/876046368.db2.gz BTWNPUICHVKBJC-WMZHIEFXSA-N 2 0 423.601 4.412 20 0 HIADRP C[C@H]1C[C@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)CCN1Cc1ccccc1 ZINC000463074210 876105866 /nfs/dbraw/zinc/10/58/66/876105866.db2.gz AWIDDDGQLFGCAO-AZGAKELHSA-N 2 0 420.645 4.232 20 0 HIADRP COc1ccc(Cn2nc(C)c(C[NH2+]Cc3ccc(F)c(C[NH+](C)C)c3)c2C)cc1 ZINC000463740851 876862085 /nfs/dbraw/zinc/86/20/85/876862085.db2.gz WGMPULPLAFDORH-UHFFFAOYSA-N 2 0 410.537 4.047 20 0 HIADRP CC1(C)[C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)C[C@@H]1c1ccccc1 ZINC000464093828 877248810 /nfs/dbraw/zinc/24/88/10/877248810.db2.gz QDUJILCWUGNSTP-RBZQAINGSA-N 2 0 405.586 4.056 20 0 HIADRP C[N@H+](C[C@H](O)COc1cccc2ccccc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464843174 878114257 /nfs/dbraw/zinc/11/42/57/878114257.db2.gz QWVSMVVRDPIBSS-VWNXMTODSA-N 2 0 404.554 4.033 20 0 HIADRP C[N@H+](C[C@@H](O)COc1cc(Cl)ccc1Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464848688 878124129 /nfs/dbraw/zinc/12/41/29/878124129.db2.gz MTSYVHKCWKLJHE-AZUAARDMSA-N 2 0 423.384 4.187 20 0 HIADRP CCc1ccc(-c2ccc(C[NH2+]Cc3ccc(N4CC[NH+](CC)CC4)nc3)o2)cc1 ZINC000465010183 878369833 /nfs/dbraw/zinc/36/98/33/878369833.db2.gz HBWOLANSJZSQSB-UHFFFAOYSA-N 2 0 404.558 4.336 20 0 HIADRP CCc1ccc([C@@H](CNC(=O)N(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)[NH+](C)C)cc1 ZINC000465427304 878858039 /nfs/dbraw/zinc/85/80/39/878858039.db2.gz DXJDCVQTQUTCQJ-UKILVPOCSA-N 2 0 422.617 4.015 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)c2cccs2)CC1 ZINC000465435749 878868440 /nfs/dbraw/zinc/86/84/40/878868440.db2.gz SXNIHNKBYUHILH-WOJBJXKFSA-N 2 0 406.640 4.037 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)N(C)CC[C@@H]3CCCC[N@@H+]3C)cc2)C1 ZINC000465518992 878967051 /nfs/dbraw/zinc/96/70/51/878967051.db2.gz FORTZINZSBOOBD-LGVFNWMJSA-N 2 0 414.638 4.180 20 0 HIADRP C[N@H+](CCCNC(=O)NC[C@H]1CCC[NH+](C)[C@H]1c1cccs1)C1CCCCC1 ZINC000465541852 879002543 /nfs/dbraw/zinc/00/25/43/879002543.db2.gz MMPSRBABCYNGMW-WIYYLYMNSA-N 2 0 406.640 4.085 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CNC(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000465567226 879040936 /nfs/dbraw/zinc/04/09/36/879040936.db2.gz IFUNQVKAGFBKGM-DEOSSOPVSA-N 2 0 420.601 4.233 20 0 HIADRP CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000465574379 879050246 /nfs/dbraw/zinc/05/02/46/879050246.db2.gz PXLRYLZRFYZWKQ-XMMPIXPASA-N 2 0 422.617 4.431 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)C1 ZINC000503426251 912422546 /nfs/dbraw/zinc/42/25/46/912422546.db2.gz NAQXDKARDKYJQM-AOHZBQACSA-N 2 0 412.622 4.120 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@H](c1ccc(C)cc1)[NH+](C)C ZINC000465817087 879440092 /nfs/dbraw/zinc/44/00/92/879440092.db2.gz ORPHINXACFAAPT-UKILVPOCSA-N 2 0 422.617 4.151 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)c1ccsc1 ZINC000503446328 912468487 /nfs/dbraw/zinc/46/84/87/912468487.db2.gz KONPSKBPWLTRCG-RBBKRZOGSA-N 2 0 420.667 4.285 20 0 HIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@@H]2CCC[NH+](C)[C@@H]2c2cccs2)C1 ZINC000465897123 879554478 /nfs/dbraw/zinc/55/44/78/879554478.db2.gz QIZZNDDSWYKQKN-DYXWJJEUSA-N 2 0 420.667 4.331 20 0 HIADRP CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000465910482 879571562 /nfs/dbraw/zinc/57/15/62/879571562.db2.gz NFHRFPIUOGQZRK-NRFANRHFSA-N 2 0 421.029 4.068 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)C1 ZINC000465927799 879591479 /nfs/dbraw/zinc/59/14/79/879591479.db2.gz QASLJLWGRRILOA-LEWJYISDSA-N 2 0 400.611 4.023 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000503453401 912477037 /nfs/dbraw/zinc/47/70/37/912477037.db2.gz ORTXCZXPXKMYJL-XMMPIXPASA-N 2 0 414.638 4.182 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@H](C)c1cccc(Cl)c1Cl ZINC000465981046 879652775 /nfs/dbraw/zinc/65/27/75/879652775.db2.gz GEECFUXYAJJLJR-CVEARBPZSA-N 2 0 415.409 4.112 20 0 HIADRP CCCN(C(=O)NCCC1CC[NH+](CC)CC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000466089911 879809234 /nfs/dbraw/zinc/80/92/34/879809234.db2.gz ABCSWELDIQIVOG-DEOSSOPVSA-N 2 0 414.638 4.195 20 0 HIADRP Brc1ccc(/C=C\CC[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000466917904 880686207 /nfs/dbraw/zinc/68/62/07/880686207.db2.gz HAWQNBKKIYBONX-KTAJNNJTSA-N 2 0 407.396 4.429 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NCc2ccc(CC[NH+](C)C)cc2)C1 ZINC000466976247 880779138 /nfs/dbraw/zinc/77/91/38/880779138.db2.gz UEGZXJOXGAGLFQ-NRFANRHFSA-N 2 0 422.617 4.022 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CCS2 ZINC000467422236 881210990 /nfs/dbraw/zinc/21/09/90/881210990.db2.gz ZJOVUSCPFSVAAN-IERDGZPVSA-N 2 0 415.578 4.474 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2ccc(-c3ccccc3)cc2F)cc1 ZINC000503575773 912655774 /nfs/dbraw/zinc/65/57/74/912655774.db2.gz JRMDJEFBFSDOCK-UHFFFAOYSA-N 2 0 405.517 4.074 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CCN(C(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC1 ZINC000469370917 883495375 /nfs/dbraw/zinc/49/53/75/883495375.db2.gz HCNVUHIYRIWFPO-UHFFFAOYSA-N 2 0 414.553 4.231 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](NCc2ccc(Br)c(Cl)c2)[C@H](C)C1 ZINC000469765941 883935963 /nfs/dbraw/zinc/93/59/63/883935963.db2.gz CUNQDNOCAPPVSN-KDOFPFPSSA-N 2 0 403.792 4.329 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC(C[NH+]2CCCC2)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000503743197 912813570 /nfs/dbraw/zinc/81/35/70/912813570.db2.gz WTTBWBLXEFLOIT-NRFANRHFSA-N 2 0 414.638 4.413 20 0 HIADRP CC(C)[NH+](CCCNC(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000470493555 884880463 /nfs/dbraw/zinc/88/04/63/884880463.db2.gz LFFWKFNSDMSTPR-JTHBVZDNSA-N 2 0 402.627 4.190 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000470756462 885222374 /nfs/dbraw/zinc/22/23/74/885222374.db2.gz OYWGAJLFSCOLNE-JOCHJYFZSA-N 2 0 420.601 4.043 20 0 HIADRP Cc1c([C@@H](C)[NH2+][C@H](C)CCN2CC[NH+](C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000471592750 886304566 /nfs/dbraw/zinc/30/45/66/886304566.db2.gz GPHWMTRWZSHZMM-HZPDHXFCSA-N 2 0 424.420 4.164 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000471895061 886677507 /nfs/dbraw/zinc/67/75/07/886677507.db2.gz ILNROOHBLFUJNM-FYYLOGMGSA-N 2 0 420.601 4.033 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NCc1cccc(C[NH+](C)C)c1)c1ccccc1Cl ZINC000504205367 913084235 /nfs/dbraw/zinc/08/42/35/913084235.db2.gz RQEFYKCZFUDTKS-JOCHJYFZSA-N 2 0 416.997 4.284 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)CC1 ZINC000504216859 913093979 /nfs/dbraw/zinc/09/39/79/913093979.db2.gz ZTCYWLWDRALVTB-UHFFFAOYSA-N 2 0 422.617 4.179 20 0 HIADRP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000472149586 886949119 /nfs/dbraw/zinc/94/91/19/886949119.db2.gz AAURFGKPMJHLMT-UHFFFAOYSA-N 2 0 420.395 4.215 20 0 HIADRP CCN(C(=O)NC1CC[NH+](C2CCCC2)CC1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473740207 888521511 /nfs/dbraw/zinc/52/15/11/888521511.db2.gz POPPFNSLYGMSCM-YKSBVNFPSA-N 2 0 412.622 4.260 20 0 HIADRP CCN(C(=O)NCc1ccc(C[NH+](C)C)cc1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473875460 888736764 /nfs/dbraw/zinc/73/67/64/888736764.db2.gz NQJOQKMHCCLYJQ-GBXCKJPGSA-N 2 0 408.590 4.115 20 0 HIADRP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3ccc(Cl)cc3-n3cncn3)c2)CC1 ZINC000474720460 889577509 /nfs/dbraw/zinc/57/75/09/889577509.db2.gz QHCUYHWDCKYSEM-UHFFFAOYSA-N 2 0 409.965 4.442 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000475109692 889958744 /nfs/dbraw/zinc/95/87/44/889958744.db2.gz AARHCMFOWTVDJU-OFVILXPXSA-N 2 0 420.601 4.128 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475279152 890174222 /nfs/dbraw/zinc/17/42/22/890174222.db2.gz KZAWCZRQOACHBG-PKOBYXMFSA-N 2 0 415.965 4.177 20 0 HIADRP C[C@H]1CCC[C@@H]([NH+]2CCC(NC3CC([NH+]4CCC(C(F)(F)F)CC4)C3)CC2)C1 ZINC000475353760 890277938 /nfs/dbraw/zinc/27/79/38/890277938.db2.gz LGRPHFUPNOSBCH-FZQMEJGWSA-N 2 0 401.561 4.424 20 0 HIADRP C[NH+](C)[C@@H](CNc1cc(NC[C@@H](c2ccsc2)[NH+](C)C)ncn1)c1ccsc1 ZINC000475451941 890366762 /nfs/dbraw/zinc/36/67/62/890366762.db2.gz LFWJLYHKHIUMFJ-ROUUACIJSA-N 2 0 416.620 4.029 20 0 HIADRP CCc1c(C)[nH+]c2ccccc2c1N1CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC1 ZINC000477118139 892047773 /nfs/dbraw/zinc/04/77/73/892047773.db2.gz VEPJAMXDVSHVLN-UHFFFAOYSA-N 2 0 410.606 4.026 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCc4cc(OC)c(OC)cc43)CC2)cc1 ZINC000479075756 894339778 /nfs/dbraw/zinc/33/97/78/894339778.db2.gz YGHIUKHISZDSQY-QHCPKHFHSA-N 2 0 410.558 4.202 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccccc1)c1ccc(Br)cc1 ZINC000479298928 894583031 /nfs/dbraw/zinc/58/30/31/894583031.db2.gz WYELCMBPHRLNAR-VXKWHMMOSA-N 2 0 417.391 4.365 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CC(C)(C)c3ccc(Br)cc32)CC1 ZINC000479329676 894621458 /nfs/dbraw/zinc/62/14/58/894621458.db2.gz HABIAPIXNRZDHC-HXUWFJFHSA-N 2 0 408.428 4.179 20 0 HIADRP COc1cc2c(cc1OC)[C@@H]([NH2+]Cc1ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc1)CC2 ZINC000479360654 894660616 /nfs/dbraw/zinc/66/06/16/894660616.db2.gz MRZLVVXORPHWBI-IXFSTUDKSA-N 2 0 410.558 4.090 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)N1CCC(CC[NH+]2CCCC[C@@H]2C)CC1 ZINC000479436160 894750326 /nfs/dbraw/zinc/75/03/26/894750326.db2.gz IYDLCJYQENUQPG-YADHBBJMSA-N 2 0 406.659 4.327 20 0 HIADRP COc1cc([C@H](C)[NH2+]C2CC(N3CCC(C(F)(F)F)CC3)C2)cc(OC)c1OC ZINC000479482173 894804592 /nfs/dbraw/zinc/80/45/92/894804592.db2.gz XOUUQDFBTGSVGK-IGEOTXOUSA-N 2 0 416.484 4.168 20 0 HIADRP C[C@@H]([NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(N2CCCC2=O)c1 ZINC000479486292 894808135 /nfs/dbraw/zinc/80/81/35/894808135.db2.gz HQEYCIWXQNZGLE-MYWSLZCHSA-N 2 0 409.496 4.269 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CCc1cccc(OCC(F)(F)F)c1 ZINC000479523531 894832910 /nfs/dbraw/zinc/83/29/10/894832910.db2.gz QFTZMXPDGBGQGO-UWJYYQICSA-N 2 0 407.480 4.065 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(-n2cccn2)cc1 ZINC000480231693 895635958 /nfs/dbraw/zinc/63/59/58/895635958.db2.gz SQHSPVAZEQIEBA-HBMCJLEFSA-N 2 0 404.558 4.332 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(-n2ccnc2)cc1 ZINC000480232580 895638905 /nfs/dbraw/zinc/63/89/05/895638905.db2.gz OQDZSCFBWJKNTQ-HBMCJLEFSA-N 2 0 404.558 4.332 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)[C@H](C)C1 ZINC000480264570 895671957 /nfs/dbraw/zinc/67/19/57/895671957.db2.gz VYOQRNKDZWEXQJ-RDGATRHJSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000480270268 895678856 /nfs/dbraw/zinc/67/88/56/895678856.db2.gz YSPOHEQQELIMSW-SFHVURJKSA-N 2 0 400.588 4.315 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1OC(F)F)N1CC[NH+](C)CC1 ZINC000480548649 895908764 /nfs/dbraw/zinc/90/87/64/895908764.db2.gz JYESSODGDGPCHV-UTKZUKDTSA-N 2 0 405.533 4.364 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1OC(F)F)N1CC[NH+](C)CC1 ZINC000480548653 895909022 /nfs/dbraw/zinc/90/90/22/895909022.db2.gz JYESSODGDGPCHV-UWJYYQICSA-N 2 0 405.533 4.364 20 0 HIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480603286 895968306 /nfs/dbraw/zinc/96/83/06/895968306.db2.gz DYLALQFQOPOLPH-NHCUHLMSSA-N 2 0 421.651 4.166 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000480638102 896006846 /nfs/dbraw/zinc/00/68/46/896006846.db2.gz HJGOIEWUYCCRQI-ZIAGYGMSSA-N 2 0 411.434 4.401 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480693323 896056301 /nfs/dbraw/zinc/05/63/01/896056301.db2.gz BJBOUHQZZDKCEC-ZWKOTPCHSA-N 2 0 410.562 4.323 20 0 HIADRP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1 ZINC000480694572 896056374 /nfs/dbraw/zinc/05/63/74/896056374.db2.gz HDXPOZXZKMZPKW-QGZVFWFLSA-N 2 0 402.970 4.126 20 0 HIADRP Cc1ccc(OCCCC(=O)Nc2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H](C)C3)cc2)cc1 ZINC000480708232 896070208 /nfs/dbraw/zinc/07/02/08/896070208.db2.gz IKRXTEBKNJUQKC-NFBKMPQASA-N 2 0 409.574 4.365 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2C[NH2+]C2CCN(Cc3ccccn3)CC2)C1 ZINC000480718381 896079703 /nfs/dbraw/zinc/07/97/03/896079703.db2.gz OBSRZIUBOHISLZ-VXKWHMMOSA-N 2 0 406.618 4.314 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccc(OC(F)F)cc1 ZINC000480728335 896088809 /nfs/dbraw/zinc/08/88/09/896088809.db2.gz LTMJGYWVMSJBMB-FQEVSTJZSA-N 2 0 404.505 4.066 20 0 HIADRP Cc1ccccc1OCCCC(=O)Nc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000480741148 896102393 /nfs/dbraw/zinc/10/23/93/896102393.db2.gz RJZSEZABISQPNC-OFNKIYASSA-N 2 0 409.574 4.365 20 0 HIADRP CC(C)(C)C(=O)N1CCC(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)CC1 ZINC000480846887 896217567 /nfs/dbraw/zinc/21/75/67/896217567.db2.gz UAUWKKRSAGTPMT-UHFFFAOYSA-N 2 0 411.634 4.259 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1cccc(NC(=O)C2CCCC2)c1 ZINC000480886088 896242063 /nfs/dbraw/zinc/24/20/63/896242063.db2.gz XHBFMQULRZQXFV-CYFREDJKSA-N 2 0 406.574 4.211 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000480904238 896259457 /nfs/dbraw/zinc/25/94/57/896259457.db2.gz FIKCEFFOAYEFJJ-SFHVURJKSA-N 2 0 421.614 4.112 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(-c2ccncc2)cc1 ZINC000480907206 896263035 /nfs/dbraw/zinc/26/30/35/896263035.db2.gz INFIUOIGZBXCCJ-OAQYLSRUSA-N 2 0 400.570 4.347 20 0 HIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2sc(Cc3ccc(OC)c(OC)c3)nc2C)C1 ZINC000481019862 896349628 /nfs/dbraw/zinc/34/96/28/896349628.db2.gz GLDYHDHULKXKDO-VQIMIIECSA-N 2 0 417.619 4.442 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCCOc3ccc(Br)cc32)c1 ZINC000481303306 896648829 /nfs/dbraw/zinc/64/88/29/896648829.db2.gz FGJWGLOLXOYASL-FQEVSTJZSA-N 2 0 419.363 4.393 20 0 HIADRP C[C@H]([NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000481302764 896648890 /nfs/dbraw/zinc/64/88/90/896648890.db2.gz DQJMCYSULZIRSD-SFHVURJKSA-N 2 0 417.544 4.220 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(I)cc1 ZINC000481327775 896685767 /nfs/dbraw/zinc/68/57/67/896685767.db2.gz MMFFMJRYPFYBHG-HNNXBMFYSA-N 2 0 424.326 4.082 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)[C@@H](C)C1 ZINC000481727181 897121773 /nfs/dbraw/zinc/12/17/73/897121773.db2.gz PGVVRCSEDPNYQT-WIOPSUGQSA-N 3 0 401.639 4.289 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000481731199 897125741 /nfs/dbraw/zinc/12/57/41/897125741.db2.gz BWLZKQDBPQYKMJ-LJQANCHMSA-N 2 0 415.603 4.285 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc4c(c3)C(C)(C)C(=O)N4)CC2)cc1 ZINC000481732637 897127719 /nfs/dbraw/zinc/12/77/19/897127719.db2.gz FTKFUYIKVDWQLI-GOSISDBHSA-N 2 0 421.585 4.488 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCN(c3cc(Cl)ccc3C)C2)[C@@H](C)C1 ZINC000482090961 897534026 /nfs/dbraw/zinc/53/40/26/897534026.db2.gz TXVOIWDGTHBMOS-VWPQPMDRSA-N 2 0 408.030 4.201 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(Br)cc3cccnc32)[C@@H](C)C1 ZINC000482140727 897600293 /nfs/dbraw/zinc/60/02/93/897600293.db2.gz SUXFGXAJDHNECU-OXJNMPFZSA-N 2 0 420.395 4.224 20 0 HIADRP Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1cccc(OCC[N@@H+](C)C2CCOCC2)c1 ZINC000482273041 897759794 /nfs/dbraw/zinc/75/97/94/897759794.db2.gz VVJLVLFGPVVMEK-VWLOTQADSA-N 2 0 424.585 4.488 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(OCc2nccn2C)cc1 ZINC000482445361 898008377 /nfs/dbraw/zinc/00/83/77/898008377.db2.gz JGJGQKXGRQTZLF-GMAHTHKFSA-N 2 0 418.585 4.214 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000482483036 898060877 /nfs/dbraw/zinc/06/08/77/898060877.db2.gz IMXABRNKNRIDJU-YJBOKZPZSA-N 2 0 400.394 4.070 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](C)c2sc(-c3ccc(C)cc3)nc2C)CC1 ZINC000482496577 898077947 /nfs/dbraw/zinc/07/79/47/898077947.db2.gz QNZHVYGLKZVTMA-RBUKOAKNSA-N 2 0 400.636 4.351 20 0 HIADRP C[C@H](C[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)CN1CC[NH+](C)CC1 ZINC000482502266 898084530 /nfs/dbraw/zinc/08/45/30/898084530.db2.gz COSYQZWMJRJDQL-APWZRJJASA-N 2 0 419.038 4.314 20 0 HIADRP CCc1nc2c(s1)[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CCC2 ZINC000482529104 898116649 /nfs/dbraw/zinc/11/66/49/898116649.db2.gz APYLSIFSBQFYSS-QAPCUYQASA-N 2 0 402.583 4.325 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482539407 898126699 /nfs/dbraw/zinc/12/66/99/898126699.db2.gz ACOTTYNADAQZPF-RBUKOAKNSA-N 2 0 407.537 4.175 20 0 HIADRP COc1ccc(Cc2nc(C)c([C@@H](C)[NH2+]CC3CC[NH+](C)CC3)s2)cc1OC ZINC000482543920 898133115 /nfs/dbraw/zinc/13/31/15/898133115.db2.gz OMJVRKZPLHNYBM-OAHLLOKOSA-N 2 0 403.592 4.052 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1N(C)C)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482544596 898133390 /nfs/dbraw/zinc/13/33/90/898133390.db2.gz TWIHJUWWCWQNJA-DLBZAZTESA-N 2 0 402.533 4.194 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(F)cc1N(C)C ZINC000482544601 898133538 /nfs/dbraw/zinc/13/35/38/898133538.db2.gz TWIHJUWWCWQNJA-SJORKVTESA-N 2 0 402.533 4.194 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)[C@@H](C)C1 ZINC000482551514 898141404 /nfs/dbraw/zinc/14/14/04/898141404.db2.gz CWRGKUSDQKFIRM-DHLKQENFSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccccc1Br ZINC000482552037 898141478 /nfs/dbraw/zinc/14/14/78/898141478.db2.gz DXDYGIKXCYRHBG-INIZCTEOSA-N 2 0 403.364 4.257 20 0 HIADRP C[C@H](NC1CC[NH+](C2CCCCC2)CC1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000482556210 898147497 /nfs/dbraw/zinc/14/74/97/898147497.db2.gz IINSNIUPQKYATJ-IBGZPJMESA-N 2 0 402.602 4.025 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCCO3)CC1 ZINC000482558131 898149433 /nfs/dbraw/zinc/14/94/33/898149433.db2.gz MSCAHIYKILRZCT-MSOLQXFVSA-N 2 0 413.537 4.151 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2ccc(OC)cc2OC)CC1 ZINC000482570415 898165407 /nfs/dbraw/zinc/16/54/07/898165407.db2.gz WNNIAMORQMADQT-ZWKOTPCHSA-N 2 0 415.553 4.397 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(-c2ccccc2Br)s1 ZINC000482633006 898236534 /nfs/dbraw/zinc/23/65/34/898236534.db2.gz GTHAFIUHTMJIQJ-JKSUJKDBSA-N 2 0 422.436 4.464 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cc2c(s1)CCCC2 ZINC000482648947 898253874 /nfs/dbraw/zinc/25/38/74/898253874.db2.gz GOJQZFMSWBNHAR-DYESRHJHSA-N 2 0 411.615 4.175 20 0 HIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccc(N2CCOCC2)c1 ZINC000482884738 898499433 /nfs/dbraw/zinc/49/94/33/898499433.db2.gz KRKISHSDDYNYFN-ZZMXOZIFSA-N 2 0 405.586 4.369 20 0 HIADRP C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000483247676 898890127 /nfs/dbraw/zinc/89/01/27/898890127.db2.gz OQBGZEUZUZGAHH-NRFANRHFSA-N 2 0 420.601 4.026 20 0 HIADRP CN(C(=O)NCc1ccccc1C[NH+](C)C1CCCCC1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000483251859 898894353 /nfs/dbraw/zinc/89/43/53/898894353.db2.gz JILBATDKNZIJEZ-VSGJHWFKSA-N 2 0 412.622 4.218 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](c2cccs2)[NH+]2CCC(C)CC2)C[C@H]1C ZINC000483518620 899179222 /nfs/dbraw/zinc/17/92/22/899179222.db2.gz MYIFGNCHWWFXTQ-HSALFYBXSA-N 2 0 406.640 4.035 20 0 HIADRP O=C([C@@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000483603884 899254463 /nfs/dbraw/zinc/25/44/63/899254463.db2.gz FVLSTDWREIBWLZ-JBRSBNLGSA-N 2 0 409.618 4.154 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000483720663 899381304 /nfs/dbraw/zinc/38/13/04/899381304.db2.gz GKAYMDVMVAVKID-QFQXNSOFSA-N 2 0 418.585 4.307 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@@H]2CCc3cc(F)ccc32)CC1 ZINC000483722512 899382370 /nfs/dbraw/zinc/38/23/70/899382370.db2.gz HOYCDPZYPNLZNP-HXUWFJFHSA-N 2 0 407.455 4.373 20 0 HIADRP CC(C)n1cc([C@@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cn1 ZINC000483747889 899411778 /nfs/dbraw/zinc/41/17/78/899411778.db2.gz VXKHRUHKQWTEDA-MRXNPFEDSA-N 2 0 409.500 4.085 20 0 HIADRP C[C@H]([NH2+]C1(CN[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CCOCC1)c1ccccc1 ZINC000484135994 899756470 /nfs/dbraw/zinc/75/64/70/899756470.db2.gz BFEFYVZSDXPVJW-UMFSSWHCSA-N 2 0 421.629 4.387 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+][C@H](Cc2cccc(F)c2)c2ccc(Cl)c(Cl)c2)CC1 ZINC000484146427 899766940 /nfs/dbraw/zinc/76/69/40/899766940.db2.gz NSTZQLJGXIYRJJ-HXUWFJFHSA-N 2 0 411.348 4.463 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000484480839 899973283 /nfs/dbraw/zinc/97/32/83/899973283.db2.gz ADCNHILZVIHEGC-JOCHJYFZSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@H](NC(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000485398661 900695552 /nfs/dbraw/zinc/69/55/52/900695552.db2.gz BYRVPEPVJIBVJM-FTBPSBKWSA-N 2 0 420.601 4.033 20 0 HIADRP O=C(CC[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1)Nc1ccc(OCc2ccccc2)cc1 ZINC000485672495 900922751 /nfs/dbraw/zinc/92/27/51/900922751.db2.gz KXNXEDIVYJDUGU-JOCHJYFZSA-N 2 0 407.558 4.012 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000485781535 901036204 /nfs/dbraw/zinc/03/62/04/901036204.db2.gz YORFPRVLDQZCPP-KSEOMHKRSA-N 2 0 400.611 4.022 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccc2ncsc2c1 ZINC000485837050 901082987 /nfs/dbraw/zinc/08/29/87/901082987.db2.gz ZMWZFUSCFUMNFG-MSOLQXFVSA-N 2 0 422.598 4.116 20 0 HIADRP C[C@@H]([NH2+]Cc1cnc2ccc(Br)cn12)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486505719 901657406 /nfs/dbraw/zinc/65/74/06/901657406.db2.gz MOPLPIFBCGTQOX-AEFFLSMTSA-N 2 0 413.363 4.097 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000505919633 914565622 /nfs/dbraw/zinc/56/56/22/914565622.db2.gz TXDJLMYFVZTVTH-AKIFATBCSA-N 2 0 415.597 4.151 20 0 HIADRP FC(F)(F)c1cccc(N2CC[NH+](CCCC[NH2+]C/C=C/c3ccncc3)CC2)c1 ZINC000486965981 901992076 /nfs/dbraw/zinc/99/20/76/901992076.db2.gz KWTYPLZLJRHGOQ-SNAWJCMRSA-N 2 0 418.507 4.306 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+]([C@@H]2CCc3c2cccc3Cl)CC1 ZINC000487811668 902380963 /nfs/dbraw/zinc/38/09/63/902380963.db2.gz WYPNNGZJQSINDK-JOCHJYFZSA-N 2 0 403.998 4.032 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](CC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)CC1 ZINC000488282954 902745130 /nfs/dbraw/zinc/74/51/30/902745130.db2.gz RVGSKZOZBSHTLG-AREMUKBSSA-N 2 0 419.613 4.215 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)c1)C1CCOCC1 ZINC000488443358 902828697 /nfs/dbraw/zinc/82/86/97/902828697.db2.gz URTKWPPVKNQCBG-UGKGYDQZSA-N 2 0 406.636 4.186 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2csc(-c3ccc4c(c3)OCO4)n2)C1 ZINC000488539465 902874942 /nfs/dbraw/zinc/87/49/42/902874942.db2.gz KCKYVWPZJOZKBX-CALCHBBNSA-N 2 0 401.576 4.387 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488580505 902891259 /nfs/dbraw/zinc/89/12/59/902891259.db2.gz KVJCUAYMWPGAEE-PXDATVDWSA-N 2 0 422.617 4.190 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)CC1 ZINC000488692259 902946577 /nfs/dbraw/zinc/94/65/77/902946577.db2.gz ITXZNBQPJUHKDE-HSZRJFAPSA-N 2 0 423.576 4.161 20 0 HIADRP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)CCCO2 ZINC000489483347 903413620 /nfs/dbraw/zinc/41/36/20/903413620.db2.gz PCLCXGHXPTZCLA-FQEVSTJZSA-N 2 0 422.013 4.078 20 0 HIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]CCCC[NH+]1CCN(c3ncccn3)CC1)CCCO2 ZINC000489496717 903423377 /nfs/dbraw/zinc/42/33/77/903423377.db2.gz ZFXFPDHBWXXRKY-HSZRJFAPSA-N 2 0 423.605 4.006 20 0 HIADRP Cc1ccc([C@H](NC(=O)C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)C2CC2)cc1 ZINC000489656792 903522365 /nfs/dbraw/zinc/52/23/65/903522365.db2.gz DFEOXWPPZHKKFV-MHZLTWQESA-N 2 0 419.613 4.406 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1 ZINC000489821354 903615683 /nfs/dbraw/zinc/61/56/83/903615683.db2.gz QQZCKTSTCMKBLZ-ZODMCCGTSA-N 2 0 420.601 4.033 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 ZINC000490118476 903774734 /nfs/dbraw/zinc/77/47/34/903774734.db2.gz KJEKQARNDJYADH-QHCPKHFHSA-N 2 0 419.585 4.393 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](c3ccccc3)c3ccc(OC)cc3)cn2)CC1 ZINC000490159784 903801592 /nfs/dbraw/zinc/80/15/92/903801592.db2.gz ZMWUADWSKDLYIZ-SANMLTNESA-N 2 0 416.569 4.111 20 0 HIADRP CC[N@H+](Cc1ccc(OC)c(OC)c1)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000506064864 914770668 /nfs/dbraw/zinc/77/06/68/914770668.db2.gz YFAJGIWQIAOSGG-UHFFFAOYSA-N 2 0 411.590 4.256 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)CC3 ZINC000491010664 904367850 /nfs/dbraw/zinc/36/78/50/904367850.db2.gz UEHIZXUTSNNSOH-OAQYLSRUSA-N 2 0 403.570 4.080 20 0 HIADRP CCOc1ccc([C@@H]([NH2+]C[C@@H](C)N2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000491026864 904377290 /nfs/dbraw/zinc/37/72/90/904377290.db2.gz ZGIUYTLSCAZSDZ-WZONZLPQSA-N 2 0 401.982 4.054 20 0 HIADRP C[C@H](C[NH2+][C@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1)N1CC[NH+](C)CC1 ZINC000491034761 904387460 /nfs/dbraw/zinc/38/74/60/904387460.db2.gz TZKOIWDJQGRMAA-IIBYNOLFSA-N 2 0 423.935 4.256 20 0 HIADRP COc1ccc([C@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)c2ccccc2Cl)cc1 ZINC000492254999 904824757 /nfs/dbraw/zinc/82/47/57/904824757.db2.gz XRYIUEGLCQWICK-CVDCTZTESA-N 2 0 402.966 4.265 20 0 HIADRP CN(c1ccccc1C[NH+]1CCC(OCc2ccccc2)CC1)C1CC[NH+](C)CC1 ZINC000506248722 914862416 /nfs/dbraw/zinc/86/24/16/914862416.db2.gz XZURWVWYYNXMLZ-UHFFFAOYSA-N 2 0 407.602 4.398 20 0 HIADRP CC(C)[C@H](CSc1ccccc1)[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000493201847 905047091 /nfs/dbraw/zinc/04/70/91/905047091.db2.gz GHTNLLBQYJRFSB-NRFANRHFSA-N 2 0 405.652 4.020 20 0 HIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)CC2 ZINC000493910185 905262057 /nfs/dbraw/zinc/26/20/57/905262057.db2.gz ZKARAOYTCOSNLL-HXUWFJFHSA-N 2 0 403.364 4.475 20 0 HIADRP FC(F)(F)C1CCC(C[NH+]2CCN([C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)CC1 ZINC000512428384 921155025 /nfs/dbraw/zinc/15/50/25/921155025.db2.gz SUDHMDYKPPHMSM-HRTMPFAESA-N 2 0 409.540 4.247 20 0 HIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]C1CC[NH+]([C@H]3CCCC[C@@H]3O)CC1)CC2 ZINC000494647876 905881116 /nfs/dbraw/zinc/88/11/16/905881116.db2.gz NIZTWHFVYDHEFM-AABGKKOBSA-N 2 0 407.396 4.102 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000494649134 905882625 /nfs/dbraw/zinc/88/26/25/905882625.db2.gz QANHOAHXNATEKW-APDVGNCJSA-N 2 0 407.396 4.053 20 0 HIADRP c1ccc([C@@H]([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)c2ccccn2)cc1 ZINC000494745361 905945060 /nfs/dbraw/zinc/94/50/60/905945060.db2.gz IOWFTMRTYQGJIO-AREMUKBSSA-N 2 0 401.554 4.478 20 0 HIADRP CC[N@H+](CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)[C@@H](C)Cc1ccsc1 ZINC000495256790 906343699 /nfs/dbraw/zinc/34/36/99/906343699.db2.gz UJHKQUIHBBQNAO-FQEVSTJZSA-N 2 0 413.631 4.090 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(F)c(Cl)c1 ZINC000495460915 906465204 /nfs/dbraw/zinc/46/52/04/906465204.db2.gz NUVAUJMOQXUYMN-BEFAXECRSA-N 2 0 403.929 4.027 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]Cc4ccnc(OC5CCOCC5)c4)[C@@H]3C2)cc1 ZINC000512621623 921265214 /nfs/dbraw/zinc/26/52/14/921265214.db2.gz ZXBDRGQTTAFCQX-ICDZXHCJSA-N 2 0 421.585 4.030 20 0 HIADRP O=C1CCCN1Cc1cccc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000512636728 921269652 /nfs/dbraw/zinc/26/96/52/921269652.db2.gz NNOWVLVZXVVSJX-JIMJEQGWSA-N 2 0 417.597 4.199 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)N(C)Cc1cccc(F)c1 ZINC000497274670 906827283 /nfs/dbraw/zinc/82/72/83/906827283.db2.gz GJZZAYLISRGEBC-HXUWFJFHSA-N 2 0 411.565 4.338 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)Nc1ccc(F)cc1F ZINC000497295085 906829240 /nfs/dbraw/zinc/82/92/40/906829240.db2.gz QDIPEVKSODHPIE-KRWDZBQOSA-N 2 0 401.501 4.458 20 0 HIADRP C[C@@H](CNC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccccc1 ZINC000497297236 906829581 /nfs/dbraw/zinc/82/95/81/906829581.db2.gz UTEYXTVUXBGJMS-FCHUYYIVSA-N 2 0 407.602 4.461 20 0 HIADRP C[C@@H](CNC(=O)[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccccc1 ZINC000497297238 906829751 /nfs/dbraw/zinc/82/97/51/906829751.db2.gz UTEYXTVUXBGJMS-VXKWHMMOSA-N 2 0 407.602 4.461 20 0 HIADRP O=C1CCCN1Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000512642220 921271333 /nfs/dbraw/zinc/27/13/33/921271333.db2.gz NGXHIGRSEOHBJQ-UODIDJSMSA-N 2 0 417.597 4.199 20 0 HIADRP C[C@H](NC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512695304 921290011 /nfs/dbraw/zinc/29/00/11/921290011.db2.gz SUMPUBDXOSEWAV-UNMCSNQZSA-N 2 0 412.622 4.490 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21)[NH2+][C@H](C)c1ccccc1 ZINC000497686761 907192622 /nfs/dbraw/zinc/19/26/22/907192622.db2.gz KSOZSADMWZAHQK-CEMLEFRQSA-N 2 0 400.611 4.022 20 0 HIADRP CCN(CC[NH+]1CCCCCC1)C(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000498042421 907550664 /nfs/dbraw/zinc/55/06/64/907550664.db2.gz BGCLJNBFUMIXMJ-CTNGQTDRSA-N 2 0 406.640 4.039 20 0 HIADRP CC[NH+](CC)CCOc1ccc(NC(=O)N[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000512842718 921345114 /nfs/dbraw/zinc/34/51/14/921345114.db2.gz ASQOGSYOOFDKNT-PMACEKPBSA-N 2 0 416.610 4.182 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccco1 ZINC000498901004 908308192 /nfs/dbraw/zinc/30/81/92/908308192.db2.gz LALMKWKTABNGDC-YVNJGZBMSA-N 2 0 412.578 4.061 20 0 HIADRP CN1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000499196748 908550977 /nfs/dbraw/zinc/55/09/77/908550977.db2.gz WNYRMJQNNKXQQQ-CLCBZUSPSA-N 2 0 411.540 4.495 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 ZINC000513007891 921471537 /nfs/dbraw/zinc/47/15/37/921471537.db2.gz YBOMBDNHADYFKZ-NRFANRHFSA-N 2 0 416.447 4.086 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)cc2)C1 ZINC000500697044 910029871 /nfs/dbraw/zinc/02/98/71/910029871.db2.gz LTJMWNCVBJQKDS-RTBURBONSA-N 2 0 414.638 4.273 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)cc2)C1 ZINC000500697043 910029888 /nfs/dbraw/zinc/02/98/88/910029888.db2.gz LTJMWNCVBJQKDS-OALUTQOASA-N 2 0 414.638 4.273 20 0 HIADRP C[C@H]1C[C@@H](CCNC(=O)N2CCC(CCC[NH+](C)C)CC2)C[N@@H+]1Cc1ccccc1 ZINC000500893892 910164298 /nfs/dbraw/zinc/16/42/98/910164298.db2.gz MUHLNAZAPQBIDJ-XUZZJYLKSA-N 2 0 414.638 4.051 20 0 HIADRP C[N@@H+](Cc1c(F)ccc(Br)c1F)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000500985909 910218223 /nfs/dbraw/zinc/21/82/23/910218223.db2.gz RKNLKOCDKFPXPJ-UHFFFAOYSA-N 2 0 410.306 4.471 20 0 HIADRP C[N@@H+](Cc1cc(Cl)c2c(c1)OCCCO2)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501017759 910235703 /nfs/dbraw/zinc/23/57/03/910235703.db2.gz BUENGSBTISQBIH-UHFFFAOYSA-N 2 0 401.938 4.245 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1 ZINC000501021119 910239079 /nfs/dbraw/zinc/23/90/79/910239079.db2.gz HGNQPHPQYLJHOT-NRFANRHFSA-N 2 0 408.590 4.006 20 0 HIADRP C[C@@H](NC(=O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1cccc2ccccc21 ZINC000501060364 910271336 /nfs/dbraw/zinc/27/13/36/910271336.db2.gz ASIWYRMUSICRMR-HXUWFJFHSA-N 2 0 416.569 4.260 20 0 HIADRP C[N@H+](CCC(=O)Nc1ccc(OCc2ccccc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513145424 921583038 /nfs/dbraw/zinc/58/30/38/921583038.db2.gz SXJCMEMOBUVRDF-AIZNXBIQSA-N 2 0 407.558 4.151 20 0 HIADRP C[N@H+](CCC(=O)Nc1ccccc1C(F)(F)F)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501540489 910646228 /nfs/dbraw/zinc/64/62/28/910646228.db2.gz PRACKEGMHRBHDX-UHFFFAOYSA-N 2 0 420.479 4.277 20 0 HIADRP COC(=O)c1ccc(-c2nc(C[NH+]3CCC(CCC[NH+](C)C)CC3)cs2)cc1 ZINC000501794808 910847526 /nfs/dbraw/zinc/84/75/26/910847526.db2.gz XENDBFOAEIOEJC-UHFFFAOYSA-N 2 0 401.576 4.151 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH+]2CCC(c3cccc(Br)c3)CC2)CC1 ZINC000501852889 910886027 /nfs/dbraw/zinc/88/60/27/910886027.db2.gz SHGWZYXLHPGENA-UHFFFAOYSA-N 2 0 408.428 4.045 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCC2)c1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000502601499 911608504 /nfs/dbraw/zinc/60/85/04/911608504.db2.gz QFGZQBUVTYGMGG-UHFFFAOYSA-N 2 0 412.622 4.080 20 0 HIADRP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)C1 ZINC000502763271 911786760 /nfs/dbraw/zinc/78/67/60/911786760.db2.gz NUBRKLLKDVMSDS-SFTDATJTSA-N 2 0 400.611 4.070 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000502846792 911857478 /nfs/dbraw/zinc/85/74/78/911857478.db2.gz OZCJCAUHJXXIRH-IBGZPJMESA-N 2 0 421.029 4.258 20 0 HIADRP C[C@@H]([NH2+]C1(CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)CCCC1)c1ccccc1 ZINC000502914427 911900722 /nfs/dbraw/zinc/90/07/22/911900722.db2.gz ZRZQNBWRXJIMMX-NQIIRXRSSA-N 2 0 414.619 4.314 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)NCc1ccccc1C[NH+]1CCCC1)c1ccccc1 ZINC000502951088 911936310 /nfs/dbraw/zinc/93/63/10/911936310.db2.gz RPVHCJZERUNSOT-FQEVSTJZSA-N 2 0 408.590 4.211 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000502966318 911948322 /nfs/dbraw/zinc/94/83/22/911948322.db2.gz UCJZRUBLVLNICM-SZPZYZBQSA-N 2 0 414.638 4.051 20 0 HIADRP CCC(CC)(CNC(=O)NC1CC[NH+](CC2CC2)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000503038435 912007453 /nfs/dbraw/zinc/00/74/53/912007453.db2.gz KWIHVPNQMLYFLD-IBGZPJMESA-N 2 0 400.611 4.070 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)NC2CC[NH+](C(C)(C)C)CC2)CCCC1)c1ccccc1 ZINC000503084329 912052420 /nfs/dbraw/zinc/05/24/20/912052420.db2.gz PZJRSSIWGAXOMH-IBGZPJMESA-N 2 0 400.611 4.212 20 0 HIADRP COc1ccc2c(c1)C[C@H]([NH2+]CCCOC1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000513388016 921760320 /nfs/dbraw/zinc/76/03/20/921760320.db2.gz JHHGVMDGMXPZOJ-XMMPIXPASA-N 2 0 408.586 4.213 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CC[C@@H](n2ncc3ccccc32)C1)C1CC[NH+](C)CC1 ZINC000513390713 921761498 /nfs/dbraw/zinc/76/14/98/921761498.db2.gz RYONUTIPEPXTKD-HSZRJFAPSA-N 2 0 403.574 4.014 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000506913731 915712039 /nfs/dbraw/zinc/71/20/39/915712039.db2.gz BVICHYAIJXCALY-NJYVYQBISA-N 2 0 418.651 4.181 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1 ZINC000506934405 915737749 /nfs/dbraw/zinc/73/77/49/915737749.db2.gz RDOXDGKBZKUMLD-QPPBQGQZSA-N 2 0 414.638 4.324 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)C1 ZINC000506938481 915741912 /nfs/dbraw/zinc/74/19/12/915741912.db2.gz DSEFJWWSQAODKD-BJESRGMDSA-N 2 0 406.659 4.041 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC000506940395 915745744 /nfs/dbraw/zinc/74/57/44/915745744.db2.gz OCVAOTNCYVJPAA-SVPADUAOSA-N 2 0 412.622 4.118 20 0 HIADRP c1sc(CC[NH2+][C@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)nc1-c1ccccn1 ZINC000507465069 916233686 /nfs/dbraw/zinc/23/36/86/916233686.db2.gz ZJPJNMVRBZAYQA-HBMCJLEFSA-N 2 0 404.583 4.248 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000508697675 917458944 /nfs/dbraw/zinc/45/89/44/917458944.db2.gz MKACEMKOSBVHPQ-ZGXDEKTJSA-N 3 0 421.629 4.296 20 0 HIADRP Cc1ccc(C(=O)N2CCC([NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000508700978 917462344 /nfs/dbraw/zinc/46/23/44/917462344.db2.gz VNQAMUFMZPRGTA-QPPBQGQZSA-N 2 0 405.586 4.100 20 0 HIADRP C[C@H]([NH2+]CCc1nc(-c2ccc(Cl)cc2)no1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703101 917464465 /nfs/dbraw/zinc/46/44/65/917464465.db2.gz XMFYZJYAYYWMPR-FXAWDEMLSA-N 2 0 410.949 4.433 20 0 HIADRP C[C@@H]([NH2+]CC1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508712957 917472964 /nfs/dbraw/zinc/47/29/64/917472964.db2.gz DYBUWQCEGUWQOQ-PXDATVDWSA-N 2 0 405.586 4.039 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722174 917484865 /nfs/dbraw/zinc/48/48/65/917484865.db2.gz RHTNABJQVROCOJ-AHWVRZQESA-N 3 0 420.645 4.089 20 0 HIADRP Cc1ccccc1[C@@H]([C@H](C)NC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000508897243 917652649 /nfs/dbraw/zinc/65/26/49/917652649.db2.gz JHKDFMJSBRGDOP-SQJMNOBHSA-N 2 0 422.617 4.292 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N(C)[C@H]1CC[NH+](CC)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000509025072 917778134 /nfs/dbraw/zinc/77/81/34/917778134.db2.gz TWQZDVYLDNWONE-DZFGPLHGSA-N 2 0 409.018 4.237 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N(C)[C@H]1CC[NH+](CC)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000509025074 917778709 /nfs/dbraw/zinc/77/87/09/917778709.db2.gz TWQZDVYLDNWONE-JRGCBEDISA-N 2 0 409.018 4.237 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N(C)[C@@H]1CC[NH+](CC)C[C@@H]1C)c1ccc(Cl)cc1 ZINC000509031402 917787297 /nfs/dbraw/zinc/78/72/97/917787297.db2.gz KSSONCKHNJGCKK-IOMROCGXSA-N 2 0 409.018 4.095 20 0 HIADRP CCC[N@H+](C)[C@@H](CNC(=O)N(C)[C@H](C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000509047917 917799319 /nfs/dbraw/zinc/79/93/19/917799319.db2.gz CXJBEPAGQYMNIB-UTKZUKDTSA-N 2 0 409.018 4.095 20 0 HIADRP CC(C)[N@@H+]1CCc2nc(CN[C@@H]3CC[NH+](Cc4ccccc4)CC3(C)C)sc2C1 ZINC000509452120 918105726 /nfs/dbraw/zinc/10/57/26/918105726.db2.gz VJYVVZHOZYBZPU-JOCHJYFZSA-N 2 0 412.647 4.300 20 0 HIADRP C[C@@H](C[NH2+]Cc1ccc(-c2ccccc2Br)cc1)CN1CC[NH+](C)CC1 ZINC000509464770 918114172 /nfs/dbraw/zinc/11/41/72/918114172.db2.gz PEMIUHUIILQCGG-SFHVURJKSA-N 2 0 416.407 4.089 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(Sc4ccccn4)o3)cc2)CC1 ZINC000509539169 918186548 /nfs/dbraw/zinc/18/65/48/918186548.db2.gz HFUOMYBZZTWYLJ-UHFFFAOYSA-N 2 0 409.555 4.072 20 0 HIADRP CC[C@@H](C)[NH2+][C@@H](CNC(=O)N1CCC(CCC[NH+]2CCCC2)CC1)c1ccco1 ZINC000509595395 918244091 /nfs/dbraw/zinc/24/40/91/918244091.db2.gz HGHCAAWYLMTIIN-CTNGQTDRSA-N 2 0 404.599 4.006 20 0 HIADRP C[C@H](NC(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)[C@H]1CCC[NH+](C2CCC2)C1 ZINC000511449131 920059096 /nfs/dbraw/zinc/05/90/96/920059096.db2.gz MZAWBMKKXXFKTF-ZVVDCOBXSA-N 2 0 418.651 4.083 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+]Cc2cnn(-c3ccc(C(F)(F)F)cc3)c2)c1 ZINC000512101501 920861410 /nfs/dbraw/zinc/86/14/10/920861410.db2.gz ZKTBJNBIZVVQJZ-UHFFFAOYSA-N 2 0 418.463 4.121 20 0 HIADRP C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000512148770 920890871 /nfs/dbraw/zinc/89/08/71/920890871.db2.gz YNLKEGMOHDJCOE-QWHCGFSZSA-N 2 0 403.876 4.150 20 0 HIADRP C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000512148771 920891013 /nfs/dbraw/zinc/89/10/13/920891013.db2.gz YNLKEGMOHDJCOE-STQMWFEESA-N 2 0 403.876 4.150 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512318879 921070001 /nfs/dbraw/zinc/07/00/01/921070001.db2.gz UHFIJCIBLIXRMX-WSTZPKSXSA-N 2 0 406.014 4.320 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(Br)cc1 ZINC000513456967 921821890 /nfs/dbraw/zinc/82/18/90/921821890.db2.gz GVMWPOPLJGIICW-SFTDATJTSA-N 2 0 403.364 4.257 20 0 HIADRP C[C@H]1C[C@H](CC[NH2+]Cc2c[nH]nc2-c2ccc3c(c2)OCO3)C[N@@H+]1Cc1ccccc1 ZINC000513501607 921851020 /nfs/dbraw/zinc/85/10/20/921851020.db2.gz UMUXDQBQBRSTJA-ICSRJNTNSA-N 2 0 418.541 4.196 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccccc2OC(F)(F)F)C[C@@H](C)O1 ZINC000513588049 921920252 /nfs/dbraw/zinc/92/02/52/921920252.db2.gz GVQCUSBGEKKPRL-IAGOWNOFSA-N 2 0 408.464 4.484 20 0 HIADRP Cc1ccccc1[C@@H](OC[C@@H](O)C[N@@H+](C)C1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000514005198 922328835 /nfs/dbraw/zinc/32/88/35/922328835.db2.gz DHJYFCVMTGQKBW-AHWVRZQESA-N 2 0 410.602 4.267 20 0 HIADRP C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000514019787 922342904 /nfs/dbraw/zinc/34/29/04/922342904.db2.gz IKIREFVMCXUDGX-GOSISDBHSA-N 2 0 421.029 4.114 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000514023326 922345496 /nfs/dbraw/zinc/34/54/96/922345496.db2.gz WMLNOOSSHQKKDU-HYBUGGRVSA-N 2 0 408.590 4.163 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCC2(CC)CC[NH+](Cc3ccccc3)CC2)C1 ZINC000514030340 922351524 /nfs/dbraw/zinc/35/15/24/922351524.db2.gz DUJNHUYXRKTORF-QHCPKHFHSA-N 2 0 414.638 4.052 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3ccc(OC)c(OC)c3C)cc2)CC1 ZINC000514101151 922428616 /nfs/dbraw/zinc/42/86/16/922428616.db2.gz ZCWNLVYBSINQEC-HXUWFJFHSA-N 2 0 411.590 4.001 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000514107573 922437501 /nfs/dbraw/zinc/43/75/01/922437501.db2.gz NJRBZYFOTWZDJU-PMACEKPBSA-N 2 0 420.667 4.017 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCCCC[N@H+]2CCCC[C@H]2C)[NH+]2CCCC2)cc1 ZINC000514122617 922454498 /nfs/dbraw/zinc/45/44/98/922454498.db2.gz LSMLVTVJDRFYGZ-FYYLOGMGSA-N 2 0 400.611 4.086 20 0 HIADRP CC(C)[C@@H](CNC(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)[NH+]1CCC(C)CC1 ZINC000514221824 922557227 /nfs/dbraw/zinc/55/72/27/922557227.db2.gz KBNKIMJSSNVQJF-RBBKRZOGSA-N 2 0 420.667 4.016 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NC[C@H](c2ccccc2Cl)[NH+]2CCCC2)C1 ZINC000514458872 922635628 /nfs/dbraw/zinc/63/56/28/922635628.db2.gz DUXHVZQWKTWLNA-DENIHFKCSA-N 2 0 421.029 4.288 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccc2c(c1)OCCO2 ZINC000514682383 922753320 /nfs/dbraw/zinc/75/33/20/922753320.db2.gz IXFCWJBJRPRHEN-NZQKXSOJSA-N 2 0 422.569 4.037 20 0 HIADRP CCC1(CC)[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C[C@H]1OC ZINC000515316301 923045415 /nfs/dbraw/zinc/04/54/15/923045415.db2.gz UVJIPWHYELDQLE-DNVJHFABSA-N 2 0 400.607 4.099 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(=O)N1CCc2sccc2C1 ZINC000515757886 923330751 /nfs/dbraw/zinc/33/07/51/923330751.db2.gz VLLRMSFOGIUKAK-OALUTQOASA-N 2 0 411.615 4.043 20 0 HIADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2cccc(S(=O)(=O)NC3CCCCCC3)c2)CC1 ZINC000516524602 923778659 /nfs/dbraw/zinc/77/86/59/923778659.db2.gz FTTDESYQCUNBCL-IBGZPJMESA-N 2 0 421.651 4.070 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@@H]1CC[NH+]([C@H](C)c2ccccc2)C1 ZINC000516579808 923800545 /nfs/dbraw/zinc/80/05/45/923800545.db2.gz TUGJSJGMGSRAOC-HYBUGGRVSA-N 2 0 408.590 4.162 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)cc1 ZINC000517422412 924172756 /nfs/dbraw/zinc/17/27/56/924172756.db2.gz UXWSGLHVORPSOC-URXFXBBRSA-N 2 0 412.622 4.221 20 0 HIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000518591499 927367377 /nfs/dbraw/zinc/36/73/77/927367377.db2.gz KQQIEWWEKBIVPA-GXFGXRNXSA-N 2 0 419.613 4.061 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2csc(-c3ccc(F)cc3)n2)[C@H](c2ccccc2)C1 ZINC000518768128 927482881 /nfs/dbraw/zinc/48/28/81/927482881.db2.gz IPGLZKYWDGREAW-QHCPKHFHSA-N 2 0 424.589 4.418 20 0 HIADRP O=C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000518934335 927640784 /nfs/dbraw/zinc/64/07/84/927640784.db2.gz QHMKOXYSXDKZKG-NXMIGULDSA-N 2 0 417.597 4.210 20 0 HIADRP CC[N@@H+]1CCCC[C@H]1CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000518967781 927662425 /nfs/dbraw/zinc/66/24/25/927662425.db2.gz ZOEIDRMCCOGPEO-QHCPKHFHSA-N 2 0 408.590 4.089 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)[C@H]2CCC[N@H+](Cc3cccc(F)c3)C2)CC1 ZINC000520111734 928319209 /nfs/dbraw/zinc/31/92/09/928319209.db2.gz QVJAQDKQJRCZNP-QHCPKHFHSA-N 2 0 423.576 4.127 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3ccc(OC(F)F)cc3)CC2)c1 ZINC000520208894 928389207 /nfs/dbraw/zinc/38/92/07/928389207.db2.gz VBLYHOXKABOJSO-UHFFFAOYSA-N 2 0 403.517 4.288 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NC[C@H](c2ccc(C)cc2)[NH+]2CCCC2)c1 ZINC000520296825 928458250 /nfs/dbraw/zinc/45/82/50/928458250.db2.gz VKRHCFDUIGAXEB-XMMPIXPASA-N 2 0 408.590 4.083 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000520960150 928890612 /nfs/dbraw/zinc/89/06/12/928890612.db2.gz LZFDIVTXNRLROD-SFHVURJKSA-N 2 0 403.517 4.120 20 0 HIADRP CC[NH+](CC)Cc1cccc(NC(=O)CCC[NH+]2CCN(c3ccccc3)CC2)c1 ZINC000521057545 928966255 /nfs/dbraw/zinc/96/62/55/928966255.db2.gz YPWQGWOLVYWARU-UHFFFAOYSA-N 2 0 408.590 4.069 20 0 HIADRP Cc1ccc([C@H](CNC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)[NH+](C)C)cc1 ZINC000521466598 929233877 /nfs/dbraw/zinc/23/38/77/929233877.db2.gz AVGHQDPUQLMQRP-DEOSSOPVSA-N 2 0 408.590 4.448 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NCc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)c1 ZINC000521969754 929606027 /nfs/dbraw/zinc/60/60/27/929606027.db2.gz WMABYIXAMJJJPX-NRFANRHFSA-N 2 0 422.617 4.370 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NCc1cccc(C[NH+]2CCCCCC2)c1)c1ccccc1 ZINC000521995222 929616108 /nfs/dbraw/zinc/61/61/08/929616108.db2.gz WCNQIBQXAMWLNG-XMMPIXPASA-N 2 0 408.590 4.165 20 0 HIADRP O=C(NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)[C@@H]1CCCC[NH+]1Cc1ccccc1 ZINC000524968858 929932746 /nfs/dbraw/zinc/93/27/46/929932746.db2.gz VPNVPKLVOOUSAB-GMAHTHKFSA-N 2 0 411.615 4.131 20 0 HIADRP CC[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1ccc(Br)cc1Cl ZINC000525858321 930469423 /nfs/dbraw/zinc/46/94/23/930469423.db2.gz BEZZJIZRQUKNRD-SFHVURJKSA-N 2 0 402.808 4.169 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2ccc(C(F)F)cc2)c1)C1CCOCC1 ZINC000527518094 930673079 /nfs/dbraw/zinc/67/30/79/930673079.db2.gz BVESUPNBJRTSKJ-UHFFFAOYSA-N 2 0 404.501 4.404 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccccc2C[NH+]2CCCCCC2)CC1 ZINC000530966523 930871002 /nfs/dbraw/zinc/87/10/02/930871002.db2.gz SLIUWZMOEZKINL-UHFFFAOYSA-N 2 0 420.601 4.299 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NC1CC[NH+](C2CCCCC2)CC1)c1ccc(Cl)cc1 ZINC000531345333 931025354 /nfs/dbraw/zinc/02/53/54/931025354.db2.gz GDTMBYRCLCADRO-OAQYLSRUSA-N 2 0 407.002 4.039 20 0 HIADRP CCN(C(=O)C1CCN(c2cc[nH+]cc2C)CC1)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000531443065 931058337 /nfs/dbraw/zinc/05/83/37/931058337.db2.gz VVDQHNFDWDLTGC-URXFXBBRSA-N 2 0 420.601 4.290 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)CC1 ZINC000531446040 931060563 /nfs/dbraw/zinc/06/05/63/931060563.db2.gz GVVIOSHLJIRNRI-UHFFFAOYSA-N 2 0 420.601 4.155 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NC[C@H](CC(C)C)[NH2+][C@@H](C)c2ccccc2)CC1 ZINC000531460435 931065984 /nfs/dbraw/zinc/06/59/84/931065984.db2.gz OXXJVHYAULMFOZ-URXFXBBRSA-N 2 0 422.617 4.488 20 0 HIADRP C[C@@H](c1ccccc1)N1CC[C@H]([NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000531594424 931113244 /nfs/dbraw/zinc/11/32/44/931113244.db2.gz KAYARRVNTNPWKC-URXFXBBRSA-N 2 0 406.618 4.142 20 0 HIADRP C[C@H](c1ccccc1)N1CC[C@H]([NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000531594423 931113278 /nfs/dbraw/zinc/11/32/78/931113278.db2.gz KAYARRVNTNPWKC-QPPBQGQZSA-N 2 0 406.618 4.142 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000531597449 931116487 /nfs/dbraw/zinc/11/64/87/931116487.db2.gz OLXFYMZJKGKWSW-UHFFFAOYSA-N 3 0 408.634 4.349 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccc2c(c1)OCCO2 ZINC000531597458 931116731 /nfs/dbraw/zinc/11/67/31/931116731.db2.gz OXGCEBYRHVSFIV-QFIPXVFZSA-N 2 0 409.574 4.229 20 0 HIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CC2(O)CC[NH+](C(C)C)CC2)cc1 ZINC000531610112 931125111 /nfs/dbraw/zinc/12/51/11/931125111.db2.gz FXMXBUIEUFQGCM-UHFFFAOYSA-N 2 0 418.585 4.173 20 0 HIADRP CC[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000531710473 931169267 /nfs/dbraw/zinc/16/92/67/931169267.db2.gz OEELYYAOIXBRIG-FGZHOGPDSA-N 2 0 403.517 4.317 20 0 HIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000531723811 931173906 /nfs/dbraw/zinc/17/39/06/931173906.db2.gz HXYCUSMOONIOBC-AVRDEDQJSA-N 2 0 406.014 4.435 20 0 HIADRP C[C@H](c1ccccc1)N1CC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000531785714 931196841 /nfs/dbraw/zinc/19/68/41/931196841.db2.gz YREUVADLRMJCCK-ZEQKJWHPSA-N 2 0 421.629 4.483 20 0 HIADRP c1c(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)[nH]nc1-c1cccnc1 ZINC000531811065 931205511 /nfs/dbraw/zinc/20/55/11/931205511.db2.gz XWIWUGYDKAMXHQ-UHFFFAOYSA-N 2 0 403.574 4.296 20 0 HIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000531959357 931265616 /nfs/dbraw/zinc/26/56/16/931265616.db2.gz YTQBTUWUKDTGMZ-RTBURBONSA-N 2 0 421.564 4.483 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531966749 931269633 /nfs/dbraw/zinc/26/96/33/931269633.db2.gz WMGULQUDDVMEFS-CQSZACIVSA-N 2 0 411.443 4.413 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc(NC(=O)[C@H](C)CC)c2)CC1 ZINC000532042575 931295045 /nfs/dbraw/zinc/29/50/45/931295045.db2.gz ZCYUGWFFFBUKQU-OAQYLSRUSA-N 2 0 422.617 4.493 20 0 HIADRP Cc1ccc(C[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)nc1 ZINC000532141320 931327818 /nfs/dbraw/zinc/32/78/18/931327818.db2.gz ULPXNOJIQUSFND-UHFFFAOYSA-N 2 0 406.496 4.101 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CCCC[NH+]1CCN(C)CC1 ZINC000532451033 931439704 /nfs/dbraw/zinc/43/97/04/931439704.db2.gz SCQWVICKILSIBX-INIZCTEOSA-N 2 0 407.027 4.450 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]Cc1ccccc1-n1ccnc1 ZINC000532465084 931446508 /nfs/dbraw/zinc/44/65/08/931446508.db2.gz DJYDEXRQXQWRFD-HNNXBMFYSA-N 2 0 418.419 4.278 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](CCC(=O)N[C@H](c2cccs2)c2ccccc2)CC1 ZINC000532537805 931515251 /nfs/dbraw/zinc/51/52/51/931515251.db2.gz KXMSEAMOKXNVNN-DEOSSOPVSA-N 2 0 413.631 4.396 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H]1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1 ZINC000533090531 931769036 /nfs/dbraw/zinc/76/90/36/931769036.db2.gz SVTQEPZHFOVMTF-NJDAHSKKSA-N 2 0 411.590 4.228 20 0 HIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+]([C@H](C)c3cccc(NC(=O)c4ccccc4)c3)C2)CC1 ZINC000533308222 931835004 /nfs/dbraw/zinc/83/50/04/931835004.db2.gz LYKYXPLVECEQDE-PXDATVDWSA-N 2 0 420.601 4.100 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@@H](CNCc2nc(-c3ccc(Br)cc3)c[nH]2)C1 ZINC000533444373 931870991 /nfs/dbraw/zinc/87/09/91/931870991.db2.gz UABVTTIBRACSCE-INIZCTEOSA-N 2 0 405.384 4.297 20 0 HIADRP c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+][C@@H]3[C@@H]4CCO[C@H]4C34CCC4)CC2)cc1 ZINC000534064219 932241848 /nfs/dbraw/zinc/24/18/48/932241848.db2.gz RNQNYZGKESRAQG-JIMJEQGWSA-N 2 0 417.597 4.056 20 0 HIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cc(Cl)ccc2OC[C@H]2CCCO2)cc1F ZINC000534233225 932353605 /nfs/dbraw/zinc/35/36/05/932353605.db2.gz CEVVAXQJTWETBB-HXUWFJFHSA-N 2 0 406.929 4.388 20 0 HIADRP C[N@@H+]1CC[C@@H](CNC(=O)NCCC[NH2+]C2CCCCC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000534250509 932365666 /nfs/dbraw/zinc/36/56/66/932365666.db2.gz IBXOWMQPBWQFBO-LAUBAEHRSA-N 2 0 424.992 4.084 20 0 HIADRP CCO[C@H]1C[C@H]([NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)C12CCCC2 ZINC000537293355 933700738 /nfs/dbraw/zinc/70/07/38/933700738.db2.gz ODIWGRHYDAWTJJ-ZEQRLZLVSA-N 2 0 416.606 4.004 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc2cc(Cl)ccc2o1 ZINC000537295534 933701954 /nfs/dbraw/zinc/70/19/54/933701954.db2.gz MBUSXYIZZSYPKD-HNNXBMFYSA-N 2 0 405.970 4.364 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)N(C)CC[C@H]3CCCC[N@@H+]3C)c2)CC1 ZINC000537671801 938350835 /nfs/dbraw/zinc/35/08/35/938350835.db2.gz QXKZFXSMQIJPDD-HSZRJFAPSA-N 2 0 400.611 4.299 20 0 HIADRP COc1cc(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)ccc1OC(F)F ZINC000537843811 938388266 /nfs/dbraw/zinc/38/82/66/938388266.db2.gz WRPCYSYQURJESJ-UHFFFAOYSA-N 2 0 405.489 4.430 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)CC(=O)Nc2cccc(Br)c2)C1 ZINC000537950982 938429446 /nfs/dbraw/zinc/42/94/46/938429446.db2.gz UPTRXWFZKCMVJM-SJORKVTESA-N 2 0 410.400 4.124 20 0 HIADRP OC[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1ccccc1C(F)(F)F ZINC000537957356 938432871 /nfs/dbraw/zinc/43/28/71/938432871.db2.gz CEJLTQOBEJMAJG-FQEVSTJZSA-N 2 0 420.519 4.153 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCc3c2cc(Br)cc3Cl)CC1 ZINC000537957738 938433555 /nfs/dbraw/zinc/43/35/55/938433555.db2.gz SGHOVQPSCODTGZ-IPMKNSEASA-N 2 0 413.787 4.057 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)NCc2cccc(C[NH+](C)C)c2)CC1)CC(C)C ZINC000538071329 938494274 /nfs/dbraw/zinc/49/42/74/938494274.db2.gz PPSSPSMDFQUXBU-UHFFFAOYSA-N 2 0 402.627 4.038 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000538115132 938506152 /nfs/dbraw/zinc/50/61/52/938506152.db2.gz YWIXAQPVZWOZCZ-PWRODBHTSA-N 2 0 407.396 4.258 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H](c2ccc(Br)cc2)C2CC2)ccn1 ZINC000538117802 938506811 /nfs/dbraw/zinc/50/68/11/938506811.db2.gz WTCANUUANMGQRF-HXUWFJFHSA-N 2 0 404.352 4.025 20 0 HIADRP CC(C)[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000538116458 938506827 /nfs/dbraw/zinc/50/68/27/938506827.db2.gz LARRYVHGEZYREJ-XMMPIXPASA-N 2 0 422.573 4.423 20 0 HIADRP COc1ccc(C[C@@H](C)[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1OC ZINC000538299323 938586717 /nfs/dbraw/zinc/58/67/17/938586717.db2.gz TXNWNXCOTVMVAQ-WIYYLYMNSA-N 2 0 410.558 4.213 20 0 HIADRP CC(C)COc1cccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c1 ZINC000538305617 938588194 /nfs/dbraw/zinc/58/81/94/938588194.db2.gz UWFSTBIXFYKXNW-UHFFFAOYSA-N 2 0 401.639 4.350 20 0 HIADRP Cc1cc(C)n(-c2ccccc2C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)n1 ZINC000538413522 938614796 /nfs/dbraw/zinc/61/47/96/938614796.db2.gz FDEQVYSVOSTPGQ-UHFFFAOYSA-N 2 0 417.601 4.309 20 0 HIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)CCO1 ZINC000538507686 938637764 /nfs/dbraw/zinc/63/77/64/938637764.db2.gz YCWAFTGDQTWYTK-AHWVRZQESA-N 2 0 407.602 4.302 20 0 HIADRP COCCc1nc(C)c([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)s1 ZINC000538867699 938728168 /nfs/dbraw/zinc/72/81/68/938728168.db2.gz PFXTXNFIXDWDED-KSZLIROESA-N 2 0 417.619 4.100 20 0 HIADRP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)c1oc2ccccc2c1C[NH+](C)C ZINC000538893076 938731885 /nfs/dbraw/zinc/73/18/85/938731885.db2.gz LOVLAHROTSOZPT-UHFFFAOYSA-N 2 0 420.557 4.268 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(Oc2ccccc2)nn1 ZINC000538945854 938744117 /nfs/dbraw/zinc/74/41/17/938744117.db2.gz SNUKPAJFRGTBGK-UHFFFAOYSA-N 2 0 403.530 4.402 20 0 HIADRP O=C(Nc1ccc(F)cc1)[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000538951478 938747033 /nfs/dbraw/zinc/74/70/33/938747033.db2.gz UNCYYFIXWSIBKN-XMMPIXPASA-N 2 0 418.516 4.407 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1cccc(-c2ccccc2)c1 ZINC000539074299 938794979 /nfs/dbraw/zinc/79/49/79/938794979.db2.gz VWNDHGOUDLNKJD-FQEVSTJZSA-N 2 0 401.554 4.496 20 0 HIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]C3CCN(C(=O)NC4CCCCC4)CC3)CC2)C1 ZINC000539079043 938796848 /nfs/dbraw/zinc/79/68/48/938796848.db2.gz PASVXMLMGORLAW-CVDCTZTESA-N 2 0 404.643 4.126 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000539092485 938801623 /nfs/dbraw/zinc/80/16/23/938801623.db2.gz BYHGJRYMBDWPMR-AWEZNQCLSA-N 2 0 401.473 4.155 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H](c3ccc(Cl)cc3)C3CC3)c2)C1 ZINC000539201397 938818750 /nfs/dbraw/zinc/81/87/50/938818750.db2.gz YOBHRNNNROEBJP-JTHBVZDNSA-N 2 0 411.977 4.278 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CC1(c3ccccc3)CCOCC1)c1ccccc1O2 ZINC000539363736 938849133 /nfs/dbraw/zinc/84/91/33/938849133.db2.gz RTPSROJTORUVOT-HSZRJFAPSA-N 2 0 406.570 4.313 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1N[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000539394760 938853895 /nfs/dbraw/zinc/85/38/95/938853895.db2.gz ZDWDHAXQGIAQNM-ZODMCCGTSA-N 2 0 419.613 4.475 20 0 HIADRP CC(C)[NH+]1CCN(c2cccc(N[C@H](C)[C@@H](c3ccccc3)[NH+]3CCOCC3)c2)CC1 ZINC000539645258 938893085 /nfs/dbraw/zinc/89/30/85/938893085.db2.gz MHNZBKFVEFWSOG-GJZUVCINSA-N 2 0 422.617 4.091 20 0 HIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc1F ZINC000563567028 945217544 /nfs/dbraw/zinc/21/75/44/945217544.db2.gz XUKOOAMKKARFIX-UNMCSNQZSA-N 2 0 415.553 4.376 20 0 HIADRP COC(=O)[C@@H](C)Oc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000539825960 938947374 /nfs/dbraw/zinc/94/73/74/938947374.db2.gz ZTCPSUMJSFLOLT-OAQYLSRUSA-N 2 0 422.569 4.115 20 0 HIADRP Cc1cc(C)n(-c2ccccc2C[NH2+]Cc2c(Cl)cccc2N2CC[NH+](C)CC2)n1 ZINC000539978941 939029055 /nfs/dbraw/zinc/02/90/55/939029055.db2.gz HHARBFMRJFKQOJ-UHFFFAOYSA-N 2 0 423.992 4.184 20 0 HIADRP CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)c1ccc(Nc2cc[nH+]cc2)cc1 ZINC000539984091 939029698 /nfs/dbraw/zinc/02/96/98/939029698.db2.gz FICCMFTYERIHQX-UHFFFAOYSA-N 2 0 415.541 4.021 20 0 HIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C3CCN([C@H]4CCC[C@H]4O)CC3)s2)cc1 ZINC000540160142 939095772 /nfs/dbraw/zinc/09/57/72/939095772.db2.gz JVLGMNKPZRFOCF-ONGXBYRLSA-N 2 0 415.603 4.156 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc(-n2ccnc2)cc1 ZINC000540192731 939117345 /nfs/dbraw/zinc/11/73/45/939117345.db2.gz OJJDXTRBBKHXEW-JOCHJYFZSA-N 2 0 403.574 4.125 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000540191837 939117435 /nfs/dbraw/zinc/11/74/35/939117435.db2.gz ZQMFGYKLSLWIKU-FQEVSTJZSA-N 2 0 420.601 4.169 20 0 HIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3CCN(C(=O)CCc4ccccc4)CC3)CC2)C1 ZINC000540192311 939117554 /nfs/dbraw/zinc/11/75/54/939117554.db2.gz DHKVIPDLNBRQMU-SQJMNOBHSA-N 2 0 411.634 4.243 20 0 HIADRP CC[N@H+](CCC1CC[NH+]([C@H](C)C(=O)Nc2cccc(NC(C)=O)c2)CC1)CC(C)C ZINC000540194266 939119968 /nfs/dbraw/zinc/11/99/68/939119968.db2.gz DSMCKQIDQDBGSF-LJQANCHMSA-N 2 0 416.610 4.052 20 0 HIADRP Cc1nc2ccccc2n1CCC[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540468103 939264671 /nfs/dbraw/zinc/26/46/71/939264671.db2.gz KUKGTHLLQGFJBZ-JOCHJYFZSA-N 2 0 404.558 4.313 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]C[C@@H](c1ccccc1)C(C)(C)CO)c1ccccc1O2 ZINC000540494303 939274274 /nfs/dbraw/zinc/27/42/74/939274274.db2.gz VMTIPZJWTDICBZ-XZOQPEGZSA-N 2 0 408.586 4.367 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1cc2cc(Br)ccc2o1 ZINC000540594741 939314133 /nfs/dbraw/zinc/31/41/33/939314133.db2.gz ZQVRKIXJUFSNMC-OAHLLOKOSA-N 2 0 408.384 4.120 20 0 HIADRP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cc2cc(Br)ccc2o1 ZINC000540605321 939317265 /nfs/dbraw/zinc/31/72/65/939317265.db2.gz HWWOYCIJTZVUGZ-AWEZNQCLSA-N 2 0 418.335 4.382 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)CC3 ZINC000540988043 939425653 /nfs/dbraw/zinc/42/56/53/939425653.db2.gz FPXXQTRCLQSPLT-VXKWHMMOSA-N 2 0 403.570 4.080 20 0 HIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)ccc1OC(F)F ZINC000540990656 939426565 /nfs/dbraw/zinc/42/65/65/939426565.db2.gz SMGLPFZMBOVLMN-UZLBHIALSA-N 2 0 420.500 4.104 20 0 HIADRP C[C@H](CCNC(=O)NC[C@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1)[NH+]1CCCCC1 ZINC000541480280 939532377 /nfs/dbraw/zinc/53/23/77/939532377.db2.gz MSTABIQVJRMJBO-HGHGUNKESA-N 2 0 424.992 4.036 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]C3CC(c4ccc(Cl)cc4)C3)c2)C1 ZINC000541541696 939548290 /nfs/dbraw/zinc/54/82/90/939548290.db2.gz SJSMOJQZJCGILO-HVIUMASTSA-N 2 0 411.977 4.073 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@@H](c2ccc(F)cc2)c2ccccn2)[C@H](c2ccccc2)C1 ZINC000541548590 939551552 /nfs/dbraw/zinc/55/15/52/939551552.db2.gz DYCPSSGCZPPZII-UIOOFZCWSA-N 2 0 418.560 4.279 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000541914751 939652139 /nfs/dbraw/zinc/65/21/39/939652139.db2.gz JEHSYTUIXATPAL-YADHBBJMSA-N 2 0 415.375 4.257 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cccc(Br)c1 ZINC000541915759 939652703 /nfs/dbraw/zinc/65/27/03/939652703.db2.gz YZEYFPFKFNLESR-LEWJYISDSA-N 2 0 403.364 4.257 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccccc1OC(F)F ZINC000541918976 939653822 /nfs/dbraw/zinc/65/38/22/939653822.db2.gz QWWYFKCMTNEHHS-TZIWHRDSSA-N 2 0 404.501 4.486 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)Cn1c2ccccc2c2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542534730 939839138 /nfs/dbraw/zinc/83/91/38/939839138.db2.gz WBXWXCOHYJEXMW-TUNNFDKTSA-N 2 0 405.586 4.398 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(F)cc1Br ZINC000542849455 939862999 /nfs/dbraw/zinc/86/29/99/939862999.db2.gz PMUKUYQZXXEAJC-KBXCAEBGSA-N 2 0 407.327 4.006 20 0 HIADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000543073079 939924918 /nfs/dbraw/zinc/92/49/18/939924918.db2.gz VSFMSDRFEXBFAD-KBPBESRZSA-N 2 0 405.892 4.397 20 0 HIADRP CCc1ccc([C@@H](CN2CCOCC2)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000543407418 940055332 /nfs/dbraw/zinc/05/53/32/940055332.db2.gz UCNVZMVCKYUHAN-AREMUKBSSA-N 2 0 407.602 4.008 20 0 HIADRP CC1(C(=O)N[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000543415820 940058362 /nfs/dbraw/zinc/05/83/62/940058362.db2.gz CMNPDESECVZSPG-DEOSSOPVSA-N 2 0 405.586 4.070 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cnn1-c1cc(C)ccc1C ZINC000543776316 940182495 /nfs/dbraw/zinc/18/24/95/940182495.db2.gz FZZOEDGVFFODBI-HYBUGGRVSA-N 2 0 418.585 4.215 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(Cl)cc1F ZINC000543776561 940182813 /nfs/dbraw/zinc/18/28/13/940182813.db2.gz YPOFGOSTJBLCLD-OAQYLSRUSA-N 2 0 405.945 4.257 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCCc3c(Br)cccc32)CC1 ZINC000544043702 940308697 /nfs/dbraw/zinc/30/86/97/940308697.db2.gz ODUFIXLBYAFLKM-PWRODBHTSA-N 2 0 407.396 4.184 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000544357683 940399889 /nfs/dbraw/zinc/39/98/89/940399889.db2.gz WUSHMHCNFZEEFF-ILBGXUMGSA-N 2 0 407.533 4.290 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H](c1ccc(F)cc1)c1cnc2ccccc2c1)N1CC[NH+](C)CC1 ZINC000544366706 940403270 /nfs/dbraw/zinc/40/32/70/940403270.db2.gz TYOUQQNSJIXEFA-CLJLJLNGSA-N 2 0 420.576 4.325 20 0 HIADRP Cc1cc([C@@H](C)[NH2+]CC(=O)Nc2cccc(C[NH+]3CCSCC3)c2)c(C)s1 ZINC000544401006 940412836 /nfs/dbraw/zinc/41/28/36/940412836.db2.gz UERIUCNSAKGAIW-MRXNPFEDSA-N 2 0 403.617 4.203 20 0 HIADRP C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000544488736 940454215 /nfs/dbraw/zinc/45/42/15/940454215.db2.gz OVPPTOJHMQTSKJ-SFHVURJKSA-N 2 0 416.997 4.406 20 0 HIADRP CCC[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1cccnc1 ZINC000544568336 940480891 /nfs/dbraw/zinc/48/08/91/940480891.db2.gz GMWBXEUNBKPPHN-HXUWFJFHSA-N 2 0 406.496 4.483 20 0 HIADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NCC1([NH2+][C@@H](C)c2ccccc2)CCCC1 ZINC000544657701 940499316 /nfs/dbraw/zinc/49/93/16/940499316.db2.gz ZOOJOLCKGMCNPN-VQTJNVASSA-N 2 0 400.611 4.022 20 0 HIADRP O=C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(C[NH+]2CCCC2)cc1 ZINC000548091874 941086466 /nfs/dbraw/zinc/08/64/66/941086466.db2.gz HKJRZFCJBSAENY-QILAJZQNSA-N 2 0 403.570 4.208 20 0 HIADRP C[C@H]([NH2+]C[C@@H](CO)Cc1ccc(C(F)(F)F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548154132 941089517 /nfs/dbraw/zinc/08/95/17/941089517.db2.gz FDLVCFMFHADPDV-NYVOZVTQSA-N 2 0 420.519 4.357 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(COC2CCOCC2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483857 941107956 /nfs/dbraw/zinc/10/79/56/941107956.db2.gz KNXUBLIFVWAQEL-BWKNWUBXSA-N 2 0 408.586 4.382 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)c1ccc(C[NH+]2CCCC2)cc1)c1cccc(C(F)(F)F)c1 ZINC000549035683 941146593 /nfs/dbraw/zinc/14/65/93/941146593.db2.gz HMZNZGQKOHKOCZ-NRFANRHFSA-N 2 0 419.491 4.334 20 0 HIADRP CC(C)[NH+]1CCC(C(=O)N[C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000549618026 941201556 /nfs/dbraw/zinc/20/15/56/941201556.db2.gz WOIQTLHBPYDQNX-MWWJCJHHSA-N 2 0 418.025 4.491 20 0 HIADRP CC[N@H+](CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)[C@@H](C)c1cccc(OC)c1 ZINC000549938454 941244070 /nfs/dbraw/zinc/24/40/70/941244070.db2.gz SNTRJEDOKYUZOV-NRFANRHFSA-N 2 0 423.601 4.167 20 0 HIADRP CC(C)[C@@]1(CO)CCC[NH+](Cc2ccccc2C[N@H+]2CCC[C@](CO)(C(C)C)C2)C1 ZINC000550433226 941326292 /nfs/dbraw/zinc/32/62/92/941326292.db2.gz FUIYSIVNGWRMMO-UIOOFZCWSA-N 2 0 416.650 4.148 20 0 HIADRP CC(C)[C@]1(CO)CCC[N@H+](Cc2cccc(C[NH+]3CCC[C@](CO)(C(C)C)C3)c2)C1 ZINC000550433509 941326722 /nfs/dbraw/zinc/32/67/22/941326722.db2.gz LWXSNONHHQZXGQ-WMPKNSHKSA-N 2 0 416.650 4.148 20 0 HIADRP CN1CC[C@H]([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)C[C@@H]1c1ccccc1 ZINC000550700360 941355646 /nfs/dbraw/zinc/35/56/46/941355646.db2.gz GCXDOGODEGCMCP-AZGAKELHSA-N 2 0 407.602 4.129 20 0 HIADRP Cc1cccc([C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C(=O)N2CCC(C[NH+](C)C)CC2)c1 ZINC000550714401 941357702 /nfs/dbraw/zinc/35/77/02/941357702.db2.gz ZMFSCZOGMNCJMM-FTJBHMTQSA-N 2 0 419.613 4.011 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccncc1F ZINC000550887413 941379666 /nfs/dbraw/zinc/37/96/66/941379666.db2.gz PZJPPAYSWWIJOY-KRWDZBQOSA-N 2 0 424.486 4.493 20 0 HIADRP CCn1nccc1[C@@H]1OCC[C@H]1C[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000552054085 941575040 /nfs/dbraw/zinc/57/50/40/941575040.db2.gz JQVXLCRSXRQLMC-SPIJCBKXSA-N 2 0 422.617 4.261 20 0 HIADRP CC[C@H](C(=O)N(C)C[C@H]1CC[NH+](Cc2ccc(C)s2)C1)[N@H+](C)Cc1ccccc1 ZINC000552133758 941591301 /nfs/dbraw/zinc/59/13/01/941591301.db2.gz ROVZJDOPVNHAJW-FYYLOGMGSA-N 2 0 413.631 4.247 20 0 HIADRP C[C@@H]([NH2+]CC(=O)NC1CC[NH+](C2CC2)CC1)c1ccccc1-c1ccc(Cl)cc1 ZINC000552980245 941811518 /nfs/dbraw/zinc/81/15/18/941811518.db2.gz RVZAJEZNFKROHH-QGZVFWFLSA-N 2 0 411.977 4.401 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(NC2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)c1 ZINC000554404456 942128276 /nfs/dbraw/zinc/12/82/76/942128276.db2.gz YTZHBVBZDYWNPV-AUSIDOKSSA-N 2 0 400.611 4.422 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COc1cccc2ccccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554448652 942147554 /nfs/dbraw/zinc/14/75/54/942147554.db2.gz ZWUKMKDWEKYUFF-NKKJXINNSA-N 2 0 404.554 4.080 20 0 HIADRP CC1CC[NH+](Cc2ccc(C[NH2+]CCC(=O)Nc3cc(F)cc(F)c3)cc2)CC1 ZINC000555900342 942768685 /nfs/dbraw/zinc/76/86/85/942768685.db2.gz ONWCIQPWCPTVBK-UHFFFAOYSA-N 2 0 401.501 4.315 20 0 HIADRP Cc1cc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)no1 ZINC000556236591 942824366 /nfs/dbraw/zinc/82/43/66/942824366.db2.gz SJDHDNVEQRZAKZ-KRWDZBQOSA-N 2 0 410.484 4.255 20 0 HIADRP CN1CC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000557337027 943076226 /nfs/dbraw/zinc/07/62/26/943076226.db2.gz ZDABOOFQVPSRPU-BDYUSTAISA-N 2 0 421.629 4.483 20 0 HIADRP CC(C)(C)[C@H]([NH2+]CC(=O)NC1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000557522241 943189307 /nfs/dbraw/zinc/18/93/07/943189307.db2.gz RXKGRRMXNYWARZ-HXUWFJFHSA-N 2 0 411.512 4.125 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+]C2(c3ccccc3)CCCC2)CC1 ZINC000557543878 943201624 /nfs/dbraw/zinc/20/16/24/943201624.db2.gz VGHSCXJJFWBMOC-UHFFFAOYSA-N 2 0 405.586 4.135 20 0 HIADRP c1ccc(C[C@@H]2CCC[NH+]2CC2(C[N@H+]3CCC[C@H]3Cc3ccccc3)COC2)cc1 ZINC000558604566 943615154 /nfs/dbraw/zinc/61/51/54/943615154.db2.gz SQOUEGOGERCJRT-UIOOFZCWSA-N 2 0 404.598 4.417 20 0 HIADRP COc1cccc2c1CC[C@@H]([NH2+]C[C@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)C2 ZINC000559891074 944076844 /nfs/dbraw/zinc/07/68/44/944076844.db2.gz NAZJQDMPOQBEMH-BJKOFHAPSA-N 2 0 420.597 4.071 20 0 HIADRP CC(=O)N1CCC(C[NH2+][C@@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)CC1 ZINC000559894400 944078190 /nfs/dbraw/zinc/07/81/90/944078190.db2.gz MINZGLDKAQEVEA-DEOSSOPVSA-N 2 0 403.586 4.227 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccccc3OCC(F)(F)F)cc2)CC1 ZINC000560092138 944156555 /nfs/dbraw/zinc/15/65/55/944156555.db2.gz LKDMPSDECVXAIQ-UHFFFAOYSA-N 2 0 408.464 4.391 20 0 HIADRP COc1ccc(OC(F)F)c(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c1 ZINC000560091851 944156685 /nfs/dbraw/zinc/15/66/85/944156685.db2.gz HYFVCLWJGHEKED-UHFFFAOYSA-N 2 0 406.473 4.059 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cnc(OC)c(Cl)c3)CC2)cc1 ZINC000560244089 944206147 /nfs/dbraw/zinc/20/61/47/944206147.db2.gz VQAPNIJMJGDPKY-INIZCTEOSA-N 2 0 403.954 4.315 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccc2c(c1)OCC(=O)N2 ZINC000560530118 944244698 /nfs/dbraw/zinc/24/46/98/944244698.db2.gz ZOSGALPTFHTGHS-MRXNPFEDSA-N 2 0 413.949 4.234 20 0 HIADRP Cc1ccc(OC(F)F)c(C[N@@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c1 ZINC000560567768 944256602 /nfs/dbraw/zinc/25/66/02/944256602.db2.gz FGKGGUIXSVLTAC-UHFFFAOYSA-N 2 0 409.565 4.225 20 0 HIADRP C[C@@H](C(=O)NC12CC3CC(CC(C3)C1)C2)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000560823161 944346692 /nfs/dbraw/zinc/34/66/92/944346692.db2.gz MJNCNBNHLQUJDP-LYAPCXFUSA-N 2 0 424.633 4.093 20 0 HIADRP CCOc1ccc([C@H](CC)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1OCC ZINC000560921720 944370508 /nfs/dbraw/zinc/37/05/08/944370508.db2.gz ZGSWFPDRSPPLAX-BDTNDASRSA-N 2 0 404.595 4.293 20 0 HIADRP CC1CC[NH+](Cc2ccc(NC(=O)C3CC[NH+]([C@@H]4CCSC4)CC3)cc2)CC1 ZINC000561162277 944490993 /nfs/dbraw/zinc/49/09/93/944490993.db2.gz NCDFJZCKXQJUGT-JOCHJYFZSA-N 2 0 401.620 4.075 20 0 HIADRP COC(=O)[C@@H](C)Oc1ccc(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000562213168 945022020 /nfs/dbraw/zinc/02/20/20/945022020.db2.gz DAFAIQPPCLLTHG-NFBKMPQASA-N 2 0 410.558 4.019 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H](c1ccc(Br)s1)C1CC1 ZINC000564366914 945533271 /nfs/dbraw/zinc/53/32/71/945533271.db2.gz CEKFKNWLNJMZOL-GOSISDBHSA-N 2 0 410.381 4.087 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)C1 ZINC000564506196 945635192 /nfs/dbraw/zinc/63/51/92/945635192.db2.gz QRSVTDYQUCOSIJ-DQEYMECFSA-N 2 0 421.972 4.375 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)cc2)CC1 ZINC000564744237 945745020 /nfs/dbraw/zinc/74/50/20/945745020.db2.gz MPKNRYJTILXCAF-MPIKPJSNSA-N 3 0 419.613 4.445 20 0 HIADRP CN1CC[C@H]([NH2+]C[C@@H](c2ccc(Cl)cc2)N2CCOCC2)C[C@@H]1c1ccccc1 ZINC000565097798 945774187 /nfs/dbraw/zinc/77/41/87/945774187.db2.gz SLCDDNRGPOFXFL-VXNXHJTFSA-N 2 0 413.993 4.138 20 0 HIADRP CC[NH+]1CCN(c2ccccc2NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000565263424 945796323 /nfs/dbraw/zinc/79/63/23/945796323.db2.gz QCNFLBFCORCLSX-UHFFFAOYSA-N 2 0 406.574 4.067 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]C[C@H]4CC[C@@H](c5nc(C6CC6)no5)O4)[C@H]3C2)cc1 ZINC000565673181 945864559 /nfs/dbraw/zinc/86/45/59/945864559.db2.gz CDRSJZOOMPGPTH-BFRACDOUSA-N 2 0 422.573 4.057 20 0 HIADRP O[C@H](C[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)COCc1ccc(Cl)cc1 ZINC000567188078 946263763 /nfs/dbraw/zinc/26/37/63/946263763.db2.gz ZKWFLVZBUKNPCA-LADGPHEKSA-N 2 0 416.993 4.109 20 0 HIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CCCc2cc(Br)ccc21 ZINC000568321007 946504738 /nfs/dbraw/zinc/50/47/38/946504738.db2.gz WMUZABKYRRJMRV-FQEVSTJZSA-N 2 0 418.379 4.342 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CC2 ZINC000568420432 946536188 /nfs/dbraw/zinc/53/61/88/946536188.db2.gz ARDXYZQDTQNQKQ-RCZVLFRGSA-N 2 0 406.570 4.201 20 0 HIADRP Brc1ccc(/C=C/CC[NH+]2CCC(CC[NH+]3CCOCC3)CC2)cc1 ZINC000568795746 946695434 /nfs/dbraw/zinc/69/54/34/946695434.db2.gz DNMSVFQWPDYXQI-HNQUOIGGSA-N 2 0 407.396 4.287 20 0 HIADRP CO[C@@H](C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1)c1ccc(Cl)cc1 ZINC000569200032 946837108 /nfs/dbraw/zinc/83/71/08/946837108.db2.gz OHCFECUCIZUWQL-QHCPKHFHSA-N 2 0 408.030 4.156 20 0 HIADRP CO[C@H](C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1)c1ccc(Cl)cc1 ZINC000569200031 946837183 /nfs/dbraw/zinc/83/71/83/946837183.db2.gz OHCFECUCIZUWQL-HSZRJFAPSA-N 2 0 408.030 4.156 20 0 HIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000569395727 946865816 /nfs/dbraw/zinc/86/58/16/946865816.db2.gz HPIAETFUKUJFSD-MKRMIXIUSA-N 2 0 416.512 4.438 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(Br)cn1 ZINC000569659695 946929091 /nfs/dbraw/zinc/92/90/91/946929091.db2.gz RDLFGTKJHMAMIT-MRXNPFEDSA-N 2 0 404.352 4.170 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000569678652 946938027 /nfs/dbraw/zinc/93/80/27/946938027.db2.gz RODIWURJTSYELX-HXUWFJFHSA-N 2 0 404.558 4.255 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](NC[C@@H]2CCCC[NH+](Cc3ccccc3)C2)[C@H](C)C1 ZINC000571573407 947708007 /nfs/dbraw/zinc/70/80/07/947708007.db2.gz QRZCYQVJRMADAI-VJTSUQJLSA-N 2 0 401.639 4.015 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(=O)N(C)Cc1cccc(F)c1 ZINC000572867382 948025990 /nfs/dbraw/zinc/02/59/90/948025990.db2.gz OOLICMNIDHWZBQ-PMACEKPBSA-N 2 0 411.565 4.194 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000573214972 948108417 /nfs/dbraw/zinc/10/84/17/948108417.db2.gz QONFDMYUFKMOKW-JOCHJYFZSA-N 2 0 410.949 4.144 20 0 HIADRP O=C(NCCC[NH+]1CCCC1)C1CC[NH+](Cc2cc(-c3ccccc3)cs2)CC1 ZINC000573366931 948169568 /nfs/dbraw/zinc/16/95/68/948169568.db2.gz XSXAHRUJJDICAM-UHFFFAOYSA-N 2 0 411.615 4.229 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(Cn3ccccc3=O)cc2)CC1 ZINC000574224108 948390990 /nfs/dbraw/zinc/39/09/90/948390990.db2.gz KITFVKXBQNPMOT-UHFFFAOYSA-N 2 0 415.581 4.429 20 0 HIADRP O=C(C[NH2+][C@@H](Cc1ccc(Cl)cc1)C1CCCCC1)NC1CC[NH+](C2CC2)CC1 ZINC000574423133 948435713 /nfs/dbraw/zinc/43/57/13/948435713.db2.gz KERFKKXSFLNJQY-QHCPKHFHSA-N 2 0 418.025 4.164 20 0 HIADRP COc1cc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc(OC)c1OCC(F)F ZINC000574481688 948454510 /nfs/dbraw/zinc/45/45/10/948454510.db2.gz ULGLUBRCWBEMPV-NVXWUHKLSA-N 2 0 412.521 4.090 20 0 HIADRP O=C(NCCC[NH+]1CCCC1)C1CC[NH+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000574678607 948503430 /nfs/dbraw/zinc/50/34/30/948503430.db2.gz WAGDJFKYJCCWGY-UHFFFAOYSA-N 2 0 405.586 4.168 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2c(c1)OCC(=O)N2 ZINC000575975421 948805846 /nfs/dbraw/zinc/80/58/46/948805846.db2.gz QIINIYUNDDFWTA-GUDVDZBRSA-N 2 0 407.558 4.346 20 0 HIADRP CCC[N@@H+]1CCCC[C@@H]1c1ccc(N(c2ncnc3c2CC[NH2+]CC3)C(C)C)nc1 ZINC001164663232 719344746 /nfs/dbraw/zinc/34/47/46/719344746.db2.gz XEHMIQCILNOYFD-JOCHJYFZSA-N 2 0 408.594 4.043 20 0 HIADRP COc1ccc2c(cc[nH+]c2N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)c1 ZINC001165023338 721805861 /nfs/dbraw/zinc/80/58/61/721805861.db2.gz JNWHBTPEMDRGQT-IGKWTDBASA-N 2 0 402.542 4.375 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3c[nH]nc3-c3ccsc3)CC2)c1 ZINC000436287381 861594526 /nfs/dbraw/zinc/59/45/26/861594526.db2.gz JDFURNQNIRWUBQ-UHFFFAOYSA-N 2 0 409.603 4.139 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000031097259 847821732 /nfs/dbraw/zinc/82/17/32/847821732.db2.gz RDEQNGUSHDCTFC-QFIPXVFZSA-N 2 0 414.619 4.095 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NC[C@H](c2ccc(OC)cc2)[NH+]2CCCC2)cc1 ZINC000036833802 848167441 /nfs/dbraw/zinc/16/74/41/848167441.db2.gz AQKJRZLXICCYPT-XMMPIXPASA-N 2 0 409.574 4.104 20 0 HIADRP Cc1cc(O)c(C(C)C)cc1C(=O)N(C)[C@@H]1CCCC[C@@H]1[N@H+](C)C1CCN(C)CC1 ZINC000436632181 861875769 /nfs/dbraw/zinc/87/57/69/861875769.db2.gz VRUNLBBZKKBJMD-XZOQPEGZSA-N 2 0 415.622 4.233 20 0 HIADRP C[C@H]1C[NH+](CCCNC(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)C[C@H](C)O1 ZINC000043391168 848417449 /nfs/dbraw/zinc/41/74/49/848417449.db2.gz HZSOLCTYMWOJFM-PMACEKPBSA-N 2 0 416.610 4.072 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)N2CCC([NH+]3CCCCC3)CC2)CC1 ZINC000045777799 848726349 /nfs/dbraw/zinc/72/63/49/848726349.db2.gz FHPZHXAODACVGZ-UHFFFAOYSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)N3CCC([NH+]4CCCCC4)CC3)cc2)C1 ZINC000045786428 848727371 /nfs/dbraw/zinc/72/73/71/848727371.db2.gz CRTXWABDRBLRSX-NRFANRHFSA-N 2 0 412.622 4.078 20 0 HIADRP Cc1ccccc1[C@H](OC[C@@H](O)C[NH+]1CCC(CC[NH+](C)C)CC1)c1ccccc1 ZINC000056523049 850383106 /nfs/dbraw/zinc/38/31/06/850383106.db2.gz SHGOAKYYKJGNOU-AZGAKELHSA-N 2 0 410.602 4.126 20 0 HIADRP C[NH+](C)CCC1CCN(C(=O)NCc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000057285779 850600870 /nfs/dbraw/zinc/60/08/70/850600870.db2.gz RUODSOTWVSCERB-UHFFFAOYSA-N 2 0 414.638 4.324 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000058614799 850868375 /nfs/dbraw/zinc/86/83/75/850868375.db2.gz LTQYGPHIBNBXKR-HDICACEKSA-N 2 0 418.632 4.083 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC[C@@H](c3ccccc3)[NH+](C)C)cc2)C1 ZINC000060954479 851257796 /nfs/dbraw/zinc/25/77/96/851257796.db2.gz OCBFSMUATRWBEU-YKSBVNFPSA-N 2 0 408.590 4.021 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)cc2c1OCCO2 ZINC000061070912 851288456 /nfs/dbraw/zinc/28/84/56/851288456.db2.gz RAZMOYCBOAADEK-OALUTQOASA-N 2 0 410.558 4.234 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000061070517 851288634 /nfs/dbraw/zinc/28/86/34/851288634.db2.gz AMHKTICGZONLEF-HSZRJFAPSA-N 2 0 424.589 4.292 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)cc1 ZINC000061867728 851463151 /nfs/dbraw/zinc/46/31/51/851463151.db2.gz KFQLKXVIEZTAME-GCJKJVERSA-N 2 0 414.619 4.225 20 0 HIADRP Cc1nn(Cc2ccccc2Cl)c(C)c1C[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000062252970 851517353 /nfs/dbraw/zinc/51/73/53/851517353.db2.gz RIQJEJSIQGHOFK-ROUUACIJSA-N 2 0 419.013 4.181 20 0 HIADRP CCCc1cc[n+](C(C(=O)c2ccc(C)c(C)c2)C(=S)NC2CC[NH+](C)CC2)cc1 ZINC000063441362 851690320 /nfs/dbraw/zinc/69/03/20/851690320.db2.gz DNIWGKBDYVZVHC-UHFFFAOYSA-O 2 0 424.634 4.166 20 0 HIADRP CC1(C)CC(NC(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)CC(C)(C)[NH2+]1 ZINC000063799534 851767762 /nfs/dbraw/zinc/76/77/62/851767762.db2.gz RMFPUIBPTJLNAT-UHFFFAOYSA-N 2 0 400.611 4.171 20 0 HIADRP C[C@H](C(=O)Nc1ccccc1-c1ccccc1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000064344473 851875302 /nfs/dbraw/zinc/87/53/02/851875302.db2.gz QDICTOLCZNMBRV-OAQYLSRUSA-N 2 0 421.585 4.115 20 0 HIADRP Cc1ccc(C[N@@H+](CC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)C(C)C)s1 ZINC000065162414 852082566 /nfs/dbraw/zinc/08/25/66/852082566.db2.gz PNWOPKXMLDTPTR-UHFFFAOYSA-N 2 0 413.631 4.356 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)NCc2ccccc2C[NH+]2CCCCC2)C1 ZINC000065522346 852167110 /nfs/dbraw/zinc/16/71/10/852167110.db2.gz MGMWNNZGIIOKSR-BWKNWUBXSA-N 2 0 420.601 4.307 20 0 HIADRP CCc1ccc([C@H](CNC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)[NH+](C)C)cc1 ZINC000071913251 852430137 /nfs/dbraw/zinc/43/01/37/852430137.db2.gz MDOHLVQVPSJNLV-LEWJYISDSA-N 2 0 414.619 4.050 20 0 HIADRP COc1ccccc1[C@@H](CNC(=O)[C@H]1CCC[N@@H+]1Cc1ccccc1)[NH+]1CCCCC1 ZINC000108934212 852895364 /nfs/dbraw/zinc/89/53/64/852895364.db2.gz DXTZVTYDYJYJJM-DNQXCXABSA-N 2 0 421.585 4.003 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H](c2cccc(OC)c2)[NH+]2CCCC2)cc1)C(C)C ZINC000110165668 853068319 /nfs/dbraw/zinc/06/83/19/853068319.db2.gz MCNFJLNAFSTQBB-RUZDIDTESA-N 2 0 423.601 4.492 20 0 HIADRP C[NH+](C)CCc1ccc(NC(=O)[C@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000110867357 853159315 /nfs/dbraw/zinc/15/93/15/853159315.db2.gz PYRXYBJJYGOEJJ-QFIPXVFZSA-N 2 0 419.491 4.184 20 0 HIADRP C[C@H](CNC(=O)[C@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000110913347 853167380 /nfs/dbraw/zinc/16/73/80/853167380.db2.gz JNHJJGBENUSWFD-YADHBBJMSA-N 2 0 407.602 4.139 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000139927476 853427229 /nfs/dbraw/zinc/42/72/29/853427229.db2.gz RNJYREHXIGLGNT-HXUWFJFHSA-N 2 0 418.651 4.054 20 0 HIADRP COc1c(Br)cc(Br)cc1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000227327456 853885323 /nfs/dbraw/zinc/88/53/23/853885323.db2.gz XNQAOGPHVONYEW-UHFFFAOYSA-N 2 0 420.189 4.042 20 0 HIADRP c1cn(Cc2ccc(C[NH2+]Cc3cn(-c4ccccc4)nc3-c3ccncc3)cc2)cn1 ZINC000236584641 853900713 /nfs/dbraw/zinc/90/07/13/853900713.db2.gz NMZSOYYXMLTIBE-UHFFFAOYSA-N 2 0 420.520 4.469 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+]Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 ZINC000236940900 853940440 /nfs/dbraw/zinc/94/04/40/853940440.db2.gz HQHJBSVBSXQPOW-UHFFFAOYSA-N 2 0 409.496 4.473 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2cc3ccccc3nc2N2CCCCC2)cc1 ZINC000236981341 853946524 /nfs/dbraw/zinc/94/65/24/853946524.db2.gz QYOSAJKDZXUWLL-UHFFFAOYSA-N 2 0 418.585 4.455 20 0 HIADRP COc1ccc([C@@H](CNC2CC[NH+](Cc3ccccc3)CC2)[NH+]2CCCCC2)cc1 ZINC000237321672 854006054 /nfs/dbraw/zinc/00/60/54/854006054.db2.gz MBYOWNILQWFVNT-AREMUKBSSA-N 2 0 407.602 4.476 20 0 HIADRP Cc1cccc(-c2n[nH]cc2C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)c1 ZINC000237573611 854056531 /nfs/dbraw/zinc/05/65/31/854056531.db2.gz IHBZXTABOVPPBV-WOJBJXKFSA-N 2 0 404.558 4.284 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2csc(COc3ccc(Cl)cc3)n2)C[C@H](C)O1 ZINC000237610564 854061882 /nfs/dbraw/zinc/06/18/82/854061882.db2.gz RMSQHTBEERCLFY-CALCHBBNSA-N 2 0 424.010 4.355 20 0 HIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2cc3ccccc3nc2N2CCCCC2)C[C@H](C)O1 ZINC000237774182 854093851 /nfs/dbraw/zinc/09/38/51/854093851.db2.gz CRGFNFCKNHNKDM-SFTDATJTSA-N 2 0 410.606 4.204 20 0 HIADRP Fc1ccc(-c2nc(CC[NH2+]Cc3ccc(OCC[NH+]4CCCC4)cc3)co2)cc1 ZINC000237929117 854120745 /nfs/dbraw/zinc/12/07/45/854120745.db2.gz UEQBHZFAMUXFRU-UHFFFAOYSA-N 2 0 409.505 4.288 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+]Cc1ccc(-c2cccc(Br)c2)o1 ZINC000237964673 854126585 /nfs/dbraw/zinc/12/65/85/854126585.db2.gz POEHDFKHWXVRPT-SFHVURJKSA-N 2 0 407.352 4.036 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+]Cc1sc(Sc2ccccc2)nc1Cl ZINC000237965865 854126668 /nfs/dbraw/zinc/12/66/68/854126668.db2.gz XIJGUGTVKDKGNT-HNNXBMFYSA-N 2 0 412.024 4.274 20 0 HIADRP Fc1ccc(-c2nc(C[NH2+]CCCN3CC[NH+](Cc4ccccc4)CC3)cs2)cc1 ZINC000303000976 854717030 /nfs/dbraw/zinc/71/70/30/854717030.db2.gz ZNEMYBWYZMZSOY-UHFFFAOYSA-N 2 0 424.589 4.247 20 0 HIADRP Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000303152166 854787194 /nfs/dbraw/zinc/78/71/94/854787194.db2.gz FOLRURBWZVHRPO-FCHUYYIVSA-N 2 0 407.602 4.405 20 0 HIADRP CC1CC[NH+](Cc2cccc(CNC(=O)N3CCC[C@@H]3C[NH+]3CCCCC3)c2)CC1 ZINC000303291303 854855699 /nfs/dbraw/zinc/85/56/99/854855699.db2.gz OFLFDHBOSMQFDA-XMMPIXPASA-N 2 0 412.622 4.078 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NCC(C)(C)[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC000303647568 855103507 /nfs/dbraw/zinc/10/35/07/855103507.db2.gz JNLNIBQGPPTCNC-UXHICEINSA-N 2 0 400.611 4.022 20 0 HIADRP CC(C)(C)OC(=O)N1CCC[C@@H]([NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000309710187 855363875 /nfs/dbraw/zinc/36/38/75/855363875.db2.gz JAAARKXARXPWCX-ZJSXRUAMSA-N 2 0 401.595 4.278 20 0 HIADRP C[C@H](CCCNC(=O)OC(C)(C)C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390526225 855455017 /nfs/dbraw/zinc/45/50/17/855455017.db2.gz CNQQJIZIDQIJBW-VEEZFSHISA-N 2 0 401.595 4.465 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000398045435 855475555 /nfs/dbraw/zinc/47/55/55/855475555.db2.gz VLLTXPSIHNMLNS-HJNYFJLDSA-N 2 0 401.595 4.134 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)NC2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000410308492 855919761 /nfs/dbraw/zinc/91/97/61/855919761.db2.gz WRCMIXOMVYRXIM-UHFFFAOYSA-N 2 0 422.617 4.035 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NCc2ccccc2C[N@@H+](C)C(C)C)CC1 ZINC000410317311 855924915 /nfs/dbraw/zinc/92/49/15/855924915.db2.gz BVRWZYZHTHKBOO-UHFFFAOYSA-N 2 0 422.617 4.299 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000410338268 855936194 /nfs/dbraw/zinc/93/61/94/855936194.db2.gz NJQDTWCQXVSHTL-HSZRJFAPSA-N 2 0 424.589 4.148 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)CC1 ZINC000410337320 855936443 /nfs/dbraw/zinc/93/64/43/855936443.db2.gz NIDFESBLAPNIBA-JOCHJYFZSA-N 2 0 414.638 4.372 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC[C@H](c3ccccc3)[NH+](C)C)cc2)C1 ZINC000410359703 855949618 /nfs/dbraw/zinc/94/96/18/855949618.db2.gz OCBFSMUATRWBEU-HYBUGGRVSA-N 2 0 408.590 4.021 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)CC1 ZINC000410374736 855959706 /nfs/dbraw/zinc/95/97/06/855959706.db2.gz NLEYNFQGNOFNGG-OAQYLSRUSA-N 2 0 414.638 4.182 20 0 HIADRP Cc1ccc(-c2nnc([C@H](C)[NH+]3CCC(CC[NH+]4C[C@@H](C)O[C@H](C)C4)CC3)o2)cc1 ZINC000426788215 856477719 /nfs/dbraw/zinc/47/77/19/856477719.db2.gz LFAJYWHQJDTVFY-AQNXPRMDSA-N 2 0 412.578 4.317 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CCCc4ncc(C(F)(F)F)cc43)cc2)CC1 ZINC000427582966 856877722 /nfs/dbraw/zinc/87/77/22/856877722.db2.gz KMMCOWPXXHMPGP-NRFANRHFSA-N 2 0 418.507 4.015 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCc3ncc(C(F)(F)F)cc32)(N2CCCCC2)CC1 ZINC000427721481 856922258 /nfs/dbraw/zinc/92/22/58/856922258.db2.gz QDQMAADXESWZKT-HXUWFJFHSA-N 2 0 410.528 4.018 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC000428369178 857178935 /nfs/dbraw/zinc/17/89/35/857178935.db2.gz HPZZFLVZZOHSFO-OFVILXPXSA-N 2 0 422.617 4.379 20 0 HIADRP Cn1cc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c(C(F)(F)F)n1 ZINC000428457421 857208899 /nfs/dbraw/zinc/20/88/99/857208899.db2.gz WZDCZGVOQWLERX-DFQSSKMNSA-N 2 0 406.496 4.219 20 0 HIADRP c1cc(C[NH+]2CCOC[C@H](C3CCC3)C2)cc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c1 ZINC000428998713 857449941 /nfs/dbraw/zinc/44/99/41/857449941.db2.gz DGNLJEUBCHXZPW-CLJLJLNGSA-N 2 0 412.618 4.184 20 0 HIADRP COc1ccccc1-n1nccc1C[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000430019898 858000080 /nfs/dbraw/zinc/00/00/80/858000080.db2.gz NZYWYQORKXXEHJ-UHFFFAOYSA-N 2 0 404.558 4.403 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000430669724 858260690 /nfs/dbraw/zinc/26/06/90/858260690.db2.gz ULBZCNLQSYJRER-NQHRYMMQSA-N 2 0 405.586 4.068 20 0 HIADRP Cc1ccc(NC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c(OCC[NH+](C)C)c1 ZINC000431196359 858498270 /nfs/dbraw/zinc/49/82/70/858498270.db2.gz LERCVHKVONBRFE-IRLDBZIGSA-N 2 0 424.589 4.110 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000437695189 863031255 /nfs/dbraw/zinc/03/12/55/863031255.db2.gz OPRVBSQWSBLTSF-HSZRJFAPSA-N 2 0 424.589 4.145 20 0 HIADRP C[N@@H+]1CCCC[C@@H]1CCC(=O)N1CCC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000431630525 858700486 /nfs/dbraw/zinc/70/04/86/858700486.db2.gz LJKZEUDTBLCHBL-HXUWFJFHSA-N 2 0 411.512 4.004 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)NC2CC[NH+](C3CCCCC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000431667322 858725806 /nfs/dbraw/zinc/72/58/06/858725806.db2.gz YMWDMUWKAKRDQN-REWPJTCUSA-N 2 0 412.622 4.136 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000431695028 858743641 /nfs/dbraw/zinc/74/36/41/858743641.db2.gz VXWCOSYSNKHUBE-PUHATCMVSA-N 2 0 424.589 4.159 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccco1 ZINC000431697478 858747033 /nfs/dbraw/zinc/74/70/33/858747033.db2.gz IDZALAPNPQKZNV-ILWGZMRPSA-N 2 0 412.578 4.015 20 0 HIADRP COc1ccccc1[C@@H](CNC(=O)C[C@H](c1ccccc1)[NH+](C)C)[NH+]1CCCCC1 ZINC000431727878 858768170 /nfs/dbraw/zinc/76/81/70/858768170.db2.gz LVJOQYDUGRSOLC-DHIUTWEWSA-N 2 0 409.574 4.031 20 0 HIADRP C[C@H]1C[N@H+](CCC[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccccc2)CCCO1 ZINC000432347744 859113158 /nfs/dbraw/zinc/11/31/58/859113158.db2.gz QKHRSQYIYYNAQY-QFIPXVFZSA-N 2 0 418.585 4.189 20 0 HIADRP C[C@@H]1C[N@H+](CCC[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccs2)CCCO1 ZINC000432365669 859123474 /nfs/dbraw/zinc/12/34/74/859123474.db2.gz WODZQEMAEKISFS-HXUWFJFHSA-N 2 0 424.614 4.250 20 0 HIADRP O[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000432411606 859152082 /nfs/dbraw/zinc/15/20/82/859152082.db2.gz ZNKURPJFMLUFSI-APHPEJJXSA-N 2 0 407.396 4.053 20 0 HIADRP COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000433126776 859530916 /nfs/dbraw/zinc/53/09/16/859530916.db2.gz PPKGZMMINJAVPO-HXUWFJFHSA-N 2 0 407.558 4.010 20 0 HIADRP C[C@@H](c1ccccc1)N(C)C(=O)C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433174254 859554138 /nfs/dbraw/zinc/55/41/38/859554138.db2.gz IUDVZVRMZCPGTI-QFIPXVFZSA-N 2 0 405.586 4.194 20 0 HIADRP CC1CC[NH+](C2CCC([NH2+][C@H](c3ccc(Cl)cc3)[C@@H]3CN(C)CCO3)CC2)CC1 ZINC000467734922 881536532 /nfs/dbraw/zinc/53/65/32/881536532.db2.gz KGKGKDMXSMXMLW-STTLMXHVSA-N 2 0 420.041 4.344 20 0 HIADRP CC[NH+]1CCN(c2ccccc2C[NH+]2CCC(C(=O)c3ccc(F)cc3)CC2)CC1 ZINC000435052809 860616213 /nfs/dbraw/zinc/61/62/13/860616213.db2.gz KAPBUZJUSBLKPY-UHFFFAOYSA-N 2 0 409.549 4.063 20 0 HIADRP c1ccc(OC2CC[NH+](CCCCC[NH+]3CCC(Oc4ccccn4)CC3)CC2)nc1 ZINC000437890519 863255327 /nfs/dbraw/zinc/25/53/27/863255327.db2.gz PJYDNOFPVHHZQM-UHFFFAOYSA-N 2 0 424.589 4.034 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc2nc(C3CC3)sc2c1 ZINC000438097457 863501163 /nfs/dbraw/zinc/50/11/63/863501163.db2.gz TYCGUPBHLFFRMG-GOSISDBHSA-N 2 0 415.607 4.054 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)cc1)C1CC1 ZINC000438712457 864194591 /nfs/dbraw/zinc/19/45/91/864194591.db2.gz HZMCJIUUOJWUKG-UHFFFAOYSA-N 2 0 405.586 4.408 20 0 HIADRP C[C@H]1CN(Cc2cccc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)c2)CCO1 ZINC000438834869 864330003 /nfs/dbraw/zinc/33/00/03/864330003.db2.gz VHEAEOYKVRFLGT-CCGQDMKZSA-N 2 0 421.629 4.440 20 0 HIADRP c1ccc(C[NH+]2CCC([C@H]3CCCO3)CC2)c(C[NH+]2CCC([C@H]3CCCO3)CC2)c1 ZINC000439273980 864693441 /nfs/dbraw/zinc/69/34/41/864693441.db2.gz NMLRNMFSRPYRSX-CLJLJLNGSA-N 2 0 412.618 4.469 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCN(c2ccccc2Cl)C1=O ZINC000439592502 864915137 /nfs/dbraw/zinc/91/51/37/864915137.db2.gz DVZCHOQHRRSTQL-QFIPXVFZSA-N 2 0 423.944 4.460 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N1c2ccccc2C[C@@H]1C ZINC000439595408 864918792 /nfs/dbraw/zinc/91/87/92/864918792.db2.gz JXLQMAOBGNPIBC-PMACEKPBSA-N 2 0 417.553 4.368 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N1CCc2sccc2C1 ZINC000439600193 864924416 /nfs/dbraw/zinc/92/44/16/864924416.db2.gz YAMRNSDSAPXXTN-SFHVURJKSA-N 2 0 423.582 4.036 20 0 HIADRP Cc1nc(NC(=O)[C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)sc1C ZINC000439612903 864937236 /nfs/dbraw/zinc/93/72/36/864937236.db2.gz ULPSPLMAFULUEQ-INIZCTEOSA-N 2 0 412.559 4.102 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](CC(C)C)[NH2+][C@@H](C)c2ccccc2)C[C@@H]1C ZINC000468025570 881859957 /nfs/dbraw/zinc/85/99/57/881859957.db2.gz IZUFQEQHUOIBMT-SQOUVECCSA-N 2 0 402.627 4.266 20 0 HIADRP c1cc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)ccc1C[NH+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441274689 866348908 /nfs/dbraw/zinc/34/89/08/866348908.db2.gz HBHMWEYOVAACHI-FATVKVNYSA-N 2 0 412.618 4.184 20 0 HIADRP C[C@H](OC[C@H](O)C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(Cl)cc1 ZINC000441623171 866719472 /nfs/dbraw/zinc/71/94/72/866719472.db2.gz SVKBSZYIJJJSIJ-ZCVJKFOLSA-N 2 0 416.993 4.232 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC000444653079 868933100 /nfs/dbraw/zinc/93/31/00/868933100.db2.gz TZTYWKLJSABROR-UHFFFAOYSA-N 2 0 413.631 4.331 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NCC1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000446432942 870351278 /nfs/dbraw/zinc/35/12/78/870351278.db2.gz MLRFACLKHVSSNF-HXUWFJFHSA-N 2 0 411.512 4.079 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)Nc3ccccc3CC[NH+](C)C)cc2)CC1 ZINC000446569508 870481614 /nfs/dbraw/zinc/48/16/14/870481614.db2.gz OTCIATBWQBERHS-UHFFFAOYSA-N 2 0 408.590 4.344 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)Nc1ccccc1CC[NH+](C)C ZINC000446577616 870487888 /nfs/dbraw/zinc/48/78/88/870487888.db2.gz WIKOJJRQXSSLAU-FQEVSTJZSA-N 2 0 408.590 4.487 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[NH2+]CC4CC[NH+](C5CC5)CC4)cc3)nc12 ZINC000446885628 870805254 /nfs/dbraw/zinc/80/52/54/870805254.db2.gz AFUUGSAYUKAEKO-UHFFFAOYSA-N 2 0 404.558 4.186 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](CCc2cc(Cl)cc(Cl)c2)CC1 ZINC000447137666 871038773 /nfs/dbraw/zinc/03/87/73/871038773.db2.gz WTDPEZITPFLDIH-UHFFFAOYSA-N 2 0 414.421 4.096 20 0 HIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c2ccccc21 ZINC000447531212 871396698 /nfs/dbraw/zinc/39/66/98/871396698.db2.gz QGMSLAAXSOBIMJ-TUSQITKMSA-N 2 0 405.586 4.358 20 0 HIADRP COc1ccccc1N1CCC([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000447543766 871411527 /nfs/dbraw/zinc/41/15/27/871411527.db2.gz SDZAALXHVDNNIV-BKFWDETESA-N 2 0 405.586 4.449 20 0 HIADRP c1ccc(CC[NH+]2CCC(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)CC2)cc1 ZINC000447563074 871458207 /nfs/dbraw/zinc/45/82/07/871458207.db2.gz NYRVLYXVRVPGQR-OJXFFNQFSA-N 2 0 403.614 4.479 20 0 HIADRP C[NH+](C)CCOCC[NH2+][C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000447603312 871511368 /nfs/dbraw/zinc/51/13/68/871511368.db2.gz XMEBAJGUAAWTLI-INIZCTEOSA-N 2 0 424.408 4.118 20 0 HIADRP FC(F)(F)[C@@]1(c2nc(-c3ccn4c[nH+]cc4c3)no2)CC[N@H+](Cc2ccccc2)C1 ZINC000447949466 871820330 /nfs/dbraw/zinc/82/03/30/871820330.db2.gz YGFCLIKCAVBPGT-FQEVSTJZSA-N 2 0 413.403 4.090 20 0 HIADRP Cc1ccc(N[C@@H]2C[C@@H](C)C[N@@H+](Cc3ccccc3)C2)cc1NC(=O)CC[NH+](C)C ZINC000468686292 882811631 /nfs/dbraw/zinc/81/16/31/882811631.db2.gz UUJTXZILAQEQJT-AUSIDOKSSA-N 2 0 408.590 4.208 20 0 HIADRP C[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)N(C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC000461723806 874871219 /nfs/dbraw/zinc/87/12/19/874871219.db2.gz JEWNCVUGFFRPFJ-OTNCWRBYSA-N 2 0 422.617 4.201 20 0 HIADRP CCOc1cc(C[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)ccc1OCC(C)C ZINC000462734572 875807194 /nfs/dbraw/zinc/80/71/94/875807194.db2.gz JFUWPCVCRKUYDN-UHFFFAOYSA-N 2 0 417.638 4.160 20 0 HIADRP COC(=O)c1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)n(C)c1C ZINC000462785659 875839030 /nfs/dbraw/zinc/83/90/30/875839030.db2.gz QVLIGEOECGGAIG-UHFFFAOYSA-N 2 0 405.542 4.139 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@@H]2CCCc3ccc(O)cc32)CC1 ZINC000462802861 875851959 /nfs/dbraw/zinc/85/19/59/875851959.db2.gz HYNYPOBTBYDLIL-OAQYLSRUSA-N 2 0 419.491 4.330 20 0 HIADRP CC(=O)NC1CCC([NH2+][C@@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)CC1 ZINC000462818650 875858576 /nfs/dbraw/zinc/85/85/76/875858576.db2.gz KCUWMKTZNRCEDT-VHYCJAOWSA-N 2 0 403.586 4.416 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+]CCc2cccc(C(N)=O)c2)c2ccc(F)cc2)CC1 ZINC000462823393 875861953 /nfs/dbraw/zinc/86/19/53/875861953.db2.gz UGVATQGZLJZECK-DEOSSOPVSA-N 2 0 411.565 4.310 20 0 HIADRP Fc1ccc(CCN2CCC([NH2+]CC3CC[NH+](Cc4ccccc4)CC3)CC2)cc1 ZINC000463071713 876102629 /nfs/dbraw/zinc/10/26/29/876102629.db2.gz BLCUBDOUNSSCQG-UHFFFAOYSA-N 2 0 409.593 4.334 20 0 HIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000463080169 876111309 /nfs/dbraw/zinc/11/13/09/876111309.db2.gz SJCGLVGZWZIPHQ-NHCUHLMSSA-N 2 0 412.622 4.336 20 0 HIADRP COc1cccc([C@H](CN[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[NH+]2CCCC2)c1 ZINC000463139451 876190096 /nfs/dbraw/zinc/19/00/96/876190096.db2.gz GYDRXIFBMYBQIX-CVJWPJSTSA-N 2 0 407.602 4.475 20 0 HIADRP COc1cccc(N2CCC[C@@H]([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000463285890 876345181 /nfs/dbraw/zinc/34/51/81/876345181.db2.gz UUORXWHMYUAVCI-BRNHRJKVSA-N 2 0 405.586 4.449 20 0 HIADRP COc1cccc(N2CC[C@H](C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000463286797 876345890 /nfs/dbraw/zinc/34/58/90/876345890.db2.gz LRLKZLRLWZRFBX-BRNHRJKVSA-N 2 0 405.586 4.307 20 0 HIADRP COc1cccc(N2CC[C@@H](C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000463286798 876346835 /nfs/dbraw/zinc/34/68/35/876346835.db2.gz LRLKZLRLWZRFBX-GTSJCLCLSA-N 2 0 405.586 4.307 20 0 HIADRP C[C@@H]1CN(Cc2cccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2)CCO1 ZINC000463304246 876364526 /nfs/dbraw/zinc/36/45/26/876364526.db2.gz VHMHWWXCJUXDFL-JFHCNKDXSA-N 2 0 419.613 4.193 20 0 HIADRP C[C@@H]1CCN(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000465398072 878834391 /nfs/dbraw/zinc/83/43/91/878834391.db2.gz AZVYXGZTMBZECG-FYYLOGMGSA-N 2 0 424.589 4.113 20 0 HIADRP C[C@H]1CCN(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000465398074 878834841 /nfs/dbraw/zinc/83/48/41/878834841.db2.gz AZVYXGZTMBZECG-GMAHTHKFSA-N 2 0 424.589 4.113 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000465517955 878967317 /nfs/dbraw/zinc/96/73/17/878967317.db2.gz CSLLBLKEXGJHKC-VWLOTQADSA-N 2 0 422.617 4.192 20 0 HIADRP C[C@H]1CCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000465588568 879070713 /nfs/dbraw/zinc/07/07/13/879070713.db2.gz BOSVMBYGSHNXIT-QFIPXVFZSA-N 2 0 420.601 4.088 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCC[NH+]1CCC[C@@H](C)C1 ZINC000465612042 879110117 /nfs/dbraw/zinc/11/01/17/879110117.db2.gz YEHMAGCTGLRQJQ-VWNXMTODSA-N 2 0 414.638 4.052 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[NH+]2C)C1CCCCC1 ZINC000465733605 879315049 /nfs/dbraw/zinc/31/50/49/879315049.db2.gz YICHDSHUKPHALG-DIMPSALBSA-N 2 0 412.622 4.266 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)[NH+](C)C)cc1 ZINC000465811483 879431548 /nfs/dbraw/zinc/43/15/48/879431548.db2.gz JNMUTRLJBFCCOS-ONTIZHBOSA-N 2 0 414.619 4.042 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCC2)c1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000503446612 912468912 /nfs/dbraw/zinc/46/89/12/912468912.db2.gz LSHBZNHWYJAQLB-XMMPIXPASA-N 2 0 412.622 4.080 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000503451637 912473395 /nfs/dbraw/zinc/47/33/95/912473395.db2.gz KZPSMEQBDWXQNG-XMMPIXPASA-N 2 0 414.638 4.326 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000465981047 879653326 /nfs/dbraw/zinc/65/33/26/879653326.db2.gz GEECFUXYAJJLJR-HOTGVXAUSA-N 2 0 415.409 4.112 20 0 HIADRP CCCOc1ccc(Cl)cc1NC(=O)NCC1([NH+]2CCCCC2)CCN(C)CC1 ZINC000466162228 879865018 /nfs/dbraw/zinc/86/50/18/879865018.db2.gz ZQSUPEDSUFMXPC-UHFFFAOYSA-N 2 0 423.001 4.201 20 0 HIADRP O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000503505454 912552909 /nfs/dbraw/zinc/55/29/09/912552909.db2.gz UQTYIKZIKSTKDB-YADHBBJMSA-N 2 0 416.610 4.104 20 0 HIADRP O=C(CC[NH+]1CCC(OCC[NH+]2CCCC2)CC1)Nc1ccccc1-c1ccccc1 ZINC000467201502 880931551 /nfs/dbraw/zinc/93/15/51/880931551.db2.gz LPMXOGKSVFRALA-UHFFFAOYSA-N 2 0 421.585 4.259 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccnn1-c1ccccc1 ZINC000467313042 881061088 /nfs/dbraw/zinc/06/10/88/881061088.db2.gz KZSXTRHDMBWGFB-NJDAHSKKSA-N 2 0 404.558 4.332 20 0 HIADRP CN(C(=O)[C@H]1CCCC[N@@H+]1Cc1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000469493191 883732001 /nfs/dbraw/zinc/73/20/01/883732001.db2.gz CIGKFFLBKJTNMR-RUZDIDTESA-N 2 0 405.586 4.164 20 0 HIADRP OC[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1c(F)cccc1Cl ZINC000470248667 884582946 /nfs/dbraw/zinc/58/29/46/884582946.db2.gz QUQQFQSFPGSVBT-UDEWTMQYSA-N 2 0 416.968 4.415 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC000470749274 885214680 /nfs/dbraw/zinc/21/46/80/885214680.db2.gz LWOFUXONRMSUJS-CQOQZXRMSA-N 2 0 414.638 4.051 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+](Cc2cccc(C(F)F)c2)CC1)Cc1ccccc1 ZINC000470768687 885233133 /nfs/dbraw/zinc/23/31/33/885233133.db2.gz CUGXFCZUKGHHIN-UHFFFAOYSA-N 2 0 415.528 4.084 20 0 HIADRP C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000471593797 886305702 /nfs/dbraw/zinc/30/57/02/886305702.db2.gz NBBWKYVCINOINK-IBGZPJMESA-N 2 0 411.590 4.086 20 0 HIADRP Cc1ccc(C)c2c1CCC[C@H]2[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000472138340 886931730 /nfs/dbraw/zinc/93/17/30/886931730.db2.gz LYQSRZULQWADDT-LADGPHEKSA-N 2 0 405.586 4.168 20 0 HIADRP CC[NH+](CC)CCO[C@H]1CC[N@@H+]([C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1 ZINC000472257597 887068426 /nfs/dbraw/zinc/06/84/26/887068426.db2.gz IIBMHKWUHNQDBD-RDPSFJRHSA-N 2 0 409.574 4.433 20 0 HIADRP C[C@H](CCNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[N@H+](C)Cc1ccccc1 ZINC000473014619 887842519 /nfs/dbraw/zinc/84/25/19/887842519.db2.gz KMBCGDFOXKPVTD-JOCHJYFZSA-N 2 0 422.617 4.203 20 0 HIADRP c1ccc2c(c1)CO[C@]21CC[N@@H+](CCCCC[NH+]2CC[C@]3(C2)OCc2ccccc23)C1 ZINC000473154065 887932947 /nfs/dbraw/zinc/93/29/47/887932947.db2.gz ZEBJRFKVQOVLMI-MKPDMIMOSA-N 2 0 418.581 4.420 20 0 HIADRP c1ccc2c(c1)CO[C@]21CC[NH+](CCCCC[N@@H+]2CC[C@@]3(C2)OCc2ccccc23)C1 ZINC000473154067 887933125 /nfs/dbraw/zinc/93/31/25/887933125.db2.gz ZEBJRFKVQOVLMI-SVBPBHIXSA-N 2 0 418.581 4.420 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC1CC([NH+]2CCC(C(F)(F)F)CC2)C1 ZINC000473536115 888272941 /nfs/dbraw/zinc/27/29/41/888272941.db2.gz ZIGWAAMHLOMVTL-UHFFFAOYSA-N 2 0 423.479 4.030 20 0 HIADRP CCN(C(=O)NC1CC[NH+](C2CCCC2)CC1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473740200 888521628 /nfs/dbraw/zinc/52/16/28/888521628.db2.gz POPPFNSLYGMSCM-GBXCKJPGSA-N 2 0 412.622 4.260 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCN(c2ccc(Cl)cc2Cl)C1 ZINC000474021765 888874040 /nfs/dbraw/zinc/87/40/40/888874040.db2.gz NHJGUEMWXLZRKM-QGZVFWFLSA-N 2 0 402.329 4.251 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)[C@@H](C)c1nc2ccccc2s1 ZINC000474467552 889330084 /nfs/dbraw/zinc/33/00/84/889330084.db2.gz BMKUWBLRSNPGCC-RTBURBONSA-N 2 0 408.615 4.326 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474806572 889659089 /nfs/dbraw/zinc/65/90/89/889659089.db2.gz FJGWMTYMNPIHKM-HYVNUMGLSA-N 2 0 412.043 4.110 20 0 HIADRP FC(F)(F)C1CCN(C2CC([NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)C2)CC1 ZINC000475348130 890271539 /nfs/dbraw/zinc/27/15/39/890271539.db2.gz LZSSEGRLCDTXGN-DEKIUUDOSA-N 2 0 421.551 4.292 20 0 HIADRP C[C@@H](CCc1ccc(I)cc1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475567091 890497720 /nfs/dbraw/zinc/49/77/20/890497720.db2.gz QOFVMTSXFJNOIG-MNNVXMFVSA-N 2 0 412.359 4.219 20 0 HIADRP C[C@H](C(=O)NCCc1c[nH]c2ccccc12)[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000476990642 891916135 /nfs/dbraw/zinc/91/61/35/891916135.db2.gz ADEHUUFJASEDBK-LEWJYISDSA-N 2 0 424.633 4.192 20 0 HIADRP CCc1c(C)[nH+]c2ccccc2c1N1CCC(C(=O)NCCC[NH+](CC)CC)CC1 ZINC000477049335 891978749 /nfs/dbraw/zinc/97/87/49/891978749.db2.gz RILGJTAKDHDUBK-UHFFFAOYSA-N 2 0 410.606 4.170 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)[C@@H](C)C1 ZINC000477918001 893001041 /nfs/dbraw/zinc/00/10/41/893001041.db2.gz OOOANYIVHGLNDS-WIOPSUGQSA-N 3 0 401.639 4.145 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NC1CC([NH+]2CCCCC2)C1)c1cccc(C(F)(F)F)c1 ZINC000477962971 893054633 /nfs/dbraw/zinc/05/46/33/893054633.db2.gz GVAQYZDZZVPAPC-SOAGJPPSSA-N 2 0 411.512 4.221 20 0 HIADRP CC[NH+]1CCC(NCc2cn(-c3ccc(Br)cc3)nc2C(C)C)CC1 ZINC000478219848 893380164 /nfs/dbraw/zinc/38/01/64/893380164.db2.gz LFKAKCXVNUFMTE-UHFFFAOYSA-N 2 0 405.384 4.332 20 0 HIADRP C[C@@H]1[C@@H]([NH+]2CCCC2)CCN1C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000478222846 893384418 /nfs/dbraw/zinc/38/44/18/893384418.db2.gz DAKVSZCXCZCDEW-NLFFAJNJSA-N 2 0 420.601 4.183 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H]2CC(C)(C)c3ccc(Br)cc32)CC1 ZINC000479072178 894336649 /nfs/dbraw/zinc/33/66/49/894336649.db2.gz UTYLRGDSXVYVPH-UZLBHIALSA-N 2 0 408.428 4.035 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3cc(Br)ccc32)C1 ZINC000479434584 894749468 /nfs/dbraw/zinc/74/94/68/894749468.db2.gz DYWRKTMMZUFOST-RBBKRZOGSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@@H]([NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000479474885 894798677 /nfs/dbraw/zinc/79/86/77/894798677.db2.gz FJHJAZFAGUEGBJ-PBPGXSGUSA-N 2 0 413.528 4.083 20 0 HIADRP C[C@H]1CN(Cc2cccc(C[NH2+]Cc3cccc(C(=O)OC(C)(C)C)c3)c2)CCO1 ZINC000479918161 895266304 /nfs/dbraw/zinc/26/63/04/895266304.db2.gz CFRKWIIABXWQCG-IBGZPJMESA-N 2 0 410.558 4.152 20 0 HIADRP C[C@@H]1CN(Cc2cccc(C[NH2+]Cc3cccc(C(=O)OC(C)(C)C)c3)c2)CCO1 ZINC000479918164 895266596 /nfs/dbraw/zinc/26/65/96/895266596.db2.gz CFRKWIIABXWQCG-LJQANCHMSA-N 2 0 410.558 4.152 20 0 HIADRP C[NH+]1CCN(CCC[NH2+][C@H](CCSc2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000480162447 895551332 /nfs/dbraw/zinc/55/13/32/895551332.db2.gz IGSNOPBLYKOHEM-HSZRJFAPSA-N 2 0 419.585 4.415 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+]Cc2cc(Br)c(Cl)s2)C1 ZINC000480284087 895688966 /nfs/dbraw/zinc/68/89/66/895688966.db2.gz MXJHKVANFSANCD-AWEZNQCLSA-N 2 0 415.784 4.020 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@H](C)C1 ZINC000480473048 895854199 /nfs/dbraw/zinc/85/41/99/895854199.db2.gz RDRIMDXQJBFSHJ-APWZRJJASA-N 2 0 407.649 4.449 20 0 HIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480548076 895909281 /nfs/dbraw/zinc/90/92/81/895909281.db2.gz CLINVAPDRDLOLN-JXFKEZNVSA-N 2 0 404.599 4.180 20 0 HIADRP CC(C)(C)C(=O)N1CCC(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CC1 ZINC000480566076 895926607 /nfs/dbraw/zinc/92/66/07/895926607.db2.gz XCOMZJNUULTACG-ZEQRLZLVSA-N 2 0 411.634 4.258 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)[C@H](C)C1 ZINC000480600987 895964096 /nfs/dbraw/zinc/96/40/96/895964096.db2.gz MUPUSAFQYDWWBH-FBLLAGFSSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cccc(NS(C)(=O)=O)c1 ZINC000480613908 895980664 /nfs/dbraw/zinc/98/06/64/895980664.db2.gz NFPGHHQGECKHQM-MOPGFXCFSA-N 2 0 415.603 4.283 20 0 HIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H](c1ccccc1)N1CCOCC1 ZINC000480621170 895989181 /nfs/dbraw/zinc/98/91/81/895989181.db2.gz JBTRAVZFQVJIMC-NMBZVWEGSA-N 2 0 419.613 4.234 20 0 HIADRP Cc1ncc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)c(C)n1 ZINC000480746904 896109411 /nfs/dbraw/zinc/10/94/11/896109411.db2.gz SHPRUOWQNPMEHC-FQEVSTJZSA-N 2 0 415.585 4.266 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000480760679 896122308 /nfs/dbraw/zinc/12/23/08/896122308.db2.gz BEKRYFNLZXHCHL-DEOSSOPVSA-N 2 0 401.545 4.256 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)c1ccc(-n2cnnn2)cc1 ZINC000480892495 896247906 /nfs/dbraw/zinc/24/79/06/896247906.db2.gz ATBFRLOWQWBMSN-IBGZPJMESA-N 2 0 404.562 4.278 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC2(c3cccc(Cl)c3)CCOCC2)[C@@H](C)C1 ZINC000481053915 896377029 /nfs/dbraw/zinc/37/70/29/896377029.db2.gz QMZISANPASQLTL-UGKGYDQZSA-N 2 0 409.014 4.115 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)c1 ZINC000481149734 896480621 /nfs/dbraw/zinc/48/06/21/896480621.db2.gz BTBUFFPAFNXHRX-LADGPHEKSA-N 2 0 406.574 4.267 20 0 HIADRP C[C@H]([NH2+]CC1(c2ccc(F)cc2)CCOCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000481168527 896501532 /nfs/dbraw/zinc/50/15/32/896501532.db2.gz MLLPWDSVFDDQOD-IBGZPJMESA-N 2 0 400.538 4.165 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000481179091 896517872 /nfs/dbraw/zinc/51/78/72/896517872.db2.gz ULTALLRTGPXKBS-HGHGUNKESA-N 2 0 423.384 4.233 20 0 HIADRP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000481236259 896586965 /nfs/dbraw/zinc/58/69/65/896586965.db2.gz ACJWMZBGMKUDQF-OAQYLSRUSA-N 2 0 416.569 4.263 20 0 HIADRP Cc1c(Cl)cccc1NC(=O)CC[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000482018750 897422207 /nfs/dbraw/zinc/42/22/07/897422207.db2.gz SVBQOGDPBUTKNH-QGZVFWFLSA-N 2 0 403.954 4.268 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(Br)cc3cccnc32)[C@H](C)C1 ZINC000482141181 897600709 /nfs/dbraw/zinc/60/07/09/897600709.db2.gz SUXFGXAJDHNECU-UZLBHIALSA-N 2 0 420.395 4.224 20 0 HIADRP COC(=O)c1ccccc1-c1ccc(C[NH2+]C2CCN(c3cccc(C)n3)CC2)o1 ZINC000482197898 897673173 /nfs/dbraw/zinc/67/31/73/897673173.db2.gz IMJGFWBKYGYRSO-UHFFFAOYSA-N 2 0 405.498 4.195 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc2c(c1)COC2 ZINC000482257065 897738424 /nfs/dbraw/zinc/73/84/24/897738424.db2.gz ILALLUSAQMMQRK-IBGZPJMESA-N 2 0 410.558 4.057 20 0 HIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC2CC[NH+](CCN(C)C)CC2)CCC3)cc1 ZINC000482358638 897874894 /nfs/dbraw/zinc/87/48/94/897874894.db2.gz NAODINNZJWUOLZ-OAQYLSRUSA-N 2 0 412.647 4.359 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000482358823 897874920 /nfs/dbraw/zinc/87/49/20/897874920.db2.gz PFYCULCQAXEKGH-MRXNPFEDSA-N 2 0 403.558 4.265 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cccc(Cl)c1Cl ZINC000482434220 897992997 /nfs/dbraw/zinc/99/29/97/897992997.db2.gz DZBVNIZOIYHPFQ-MRXNPFEDSA-N 2 0 408.377 4.036 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C[C@@H](C)CN1CC[NH+](C)CC1 ZINC000482450538 898014632 /nfs/dbraw/zinc/01/46/32/898014632.db2.gz QQGITUSMTYSJAF-CVEARBPZSA-N 2 0 407.027 4.306 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1Cl ZINC000482457777 898029052 /nfs/dbraw/zinc/02/90/52/898029052.db2.gz RGDFICANAFATBN-MRXNPFEDSA-N 2 0 408.377 4.036 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000482483033 898060062 /nfs/dbraw/zinc/06/00/62/898060062.db2.gz IMXABRNKNRIDJU-CRAIPNDOSA-N 2 0 400.394 4.070 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)CC1 ZINC000482496576 898077371 /nfs/dbraw/zinc/07/73/71/898077371.db2.gz QNZHVYGLKZVTMA-OALUTQOASA-N 2 0 400.636 4.351 20 0 HIADRP C[C@H](C[NH2+][C@@H](Cc1ccc(F)cc1)c1ccccc1Cl)CN1CC[NH+](C)CC1 ZINC000482513575 898098542 /nfs/dbraw/zinc/09/85/42/898098542.db2.gz REYXKNSFBMDNOT-JPYJTQIMSA-N 2 0 403.973 4.236 20 0 HIADRP OCC[NH+]1CCC(C[NH2+][C@@H](CCSc2ccccc2)c2ccc(F)cc2)CC1 ZINC000482545901 898135036 /nfs/dbraw/zinc/13/50/36/898135036.db2.gz AGNYHJJRDBIBNC-QHCPKHFHSA-N 2 0 402.579 4.343 20 0 HIADRP COc1ccc(OC)c([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c1 ZINC000482553193 898143871 /nfs/dbraw/zinc/14/38/71/898143871.db2.gz DJMXHLCCXTVDNV-IAGOWNOFSA-N 2 0 401.526 4.007 20 0 HIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c1)CCCO2 ZINC000482620270 898223697 /nfs/dbraw/zinc/22/36/97/898223697.db2.gz ONQNPFSNZAYGIQ-UPVQGACJSA-N 2 0 421.585 4.004 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000482630013 898234233 /nfs/dbraw/zinc/23/42/33/898234233.db2.gz MDUHYENVUAEBHJ-OXQOHEQNSA-N 2 0 419.491 4.254 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1 ZINC000482864346 898476358 /nfs/dbraw/zinc/47/63/58/898476358.db2.gz ARPQYKDORNZSPY-OAQYLSRUSA-N 2 0 418.589 4.048 20 0 HIADRP COc1ccc(C[C@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)c2ccc(OC)cc2)cc1 ZINC000483214479 898862901 /nfs/dbraw/zinc/86/29/01/898862901.db2.gz NYCFWQMNECSKCV-LVXARBLLSA-N 2 0 424.585 4.078 20 0 HIADRP C[N@@H+]1CCCC[C@@H]1CCN1CC[NH+](CCOC(c2ccccc2)c2ccccc2)CC1 ZINC000483503581 899162437 /nfs/dbraw/zinc/16/24/37/899162437.db2.gz UWIISIJPRYFNRA-AREMUKBSSA-N 2 0 421.629 4.285 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000483512809 899173391 /nfs/dbraw/zinc/17/33/91/899173391.db2.gz KRCYQYVIKLPTOI-SFHVURJKSA-N 2 0 413.635 4.114 20 0 HIADRP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000483598043 899248942 /nfs/dbraw/zinc/24/89/42/899248942.db2.gz YEYUUFNIUAAQKX-UIOOFZCWSA-N 2 0 417.597 4.409 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@H](C)C2)C[C@@H]1C ZINC000483677163 899337509 /nfs/dbraw/zinc/33/75/09/899337509.db2.gz FLBZDXWECMQEJU-XARGGIHNSA-N 2 0 414.638 4.179 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)cc1 ZINC000483713312 899370758 /nfs/dbraw/zinc/37/07/58/899370758.db2.gz RWHCJBSTEUZVHI-OALUTQOASA-N 2 0 403.592 4.009 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000483720661 899380153 /nfs/dbraw/zinc/38/01/53/899380153.db2.gz GKAYMDVMVAVKID-LVXARBLLSA-N 2 0 418.585 4.307 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)C[C@H]1C ZINC000483739529 899402119 /nfs/dbraw/zinc/40/21/19/899402119.db2.gz GRECDSLJLFVUFU-OFNKIYASSA-N 2 0 400.611 4.077 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2CC[NH+](Cc3ccccc3Cl)CC2)C[C@@H]1C ZINC000483741826 899406034 /nfs/dbraw/zinc/40/60/34/899406034.db2.gz FDWQFGGGOSZABY-RXVVDRJESA-N 2 0 421.029 4.066 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccccc1OC(F)F ZINC000484470968 899964776 /nfs/dbraw/zinc/96/47/76/899964776.db2.gz FENGCXGSIZSTOO-OAQYLSRUSA-N 2 0 404.501 4.486 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CCN2CCC([NH+](C)C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000484488043 899979592 /nfs/dbraw/zinc/97/95/92/899979592.db2.gz DRZHECRXADYFHT-OAHLLOKOSA-N 2 0 424.420 4.164 20 0 HIADRP C[C@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(N2CCOCC2)c1 ZINC000484500671 899991210 /nfs/dbraw/zinc/99/12/10/899991210.db2.gz NIKVVWCYZAEDON-IMIIHFCZSA-N 2 0 407.602 4.330 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCC(=O)Nc2ccc(OCc3ccccc3)cc2)C[C@@H]1C ZINC000485676640 900927832 /nfs/dbraw/zinc/92/78/32/900927832.db2.gz VRGTWPKIUFHAHW-REWPJTCUSA-N 2 0 409.574 4.399 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000486192539 901377687 /nfs/dbraw/zinc/37/76/87/901377687.db2.gz OWHIUYWZLHXNCE-BWKNWUBXSA-N 2 0 405.586 4.455 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486386142 901550303 /nfs/dbraw/zinc/55/03/03/901550303.db2.gz GUQMVEVWIMTZLO-WIOPSUGQSA-N 3 0 407.602 4.161 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2cc3ccc(F)cc3[nH]2)CC1 ZINC000486692286 901797384 /nfs/dbraw/zinc/79/73/84/901797384.db2.gz CCDDKARLFUAQCP-UHFFFAOYSA-N 2 0 420.454 4.367 20 0 HIADRP CC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccnc(Oc3ccccc3F)c2)CC1 ZINC000486811605 901868941 /nfs/dbraw/zinc/86/89/41/901868941.db2.gz LYDGPJDEFMCEII-UHFFFAOYSA-N 2 0 420.532 4.445 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1 ZINC000505931077 914582236 /nfs/dbraw/zinc/58/22/36/914582236.db2.gz WERUGXSTAQEVCS-YADHBBJMSA-N 2 0 415.622 4.134 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2c[nH]nc2-c2ccc(C(F)(F)F)cc2)cc1 ZINC000486963808 901991916 /nfs/dbraw/zinc/99/19/16/901991916.db2.gz GMBYGKNVTLDXJS-UHFFFAOYSA-N 2 0 418.463 4.326 20 0 HIADRP CCOc1c(Cl)cccc1C[NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1 ZINC000486965993 901992429 /nfs/dbraw/zinc/99/24/29/901992429.db2.gz KXPWTSDIFCJBTR-UHFFFAOYSA-N 2 0 401.982 4.166 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@@H]2CC[NH+](CCc3ccccc3)C2)cc1)C(C)C ZINC000487117084 902064462 /nfs/dbraw/zinc/06/44/62/902064462.db2.gz HQTGGJPMIFFNPF-DEOSSOPVSA-N 2 0 407.602 4.211 20 0 HIADRP Cn1ncc(Br)c1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000487277286 902135479 /nfs/dbraw/zinc/13/54/79/902135479.db2.gz MFTKZXYSWJKZRP-UHFFFAOYSA-N 2 0 419.411 4.007 20 0 HIADRP C[C@H](c1ccc(OC(F)F)cc1)[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000487740194 902331959 /nfs/dbraw/zinc/33/19/59/902331959.db2.gz PEEFESAQOWHXPE-GOSISDBHSA-N 2 0 423.548 4.053 20 0 HIADRP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000487742219 902333845 /nfs/dbraw/zinc/33/38/45/902333845.db2.gz VEXSVFLFLZWCNM-QFIPXVFZSA-N 2 0 406.014 4.495 20 0 HIADRP O=C([C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000487870167 902416773 /nfs/dbraw/zinc/41/67/73/902416773.db2.gz FKGQLPKVTMDROC-DHIUTWEWSA-N 2 0 415.597 4.152 20 0 HIADRP c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c(C[NH+]2CCC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000487915699 902448890 /nfs/dbraw/zinc/44/88/90/902448890.db2.gz PTUQBMWUQWFGGJ-XDZVQPMWSA-N 2 0 412.618 4.184 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](CC(=O)N(C)C(c2ccccc2)c2ccccc2)CC1 ZINC000488416146 902817029 /nfs/dbraw/zinc/81/70/29/902817029.db2.gz BJCDNIHCEROGSD-UHFFFAOYSA-N 2 0 407.602 4.288 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)c1)C1CCOCC1 ZINC000488443356 902828919 /nfs/dbraw/zinc/82/89/19/902828919.db2.gz URTKWPPVKNQCBG-SIKLNZKXSA-N 2 0 406.636 4.186 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488580503 902891652 /nfs/dbraw/zinc/89/16/52/902891652.db2.gz KVJCUAYMWPGAEE-BWKNWUBXSA-N 2 0 422.617 4.190 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000489436811 903383832 /nfs/dbraw/zinc/38/38/32/903383832.db2.gz MKENPEJVFZAHNP-OFVILXPXSA-N 2 0 422.617 4.238 20 0 HIADRP CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506032016 914714337 /nfs/dbraw/zinc/71/43/37/914714337.db2.gz OISBKLWLUQOZCC-LEWJYISDSA-N 2 0 415.622 4.352 20 0 HIADRP CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489559892 903463880 /nfs/dbraw/zinc/46/38/80/903463880.db2.gz HSOXLLHIOUCQKA-NRFANRHFSA-N 2 0 414.638 4.193 20 0 HIADRP Cn1ccnc1COc1ccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000489653244 903518114 /nfs/dbraw/zinc/51/81/14/903518114.db2.gz YKZLIVJGKNXRNV-UHFFFAOYSA-N 2 0 418.585 4.343 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489908502 903666427 /nfs/dbraw/zinc/66/64/27/903666427.db2.gz FQYLNSAJNIXYDF-FGZHOGPDSA-N 2 0 414.638 4.051 20 0 HIADRP CSc1cccc([C@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2ccc(F)c(F)c2)c1 ZINC000490119562 903776775 /nfs/dbraw/zinc/77/67/75/903776775.db2.gz PPJIESUNQXVQLE-QHCPKHFHSA-N 2 0 419.585 4.392 20 0 HIADRP COc1ccc([C@H]([NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)c2ccc(F)cc2)cc1 ZINC000490119827 903777547 /nfs/dbraw/zinc/77/75/47/903777547.db2.gz QIVAAJAQQOVQEM-AXHZCLLHSA-N 2 0 400.538 4.403 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H](c1ccc(F)cc1)c1ccc(Cl)cc1)N1CC[NH+](C)CC1 ZINC000490162617 903803890 /nfs/dbraw/zinc/80/38/90/903803890.db2.gz ALTRMHQTSIRSEH-PKTZIBPZSA-N 2 0 403.973 4.430 20 0 HIADRP COc1ccc([C@H]([NH2+]CCCN2CCC[N@H+](C)CC2)c2ccccc2Cl)cc1 ZINC000491012635 904369442 /nfs/dbraw/zinc/36/94/42/904369442.db2.gz YAPPVYRJTJZLOL-QHCPKHFHSA-N 2 0 401.982 4.055 20 0 HIADRP CCOc1ccc([C@@H]([NH2+]CC2CC[NH+](CCO)CC2)c2ccccc2Cl)cc1 ZINC000491037689 904390234 /nfs/dbraw/zinc/39/02/34/904390234.db2.gz OGFVHZDTPZQGIK-HSZRJFAPSA-N 2 0 402.966 4.122 20 0 HIADRP CSc1cccc([C@H]([NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491058949 904402288 /nfs/dbraw/zinc/40/22/88/904402288.db2.gz JEBRDPDKSAGAIU-HXOBKFHXSA-N 2 0 419.585 4.249 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]C(c3ccccc3)c3ccccc3)c2)C1 ZINC000492211695 904815810 /nfs/dbraw/zinc/81/58/10/904815810.db2.gz VBGZDVXEZZKFFS-RUZDIDTESA-N 2 0 413.565 4.263 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccccc1)c1ccccc1Br ZINC000492253197 904823641 /nfs/dbraw/zinc/82/36/41/904823641.db2.gz OIEAONXEHGUZJF-SIKLNZKXSA-N 2 0 417.391 4.365 20 0 HIADRP COc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OCc1cccnc1 ZINC000512402242 921136931 /nfs/dbraw/zinc/13/69/31/921136931.db2.gz XSENEPZCMRBBLQ-UGKGYDQZSA-N 2 0 409.574 4.412 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)c2ccc(C[NH+]3CCSCC3)cc2)cc1 ZINC000512404721 921139418 /nfs/dbraw/zinc/13/94/18/921139418.db2.gz IZQURLOQOLHTRN-UHFFFAOYSA-N 2 0 411.615 4.007 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000512407298 921140541 /nfs/dbraw/zinc/14/05/41/921140541.db2.gz VGTMIAPMTBMSRN-XUZZJYLKSA-N 2 0 414.638 4.051 20 0 HIADRP COc1cc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c(-c2ccccc2)cc1OC ZINC000512448970 921168942 /nfs/dbraw/zinc/16/89/42/921168942.db2.gz AEWRGAQBZUSBIY-UHFFFAOYSA-N 2 0 424.585 4.305 20 0 HIADRP C[NH+](C)Cc1ccc(CNC(=O)NCc2ccccc2C[NH+]2CCCCCC2)cc1 ZINC000494601612 905857615 /nfs/dbraw/zinc/85/76/15/905857615.db2.gz MOZYCCXVBNXICR-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000494649139 905882670 /nfs/dbraw/zinc/88/26/70/905882670.db2.gz QANHOAHXNATEKW-PUPGKCOFSA-N 2 0 407.396 4.053 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc2C1 ZINC000494945572 906116010 /nfs/dbraw/zinc/11/60/10/906116010.db2.gz ATHJIRBXYBANPZ-CLLDFNAGSA-N 2 0 405.586 4.370 20 0 HIADRP FC(F)(F)c1ccc(-c2n[nH]cc2C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)cc1 ZINC000494945015 906116243 /nfs/dbraw/zinc/11/62/43/906116243.db2.gz DPNXCZYUTQJCDP-UHFFFAOYSA-N 2 0 422.495 4.030 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)[C@@H](C)C1 ZINC000495186283 906296789 /nfs/dbraw/zinc/29/67/89/906296789.db2.gz WNQQWNNALSDDCR-FIKGOQFSSA-N 2 0 414.421 4.299 20 0 HIADRP Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000495415539 906437691 /nfs/dbraw/zinc/43/76/91/906437691.db2.gz RBWVKKSOBYAQDP-HUUCEWRRSA-N 2 0 412.500 4.414 20 0 HIADRP COc1cccc([C@@H]2[C@H]([NH2+][C@H](C)c3ccc(OCC[NH+](C)C)cc3)CCN2C2CC2)c1 ZINC000495419475 906439409 /nfs/dbraw/zinc/43/94/09/906439409.db2.gz BOSKTOMYAAADFQ-WGURPXDASA-N 2 0 423.601 4.264 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000495420543 906441486 /nfs/dbraw/zinc/44/14/86/906441486.db2.gz JBPWCIVBSLYBKH-NNMXDRDESA-N 2 0 415.603 4.009 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(F)c(Cl)c1 ZINC000495460918 906465042 /nfs/dbraw/zinc/46/50/42/906465042.db2.gz NUVAUJMOQXUYMN-KXBFYZLASA-N 2 0 403.929 4.027 20 0 HIADRP Cc1ccccc1[C@H](OC[C@@H](O)C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1ccccc1 ZINC000512582119 921248910 /nfs/dbraw/zinc/24/89/10/921248910.db2.gz LAPXAKURYMIOOX-FWXONLORSA-N 2 0 408.586 4.019 20 0 HIADRP Cn1cc(-c2ccccc2C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000512612955 921260677 /nfs/dbraw/zinc/26/06/77/921260677.db2.gz QPVBNRKEBIGQOF-UCGXPXSYSA-N 2 0 400.570 4.477 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NC2CC[NH+](CC3CCCC3)CC2)[C@H]1c1cccs1 ZINC000497561644 907049194 /nfs/dbraw/zinc/04/91/94/907049194.db2.gz KTAHGOZSUBSTNB-KNQAVFIVSA-N 2 0 418.651 4.085 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21)[NH2+][C@@H](C)c1ccccc1 ZINC000497686770 907191725 /nfs/dbraw/zinc/19/17/25/907191725.db2.gz KSOZSADMWZAHQK-KSEOMHKRSA-N 2 0 400.611 4.022 20 0 HIADRP CCS[C@@H]1CC[C@H]([NH+](C)CC2(C[N@@H+](C)[C@H]3CC[C@@H](SCC)C3)COC2)C1 ZINC000497848942 907328403 /nfs/dbraw/zinc/32/84/03/907328403.db2.gz SRLQQGLUZIJMEZ-VNTMZGSJSA-N 2 0 400.698 4.215 20 0 HIADRP CCS[C@@H]1CC[C@H]([NH+](C)CC2(C[N@@H+](C)[C@@H]3CC[C@H](SCC)C3)COC2)C1 ZINC000497848940 907328642 /nfs/dbraw/zinc/32/86/42/907328642.db2.gz SRLQQGLUZIJMEZ-JVSBHGNQSA-N 2 0 400.698 4.215 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@@H](c2cc3ccccc3o2)c2cccnc2)(N2CCCCC2)CC1 ZINC000498944787 908350155 /nfs/dbraw/zinc/35/01/55/908350155.db2.gz UIDIJBIGNVVZPK-RUZDIDTESA-N 2 0 418.585 4.457 20 0 HIADRP c1cn(Cc2ccccc2)c(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000499138561 908495822 /nfs/dbraw/zinc/49/58/22/908495822.db2.gz FXMSHHSURLYQLV-MPIKPJSNSA-N 2 0 400.570 4.259 20 0 HIADRP Cc1ccc([C@@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N2CCOCC2)cc1 ZINC000499139650 908497055 /nfs/dbraw/zinc/49/70/55/908497055.db2.gz QGZZIEYXKPEJBX-JVYGEBFASA-N 2 0 419.613 4.154 20 0 HIADRP Cc1ccc(C(=O)N2CCC([NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)CC2)cc1 ZINC000499165152 908518150 /nfs/dbraw/zinc/51/81/50/908518150.db2.gz TXGAVRKDWZMURV-PBROBROCSA-N 2 0 417.597 4.385 20 0 HIADRP CC(C)C[C@H](CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[NH2+][C@H](C)c1ccccc1 ZINC000499196433 908550781 /nfs/dbraw/zinc/55/07/81/908550781.db2.gz VUZRQPTWCMDPEK-LBWSFECWSA-N 2 0 400.611 4.019 20 0 HIADRP CN1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000499196751 908551152 /nfs/dbraw/zinc/55/11/52/908551152.db2.gz WNYRMJQNNKXQQQ-KOSDUOMESA-N 2 0 411.540 4.495 20 0 HIADRP CC(C)C[C@@H](CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[NH2+][C@H](C)c1ccccc1 ZINC000499196435 908551446 /nfs/dbraw/zinc/55/14/46/908551446.db2.gz VUZRQPTWCMDPEK-PDTZRLOFSA-N 2 0 400.611 4.019 20 0 HIADRP OC[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1ccccc1OC(F)(F)F ZINC000513005585 921469323 /nfs/dbraw/zinc/46/93/23/921469323.db2.gz QCIQKGBCDIHOHX-QGZVFWFLSA-N 2 0 414.512 4.123 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH+]2CCC(c3noc(C(C)C)n3)CC2)CC1 ZINC000513056116 921513015 /nfs/dbraw/zinc/51/30/15/921513015.db2.gz HIKHHOOVPUPDQE-UHFFFAOYSA-N 2 0 411.594 4.105 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000513063803 921519632 /nfs/dbraw/zinc/51/96/32/921519632.db2.gz ISRJGVGNFKNFEB-HXUWFJFHSA-N 2 0 412.622 4.391 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@H](C[NH+]2CCCC2)c2ccc(OC)cc2)cc1)C1CC1 ZINC000500391075 909830386 /nfs/dbraw/zinc/83/03/86/909830386.db2.gz SPEVXGJXWVFFQG-RUZDIDTESA-N 2 0 421.585 4.246 20 0 HIADRP Fc1cccc(N2CCCC2)c1C[NH2+]CCCC[NH+]1CCN(Cc2ccccc2)CC1 ZINC000513085812 921537237 /nfs/dbraw/zinc/53/72/37/921537237.db2.gz HSYRWJHMPNQMEJ-UHFFFAOYSA-N 2 0 424.608 4.114 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1cccs1 ZINC000501012219 910233615 /nfs/dbraw/zinc/23/36/15/910233615.db2.gz VHWHDKJRTAOJKV-RTBURBONSA-N 2 0 421.010 4.141 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000501015837 910234840 /nfs/dbraw/zinc/23/48/40/910234840.db2.gz RMPXVIQSYKAPNZ-XMMPIXPASA-N 2 0 401.545 4.254 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCc3ccccc3[C@@H](c3ccccc3)[C@@H]2C)CC1 ZINC000501033802 910250135 /nfs/dbraw/zinc/25/01/35/910250135.db2.gz VYTMGTLCSLUEPW-WNCULLNHSA-N 2 0 405.630 4.481 20 0 HIADRP O=C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)N1CCC([NH+]2CCCCC2)CC1 ZINC000501052931 910263634 /nfs/dbraw/zinc/26/36/34/910263634.db2.gz KGJNOJNQCHXRTG-QFIPXVFZSA-N 2 0 419.013 4.137 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1 ZINC000501055287 910266824 /nfs/dbraw/zinc/26/68/24/910266824.db2.gz AVORXCWYAUJGJV-QHCPKHFHSA-N 2 0 400.998 4.025 20 0 HIADRP Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501076833 910277820 /nfs/dbraw/zinc/27/78/20/910277820.db2.gz HAGSMIKNUGLJIY-QGZVFWFLSA-N 2 0 400.954 4.219 20 0 HIADRP COc1ccc(Br)cc1[C@H]1CCC[N@@H+]1CCCN1CC[NH+](C(C)C)CC1 ZINC000501112009 910299841 /nfs/dbraw/zinc/29/98/41/910299841.db2.gz XPACWLPDZHAWLM-HXUWFJFHSA-N 2 0 424.427 4.011 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)C1CCCCC1 ZINC000501376342 910505735 /nfs/dbraw/zinc/50/57/35/910505735.db2.gz KJBPUOQOFYDDPA-QFIPXVFZSA-N 2 0 421.029 4.114 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)c2nc(-c3ccc(F)c(C)c3)no2)CC1 ZINC000501777363 910832731 /nfs/dbraw/zinc/83/27/31/910832731.db2.gz QKBQUKNURQHJFV-SFHVURJKSA-N 2 0 418.557 4.316 20 0 HIADRP CC(C)[C@@H]([NH2+][C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000502562523 911566790 /nfs/dbraw/zinc/56/67/90/911566790.db2.gz HDDXAOHPUXMQLR-NTKDMRAZSA-N 2 0 411.565 4.282 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1)c1ccco1 ZINC000502563264 911568521 /nfs/dbraw/zinc/56/85/21/911568521.db2.gz LWITVOJWXGAZPL-XVAXZDLZSA-N 2 0 404.599 4.005 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(Cc2ccccc2)CC1)c1cnn(C2CCCC2)c1 ZINC000502686554 911727670 /nfs/dbraw/zinc/72/76/70/911727670.db2.gz MXDYCRKYAQCIMI-JOCHJYFZSA-N 2 0 409.622 4.247 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)N3CCC(CCC[NH+]4CCCC4)CC3)CC2)CC1 ZINC000502755445 911777392 /nfs/dbraw/zinc/77/73/92/911777392.db2.gz GJSTWFMTPSKOFC-UHFFFAOYSA-N 2 0 418.670 4.327 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)CC1 ZINC000502787922 911810615 /nfs/dbraw/zinc/81/06/15/911810615.db2.gz KDGSCONFIFYBTM-UHFFFAOYSA-N 2 0 406.659 4.183 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)c1 ZINC000502846647 911856155 /nfs/dbraw/zinc/85/61/55/911856155.db2.gz OVQWCLBFBBBGOL-RUZDIDTESA-N 2 0 405.586 4.409 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000502861284 911868095 /nfs/dbraw/zinc/86/80/95/911868095.db2.gz KKYCEEQGHOTAFV-FGZHOGPDSA-N 2 0 414.638 4.230 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NCC(C)(C)[NH2+][C@H](C)c1ccccc1 ZINC000502936926 911923266 /nfs/dbraw/zinc/92/32/66/911923266.db2.gz BAMPFOAOEPFPDB-HXUWFJFHSA-N 2 0 410.606 4.455 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000502943050 911928907 /nfs/dbraw/zinc/92/89/07/911928907.db2.gz YPRJEQSYGDEVLD-UHFFFAOYSA-N 2 0 422.617 4.333 20 0 HIADRP CC(C)(C)[NH+]1CCC([NH2+]C2CCN(Cc3ccc(Br)cc3)CC2)CC1 ZINC000513329048 921717113 /nfs/dbraw/zinc/71/71/13/921717113.db2.gz AWPWMYMNTQZLPT-UHFFFAOYSA-N 2 0 408.428 4.266 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCCCn2nnc(-c3ccccc3)n2)C1 ZINC000506475373 915078072 /nfs/dbraw/zinc/07/80/72/915078072.db2.gz VUYCTXFBAUCMEF-VXKWHMMOSA-N 2 0 410.610 4.097 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)C1 ZINC000506918305 915718424 /nfs/dbraw/zinc/71/84/24/915718424.db2.gz REOJHPPBJGKDPV-FCHUYYIVSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)C1 ZINC000506920285 915721404 /nfs/dbraw/zinc/72/14/04/915721404.db2.gz ZVJQQMWYEINFCF-FSSWDIPSSA-N 2 0 416.610 4.103 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1 ZINC000506934408 915737515 /nfs/dbraw/zinc/73/75/15/915737515.db2.gz RDOXDGKBZKUMLD-ZJSXRUAMSA-N 2 0 414.638 4.324 20 0 HIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)CC1 ZINC000507625650 916384988 /nfs/dbraw/zinc/38/49/88/916384988.db2.gz PJQYJFSIIMXXDK-VOQZNFBZSA-N 2 0 411.569 4.032 20 0 HIADRP CC[NH+](CC)Cc1ccc(NC(=O)c2cnn(CC[NH+](C)C)c2-c2ccccc2)cc1 ZINC000507840288 916649025 /nfs/dbraw/zinc/64/90/25/916649025.db2.gz GROIJXQNTZQELI-UHFFFAOYSA-N 2 0 419.573 4.206 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]C3CCC(C(=O)OC(C)(C)C)CC3)CC2)cc1 ZINC000507939571 916808176 /nfs/dbraw/zinc/80/81/76/916808176.db2.gz ZMEBFQHNWJFVJJ-UHFFFAOYSA-N 2 0 416.606 4.397 20 0 HIADRP CC(C)[NH+](CCN(C)C(=O)NCC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)C(C)C ZINC000508268749 917086797 /nfs/dbraw/zinc/08/67/97/917086797.db2.gz RVWIAFKJVPRQAR-JTHBVZDNSA-N 2 0 402.627 4.047 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703063 917464144 /nfs/dbraw/zinc/46/41/44/917464144.db2.gz XHQDFFLKBJVNGK-PXDATVDWSA-N 2 0 405.586 4.313 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)ccc2NC1=O ZINC000508709399 917469772 /nfs/dbraw/zinc/46/97/72/917469772.db2.gz HLDOLMOYFCENEO-LANGDILFSA-N 2 0 407.558 4.357 20 0 HIADRP Cc1ccccc1[C@H]([C@@H](C)NC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[NH+](C)C ZINC000508861964 917615196 /nfs/dbraw/zinc/61/51/96/917615196.db2.gz IUVPYISPBTVKBZ-BWKNWUBXSA-N 2 0 422.617 4.292 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N(C)[C@@H]1CC[NH+](CC)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000509025071 917778365 /nfs/dbraw/zinc/77/83/65/917778365.db2.gz TWQZDVYLDNWONE-DUXKGJEZSA-N 2 0 409.018 4.237 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N1CC[C@@H](C[NH+](C)CC2CC2)C1)c1ccc(Cl)cc1 ZINC000509040471 917793853 /nfs/dbraw/zinc/79/38/53/917793853.db2.gz SETMHHRIJRJXMZ-SIKLNZKXSA-N 2 0 421.029 4.096 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1)c1ccco1 ZINC000509595926 918245580 /nfs/dbraw/zinc/24/55/80/918245580.db2.gz LKLHIEUVMGJRLA-JSXRDJHFSA-N 2 0 404.599 4.005 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)c1oc2ccccc2c1C[NH+](C)C)Cc1ccccc1 ZINC000510375894 918861428 /nfs/dbraw/zinc/86/14/28/918861428.db2.gz HQTQSKQBTTWFPO-HXUWFJFHSA-N 2 0 407.558 4.177 20 0 HIADRP CC[NH+]1CCN(c2ccc(C(=O)Nc3ccc(C[N@@H+]4CCC[C@@H](C)C4)cc3)cc2)CC1 ZINC000510390094 918868270 /nfs/dbraw/zinc/86/82/70/918868270.db2.gz VORGSMHNQVOHLZ-OAQYLSRUSA-N 2 0 420.601 4.313 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccsc1 ZINC000510535604 918980029 /nfs/dbraw/zinc/98/00/29/918980029.db2.gz FDBAJZRRXPMROX-BBTUJRGHSA-N 2 0 406.640 4.083 20 0 HIADRP CC(C)(C)[NH+]1CCC(NC(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC000510550396 918995405 /nfs/dbraw/zinc/99/54/05/918995405.db2.gz HCWPSFCKAUWRTK-UHFFFAOYSA-N 2 0 400.611 4.125 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)N[C@@H](C)[C@@H]2CCC[NH+](C3CCC3)C2)CC1)CC(C)C ZINC000511266762 919864275 /nfs/dbraw/zinc/86/42/75/919864275.db2.gz PWYCQWJVZPWTTG-JTHBVZDNSA-N 2 0 420.686 4.429 20 0 HIADRP C[C@H](NC(=O)N(CC[NH+](C)C)Cc1cccc(Cl)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511286644 919882180 /nfs/dbraw/zinc/88/21/80/919882180.db2.gz MIESOLLTOAXFBJ-AZUAARDMSA-N 2 0 421.029 4.066 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000511398462 920011944 /nfs/dbraw/zinc/01/19/44/920011944.db2.gz OUDXODWRLDKFPR-DNQXCXABSA-N 2 0 416.009 4.343 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CCC[NH+](Cc3ccc(OC)cc3)CC2)cc1)C1CC1 ZINC000511404959 920018133 /nfs/dbraw/zinc/01/81/33/920018133.db2.gz DAZRUXCMGMOBRG-UHFFFAOYSA-N 2 0 421.585 4.028 20 0 HIADRP Cc1ccc(-c2ccc(C[NH+]3CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC3)o2)cc1 ZINC000511668477 920333319 /nfs/dbraw/zinc/33/33/19/920333319.db2.gz UHMZYIRYMPSVNW-UHFFFAOYSA-N 2 0 411.590 4.171 20 0 HIADRP CC(C)[NH+](CCN(C)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C(C)C ZINC000512196895 920941796 /nfs/dbraw/zinc/94/17/96/920941796.db2.gz OJJRLZRUCZWCMF-JOCHJYFZSA-N 2 0 402.627 4.047 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000512199804 920945393 /nfs/dbraw/zinc/94/53/93/920945393.db2.gz DOSINKSQXKZCIK-GOTSBHOMSA-N 2 0 412.666 4.303 20 0 HIADRP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(-c4ccc(C(F)(F)F)cc4)o3)C2)CC1 ZINC000513460875 921824693 /nfs/dbraw/zinc/82/46/93/921824693.db2.gz IZQOXGQANZPFGI-LJQANCHMSA-N 2 0 407.480 4.177 20 0 HIADRP COc1ccc(-c2n[nH]cc2C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000514092638 922414817 /nfs/dbraw/zinc/41/48/17/922414817.db2.gz FYPSTOMBHQGFHK-UHFFFAOYSA-N 2 0 404.558 4.429 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCCCC[N@H+]2CCCC[C@H]2C)[NH+]2CCCC2)cc1 ZINC000514122618 922453714 /nfs/dbraw/zinc/45/37/14/922453714.db2.gz LSMLVTVJDRFYGZ-GGAORHGYSA-N 2 0 400.611 4.086 20 0 HIADRP C[NH+]1CCN(CCC[NH2+][C@H](c2sccc2Br)C2CCCCC2)CC1 ZINC000514620055 922725818 /nfs/dbraw/zinc/72/58/18/922725818.db2.gz SXDRKCURANKSKF-SFHVURJKSA-N 2 0 414.457 4.359 20 0 HIADRP COc1ccccc1[C@H](C)NC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000514962761 922856672 /nfs/dbraw/zinc/85/66/72/922856672.db2.gz FKQIGGOGMKSRTJ-VQTJNVASSA-N 2 0 409.574 4.037 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(=O)Nc1ccc(F)c(F)c1 ZINC000515518759 923149192 /nfs/dbraw/zinc/14/91/92/923149192.db2.gz NDLLWNWSWNJYNT-IAGOWNOFSA-N 2 0 401.501 4.314 20 0 HIADRP O=C(NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000518631546 927392119 /nfs/dbraw/zinc/39/21/19/927392119.db2.gz CWXUOXXBIMHCLM-KNQAVFIVSA-N 2 0 419.013 4.137 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N(CC[NH+](C)C)Cc2cccc(Cl)c2)C1 ZINC000519505582 927999006 /nfs/dbraw/zinc/99/90/06/927999006.db2.gz FKPDVYUPTAFODT-WOJBJXKFSA-N 2 0 423.045 4.171 20 0 HIADRP Cc1nc(C[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)cs1 ZINC000520206896 928388474 /nfs/dbraw/zinc/38/84/74/928388474.db2.gz YISDLMPVUBIHMP-UHFFFAOYSA-N 2 0 412.525 4.162 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCSCC2)cc1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000520291506 928453161 /nfs/dbraw/zinc/45/31/61/928453161.db2.gz QKJISPHSYBGJFL-QHCPKHFHSA-N 2 0 423.626 4.129 20 0 HIADRP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000520612953 928673031 /nfs/dbraw/zinc/67/30/31/928673031.db2.gz JZOCBGRSGVAXEH-QFIPXVFZSA-N 2 0 422.617 4.335 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)[C@@H]1CCC[N@H+](Cc2cccc(F)c2)C1)c1ccsc1 ZINC000520953452 928887672 /nfs/dbraw/zinc/88/76/72/928887672.db2.gz HGJIKVXGAPRCHL-DENIHFKCSA-N 2 0 417.594 4.299 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1NC[C@H]1C[NH+](Cc2ccccc2)CCCO1 ZINC000521282899 929099489 /nfs/dbraw/zinc/09/94/89/929099489.db2.gz VJVWNVYUHYTLOS-UIOOFZCWSA-N 2 0 421.629 4.168 20 0 HIADRP Cc1nn(-c2ccccc2)c(C)c1C[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000521826864 929480633 /nfs/dbraw/zinc/48/06/33/929480633.db2.gz YQXWWDLEHGPBKJ-UHFFFAOYSA-N 2 0 417.601 4.181 20 0 HIADRP Cc1ccccc1[C@H]1C[C@@H](C)[N@@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000524593615 929703556 /nfs/dbraw/zinc/70/35/56/929703556.db2.gz JDGLRIXJVYLEHU-QPPBQGQZSA-N 2 0 405.586 4.085 20 0 HIADRP C[NH+](C)Cc1cccc(C(=O)NCCCC[NH+]2CCC(Cc3ccccc3)CC2)c1 ZINC000524973526 929938796 /nfs/dbraw/zinc/93/87/96/929938796.db2.gz ZZYWWHGXTGLKNZ-UHFFFAOYSA-N 2 0 407.602 4.213 20 0 HIADRP O=C(Nc1cccc(C[NH+]2CCSCC2)c1)[C@@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000525484223 930273323 /nfs/dbraw/zinc/27/33/23/930273323.db2.gz ZPGLWLMVHLUWMJ-QHCPKHFHSA-N 2 0 409.599 4.229 20 0 HIADRP Cc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(-n2cc(Cl)cn2)n1 ZINC000526049884 930515248 /nfs/dbraw/zinc/51/52/48/930515248.db2.gz DFGLQGTVUQLGIB-RXVVDRJESA-N 2 0 409.965 4.229 20 0 HIADRP C[C@@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1cc2ccccc2s1 ZINC000527194351 930609477 /nfs/dbraw/zinc/60/94/77/930609477.db2.gz HJMUYNDXWKEQMI-GOSISDBHSA-N 2 0 407.583 4.464 20 0 HIADRP CC[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1ccc(Br)cc1Cl ZINC000527348633 930643177 /nfs/dbraw/zinc/64/31/77/930643177.db2.gz JULMIBBFFJWOCJ-SFHVURJKSA-N 2 0 402.808 4.171 20 0 HIADRP Cc1ccc([C@@H](CCn2cncn2)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1 ZINC000527351757 930643944 /nfs/dbraw/zinc/64/39/44/930643944.db2.gz JRYAIXKNDYCYQM-HSZRJFAPSA-N 2 0 409.603 4.281 20 0 HIADRP C[C@H]1C[NH+](Cc2ccc(-c3nc(-c4ccc(C[NH+](C)C)cc4)no3)cc2)C[C@H](C)O1 ZINC000530871669 930845000 /nfs/dbraw/zinc/84/50/00/930845000.db2.gz RWJKVHVTOAWIPA-ROUUACIJSA-N 2 0 406.530 4.074 20 0 HIADRP CCn1c(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)nc2ccccc21 ZINC000530904009 930854585 /nfs/dbraw/zinc/85/45/85/930854585.db2.gz UQBGZZCIKYUITM-UHFFFAOYSA-N 2 0 406.574 4.217 20 0 HIADRP CC[C@H](C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1)[NH+](CC)CC ZINC000531300495 931007246 /nfs/dbraw/zinc/00/72/46/931007246.db2.gz WZDUTCQANIYDQX-DFQSSKMNSA-N 2 0 413.528 4.325 20 0 HIADRP CCN(C(=O)C1CCN(c2cc[nH+]cc2C)CC1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000531443064 931058685 /nfs/dbraw/zinc/05/86/85/931058685.db2.gz VVDQHNFDWDLTGC-QPPBQGQZSA-N 2 0 420.601 4.290 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]CC2(c3ccccc3)CCOCC2)CC1 ZINC000531531980 931095192 /nfs/dbraw/zinc/09/51/92/931095192.db2.gz JXCYBKXOXWEAKU-UHFFFAOYSA-N 2 0 407.602 4.057 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc4c(c3)OCCCO4)CC2)cc1 ZINC000531694862 931158564 /nfs/dbraw/zinc/15/85/64/931158564.db2.gz VYZMFPBHISJMRZ-LJQANCHMSA-N 2 0 410.558 4.419 20 0 HIADRP CC[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1cccc(Br)c1 ZINC000531710542 931169168 /nfs/dbraw/zinc/16/91/68/931169168.db2.gz XDASGSBWKHGZDA-FCHUYYIVSA-N 2 0 416.407 4.479 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1cc(F)cc(Br)c1)C1CC[NH+](C)CC1 ZINC000531851179 931221077 /nfs/dbraw/zinc/22/10/77/931221077.db2.gz IDMZLLWABUIUPY-UHFFFAOYSA-N 2 0 420.370 4.408 20 0 HIADRP COc1ccsc1C[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000531956661 931263431 /nfs/dbraw/zinc/26/34/31/931263431.db2.gz NQGGDLPZRZVZTL-UHFFFAOYSA-N 2 0 407.583 4.369 20 0 HIADRP C[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 ZINC000531958749 931264788 /nfs/dbraw/zinc/26/47/88/931264788.db2.gz WWQBFNWPRUFLDK-GCJKJVERSA-N 2 0 421.507 4.267 20 0 HIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000531959355 931265716 /nfs/dbraw/zinc/26/57/16/931265716.db2.gz YTQBTUWUKDTGMZ-OALUTQOASA-N 2 0 421.564 4.483 20 0 HIADRP CCOc1ccc([C@@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)cc1OCC ZINC000531965219 931268147 /nfs/dbraw/zinc/26/81/47/931268147.db2.gz YQAUSEAASKQFDS-NFBKMPQASA-N 2 0 411.590 4.123 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+]Cc2cccc(OCCCc3ccccc3)c2)CC1 ZINC000532016276 931285471 /nfs/dbraw/zinc/28/54/71/931285471.db2.gz YBRMHKQDWYRPAR-IZZNHLLZSA-N 2 0 408.586 4.166 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]CCc2nc(C(F)(F)F)cs2)CC1 ZINC000532041069 931295187 /nfs/dbraw/zinc/29/51/87/931295187.db2.gz VWOJECIHZUWBDI-UHFFFAOYSA-N 2 0 412.525 4.026 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)ccc1OC(F)F ZINC000532107700 931315476 /nfs/dbraw/zinc/31/54/76/931315476.db2.gz GTSMOQCWMOZMCL-UHFFFAOYSA-N 2 0 419.516 4.117 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccccc2-n2nc(C)cc2C)CC1 ZINC000532120565 931321016 /nfs/dbraw/zinc/32/10/16/931321016.db2.gz MYKFUDQVGSYYHM-UHFFFAOYSA-N 2 0 417.601 4.311 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccc(OC)c(Cl)c2)CC1 ZINC000532193393 931343445 /nfs/dbraw/zinc/34/34/45/931343445.db2.gz NQXUZZMLSOGNDF-SFHVURJKSA-N 2 0 401.982 4.337 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000532195775 931344073 /nfs/dbraw/zinc/34/40/73/931344073.db2.gz CVMBYCVJNKNWNM-AWEZNQCLSA-N 2 0 411.434 4.402 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc2cc(OC)ccc2c1 ZINC000532197402 931345371 /nfs/dbraw/zinc/34/53/71/931345371.db2.gz SSWKAULQARJMHB-XMMPIXPASA-N 2 0 404.558 4.236 20 0 HIADRP CCOc1ccc(C(=O)N2CCC([NH2+][C@H](C)c3ccc(-n4ccnc4)cc3)CC2)cc1 ZINC000532209926 931353287 /nfs/dbraw/zinc/35/32/87/931353287.db2.gz OJTPVVMKRVOIGJ-LJQANCHMSA-N 2 0 418.541 4.226 20 0 HIADRP CCOc1ccc(C(=O)N2CCC([NH2+][C@@H](C)c3ccc(-n4ccnc4)cc3)CC2)cc1 ZINC000532209925 931353464 /nfs/dbraw/zinc/35/34/64/931353464.db2.gz OJTPVVMKRVOIGJ-IBGZPJMESA-N 2 0 418.541 4.226 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000532248031 931370712 /nfs/dbraw/zinc/37/07/12/931370712.db2.gz AFJKQWSDDXSCNJ-INIZCTEOSA-N 2 0 407.986 4.452 20 0 HIADRP O[C@H]1CCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000532269861 931377636 /nfs/dbraw/zinc/37/76/36/931377636.db2.gz FLIRNUHOSQAHNC-PKTZIBPZSA-N 2 0 402.485 4.225 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000532451510 931439688 /nfs/dbraw/zinc/43/96/88/931439688.db2.gz ONHAYBABJKVKPN-OAHLLOKOSA-N 2 0 409.452 4.154 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000532449739 931439766 /nfs/dbraw/zinc/43/97/66/931439766.db2.gz SDWKLXAZPXZYIZ-IBGZPJMESA-N 2 0 419.038 4.458 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](Cc3cccc(F)c3)c3cccc(F)c3)cn2)CC1 ZINC000532452114 931440340 /nfs/dbraw/zinc/44/03/40/931440340.db2.gz SIQVGCVPCMWJHA-XMMPIXPASA-N 2 0 422.523 4.185 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000532451678 931440618 /nfs/dbraw/zinc/44/06/18/931440618.db2.gz JXURWYWZVZUWGO-HZPDHXFCSA-N 2 0 423.388 4.086 20 0 HIADRP C[C@H](NCc1ccccc1C[NH+]1CCCCC1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000532457757 931443643 /nfs/dbraw/zinc/44/36/43/931443643.db2.gz QXDOUSOEGLDVHK-KRWDZBQOSA-N 2 0 404.551 4.066 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(OC(F)(F)F)cc1)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000532460765 931444650 /nfs/dbraw/zinc/44/46/50/931444650.db2.gz BQBSDIMMEXNMTJ-CYBMUJFWSA-N 2 0 401.473 4.201 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](CCC(=O)N[C@@H](c2cccs2)c2ccccc2)CC1 ZINC000532537806 931515436 /nfs/dbraw/zinc/51/54/36/931515436.db2.gz KXMSEAMOKXNVNN-XMMPIXPASA-N 2 0 413.631 4.396 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCC[C@@H]2C[C@H](C)[NH+](Cc3ccccc3)C2)CC1 ZINC000532798984 931633766 /nfs/dbraw/zinc/63/37/66/931633766.db2.gz ARLYPOOFUFZKIR-XUZZJYLKSA-N 2 0 414.638 4.049 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCC[C@H]2C[C@@H](C)[NH+](Cc3ccccc3)C2)CC1 ZINC000532798982 931633847 /nfs/dbraw/zinc/63/38/47/931633847.db2.gz ARLYPOOFUFZKIR-QPPBQGQZSA-N 2 0 414.638 4.049 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](CC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)CC1 ZINC000532950021 931708932 /nfs/dbraw/zinc/70/89/32/931708932.db2.gz QWAXWFRTUZUDCY-SANMLTNESA-N 2 0 419.613 4.213 20 0 HIADRP COc1cc(CNc2c[nH+]ccc2N2CC[NH+](C)CC2)ccc1OCc1cccs1 ZINC000533149413 931787256 /nfs/dbraw/zinc/78/72/56/931787256.db2.gz SVKYYSYYAHYQIL-UHFFFAOYSA-N 2 0 424.570 4.095 20 0 HIADRP Cc1cc(CNc2c[nH+]ccc2N2CC[NH+](C)CC2)cc(C)c1OCc1ccccn1 ZINC000533583468 931907364 /nfs/dbraw/zinc/90/73/64/931907364.db2.gz DKPFYGJUIOLCLH-UHFFFAOYSA-N 2 0 417.557 4.036 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(Sc4ccccc4)cc3)cn2)CC1 ZINC000533609706 931923344 /nfs/dbraw/zinc/92/33/44/931923344.db2.gz NXBSSADOPAJPFT-UHFFFAOYSA-N 2 0 404.583 4.274 20 0 HIADRP C[C@H](c1ccc(F)cc1)N(C)C(=O)C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534228422 932347819 /nfs/dbraw/zinc/34/78/19/932347819.db2.gz OZAUSCHZGXGRDV-OAQYLSRUSA-N 2 0 423.576 4.333 20 0 HIADRP c1cc(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)ccc1C[NH+]1CC[C@@H](C2CCOCC2)C1 ZINC000534380281 932407553 /nfs/dbraw/zinc/40/75/53/932407553.db2.gz FIJYKIOGPSYAKK-CLJLJLNGSA-N 2 0 412.618 4.184 20 0 HIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccnc2)cc1F ZINC000534970514 932869306 /nfs/dbraw/zinc/86/93/06/932869306.db2.gz DUDCHQPRPCPNMD-UHFFFAOYSA-N 2 0 415.516 4.425 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)ccn1 ZINC000534975605 932871614 /nfs/dbraw/zinc/87/16/14/932871614.db2.gz HMBPNQPJMQUVJH-UHFFFAOYSA-N 2 0 413.468 4.382 20 0 HIADRP C[N@@H+]1CC[C@@H](CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000535703292 933358326 /nfs/dbraw/zinc/35/83/26/933358326.db2.gz XXUZKSVTBKANEG-KXBFYZLASA-N 2 0 424.992 4.080 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)N2CC[C@@H](C3CC[NH+](C)CC3)C2)CCCC1)c1ccccc1 ZINC000535939825 933506712 /nfs/dbraw/zinc/50/67/12/933506712.db2.gz YVKLFIZFFGFDHB-NZQKXSOJSA-N 2 0 412.622 4.023 20 0 HIADRP COc1cccc2cc([C@H](C)[NH2+]Cc3ccc(C(=O)NCC[NH+]4CCCC4)cc3)oc21 ZINC000537303631 933705868 /nfs/dbraw/zinc/70/58/68/933705868.db2.gz KGCZOHKHDVGUHU-SFHVURJKSA-N 2 0 421.541 4.118 20 0 HIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]C[C@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000537737125 938366301 /nfs/dbraw/zinc/36/63/01/938366301.db2.gz QPDUMBZWLGVKPI-YKSBVNFPSA-N 2 0 413.993 4.349 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nc(-c2ccc(F)c(F)c2)no1 ZINC000537846794 938389141 /nfs/dbraw/zinc/38/91/41/938389141.db2.gz VRNHDBINHURSGN-UHFFFAOYSA-N 2 0 413.472 4.148 20 0 HIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)cc1 ZINC000537959079 938434814 /nfs/dbraw/zinc/43/48/14/938434814.db2.gz UITOVYJQIUHLOG-OPXMRZJTSA-N 2 0 400.607 4.320 20 0 HIADRP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000537969264 938439902 /nfs/dbraw/zinc/43/99/02/938439902.db2.gz RMBOJTPPXKQVRI-MHECFPHRSA-N 2 0 409.549 4.065 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 ZINC000537971131 938440284 /nfs/dbraw/zinc/44/02/84/938440284.db2.gz AJDPXBNRRBFOEF-VMBXEPDQSA-N 2 0 422.585 4.314 20 0 HIADRP CCc1ccc([C@H](C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)N(C)C)cc1 ZINC000538268845 938579976 /nfs/dbraw/zinc/57/99/76/938579976.db2.gz OBBWBPAHTTYZCN-ZEQRLZLVSA-N 2 0 407.602 4.430 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@H]1CCN(c3c(F)cccc3F)C1)c1ccccc1O2 ZINC000538293573 938585076 /nfs/dbraw/zinc/58/50/76/938585076.db2.gz IVXKQZPLYZWXEV-LAUBAEHRSA-N 2 0 413.512 4.121 20 0 HIADRP CC(C)N1CC[C@@H](NC(=O)c2ccc(C[NH+](C)C)cc2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000538624219 938664710 /nfs/dbraw/zinc/66/47/10/938664710.db2.gz NMMNZQZFRRHGDI-YADHBBJMSA-N 2 0 417.956 4.495 20 0 HIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3cccc(OCc4ccccn4)c3)CC2)C[C@H](C)O1 ZINC000538763278 938704962 /nfs/dbraw/zinc/70/49/62/938704962.db2.gz RJJDJHDDTKIUNL-VXKWHMMOSA-N 2 0 423.601 4.372 20 0 HIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3cccc(OCc4ccccn4)c3)CC2)C[C@@H](C)O1 ZINC000538763276 938705214 /nfs/dbraw/zinc/70/52/14/938705214.db2.gz RJJDJHDDTKIUNL-FGZHOGPDSA-N 2 0 423.601 4.372 20 0 HIADRP Cc1sc(NC(=O)C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c(C)c1C ZINC000538945875 938744053 /nfs/dbraw/zinc/74/40/53/938744053.db2.gz SWFOPDUTRMHYBR-UHFFFAOYSA-N 2 0 400.592 4.245 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)nnn1-c1cccc(Cl)c1 ZINC000539037407 938776716 /nfs/dbraw/zinc/77/67/16/938776716.db2.gz GKEJVRYYGBHEER-MRXNPFEDSA-N 2 0 410.953 4.191 20 0 HIADRP CCC1(C[NH2+]C2CCN(Cc3ccncc3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000539043099 938779286 /nfs/dbraw/zinc/77/92/86/938779286.db2.gz PZPNVIAYMQFXOT-UHFFFAOYSA-N 2 0 406.618 4.328 20 0 HIADRP COc1ccc(Br)cc1C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000539064219 938790124 /nfs/dbraw/zinc/79/01/24/938790124.db2.gz IROTWDQJTUAOIH-OAHLLOKOSA-N 2 0 407.352 4.249 20 0 HIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3CCN(C(=O)NC4CCCCC4)CC3)CC2)C1 ZINC000539079045 938797577 /nfs/dbraw/zinc/79/75/77/938797577.db2.gz PASVXMLMGORLAW-WMZHIEFXSA-N 2 0 404.643 4.126 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H](c3ccc(Cl)cc3)C3CC3)c2)C1 ZINC000539201395 938818792 /nfs/dbraw/zinc/81/87/92/938818792.db2.gz YOBHRNNNROEBJP-GGAORHGYSA-N 2 0 411.977 4.278 20 0 HIADRP COc1ccccc1[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)C1CCCC1 ZINC000539204966 938818951 /nfs/dbraw/zinc/81/89/51/938818951.db2.gz WYYDYPOUTHZSAX-DEOSSOPVSA-N 2 0 409.574 4.008 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]C[C@@H](c1ccccc1)N1CCCC1)c1ccccc1O2 ZINC000539369088 938850272 /nfs/dbraw/zinc/85/02/72/938850272.db2.gz BEWYYJBAPYFRAD-ZEQRLZLVSA-N 2 0 405.586 4.401 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1N[C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000539394758 938853885 /nfs/dbraw/zinc/85/38/85/938853885.db2.gz ZDWDHAXQGIAQNM-NQHRYMMQSA-N 2 0 419.613 4.475 20 0 HIADRP CC(C)(C)c1nn(Cc2ccccc2)cc1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000539822030 938944791 /nfs/dbraw/zinc/94/47/91/938944791.db2.gz GYYZEPPTKQNHKZ-UHFFFAOYSA-N 2 0 424.633 4.306 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)NC3CCC(C[NH+](C)C)CC3)c2)CC1 ZINC000539873402 938963226 /nfs/dbraw/zinc/96/32/26/938963226.db2.gz IOGAWRWLPMRKAO-UHFFFAOYSA-N 2 0 400.611 4.203 20 0 HIADRP CC[C@@H](C(=O)Nc1ccc(OC)cc1)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540043730 939047404 /nfs/dbraw/zinc/04/74/04/939047404.db2.gz HMVWWYIZWAZTFI-QHCPKHFHSA-N 2 0 410.562 4.046 20 0 HIADRP CC[C@H](C(=O)Nc1ccc(OC)cc1)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540043729 939047461 /nfs/dbraw/zinc/04/74/61/939047461.db2.gz HMVWWYIZWAZTFI-HSZRJFAPSA-N 2 0 410.562 4.046 20 0 HIADRP C[N@@H+](CCC(=O)N[C@@H]1CCCc2ccccc21)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540045651 939048636 /nfs/dbraw/zinc/04/86/36/939048636.db2.gz TXUSIHVRJADXIX-RUZDIDTESA-N 2 0 420.601 4.204 20 0 HIADRP CCSc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000540168653 939100743 /nfs/dbraw/zinc/10/07/43/939100743.db2.gz FREKBRNLGKMPSI-LJQANCHMSA-N 2 0 411.615 4.475 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccccc1C(F)(F)F ZINC000540171000 939101984 /nfs/dbraw/zinc/10/19/84/939101984.db2.gz LJLPHPMAFTTXSM-QGZVFWFLSA-N 2 0 419.491 4.382 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1cccc(C(F)(F)F)c1 ZINC000540173292 939103178 /nfs/dbraw/zinc/10/31/78/939103178.db2.gz MGVSMIVTJJXUES-KRWDZBQOSA-N 2 0 419.491 4.382 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000540191838 939116819 /nfs/dbraw/zinc/11/68/19/939116819.db2.gz ZQMFGYKLSLWIKU-HXUWFJFHSA-N 2 0 420.601 4.169 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1nc2ccc(Cl)cc2n1C ZINC000540302956 939187700 /nfs/dbraw/zinc/18/77/00/939187700.db2.gz VGAKORWGMUKIRJ-INIZCTEOSA-N 2 0 400.954 4.408 20 0 HIADRP CC[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1nccn1C ZINC000540404634 939236673 /nfs/dbraw/zinc/23/66/73/939236673.db2.gz SQNDSWHQWRZKET-FQEVSTJZSA-N 2 0 423.527 4.082 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1C(F)(F)F ZINC000540442333 939252105 /nfs/dbraw/zinc/25/21/05/939252105.db2.gz RSDOUWOTJYGZCZ-AOIWGVFYSA-N 2 0 419.491 4.135 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]C[C@@H]1CCN(c3ccc(F)cc3)C1)c1ccccc1O2 ZINC000540475389 939267274 /nfs/dbraw/zinc/26/72/74/939267274.db2.gz UIMFEMQPMSERPN-WMZHIEFXSA-N 2 0 409.549 4.230 20 0 HIADRP CN(C)[C@@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1c(F)cccc1F ZINC000540493080 939273959 /nfs/dbraw/zinc/27/39/59/939273959.db2.gz SDGKACMOSKNGLI-SFTDATJTSA-N 2 0 415.528 4.145 20 0 HIADRP CCOc1cccc2cc([C@@H](C)[NH2+]Cc3ccc(CN4CC[NH+](C)CC4)cc3)oc21 ZINC000540598405 939315627 /nfs/dbraw/zinc/31/56/27/939315627.db2.gz IPJDOLDIKDSSQA-LJQANCHMSA-N 2 0 407.558 4.430 20 0 HIADRP CCC[NH+]1CCC(NC(=O)N[C@@H]2CCN(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)CC1 ZINC000540711757 939345494 /nfs/dbraw/zinc/34/54/94/939345494.db2.gz AHYFXNJCPXYMKY-RTWAWAEBSA-N 2 0 424.992 4.177 20 0 HIADRP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)CCCO2 ZINC000540989241 939426234 /nfs/dbraw/zinc/42/62/34/939426234.db2.gz OZLGOGKKDCIARW-UGKGYDQZSA-N 2 0 400.950 4.219 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)c(F)c1 ZINC000540990876 939426685 /nfs/dbraw/zinc/42/66/85/939426685.db2.gz XJFMRZBBAMLONX-DNVCBOLYSA-N 2 0 421.354 4.396 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000541744984 939619299 /nfs/dbraw/zinc/61/92/99/939619299.db2.gz BJBNOVJQAQMBRS-PKTZIBPZSA-N 2 0 406.636 4.182 20 0 HIADRP CC(=O)Nc1ccc([C@@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000541914144 939652149 /nfs/dbraw/zinc/65/21/49/939652149.db2.gz KYAGMJDFZQAUGX-HXUWFJFHSA-N 2 0 409.574 4.367 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000541914749 939652262 /nfs/dbraw/zinc/65/22/62/939652262.db2.gz JEHSYTUIXATPAL-FGZHOGPDSA-N 2 0 415.375 4.257 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)CC1 ZINC000542080464 939704215 /nfs/dbraw/zinc/70/42/15/939704215.db2.gz WULOJOKWZYGNDS-OAQYLSRUSA-N 2 0 420.667 4.429 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](c2ccc(F)cc2)c2cccnc2)[C@@H](c2ccccc2)C1 ZINC000542480289 939830554 /nfs/dbraw/zinc/83/05/54/939830554.db2.gz BBICUVBTAAWCEC-CLJLJLNGSA-N 2 0 418.560 4.279 20 0 HIADRP CC1(C(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)CC[NH+](Cc2ccccc2)CC1 ZINC000542487465 939831823 /nfs/dbraw/zinc/83/18/23/939831823.db2.gz YDVKRMMTBGKPOD-XMMPIXPASA-N 2 0 405.586 4.242 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](CCOC(c3ccccc3)c3ccccc3)CC2)CC1 ZINC000542592982 939847188 /nfs/dbraw/zinc/84/71/88/939847188.db2.gz KPNMBYAAGOQAFL-UHFFFAOYSA-N 2 0 421.629 4.142 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cnn1-c1ccc(F)cc1 ZINC000542849012 939862907 /nfs/dbraw/zinc/86/29/07/939862907.db2.gz JALHYIHVIODYEX-UUOWRZLLSA-N 2 0 422.548 4.127 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(Br)cc1 ZINC000542852110 939863176 /nfs/dbraw/zinc/86/31/76/939863176.db2.gz QOPMHNBWZZXDDJ-KKSFZXQISA-N 2 0 403.364 4.257 20 0 HIADRP C[NH+](Cc1ccccc1)Cc1cccc(C(=O)N2CC[C@@H](C[N@H+](C)CC3CC3)C2)c1 ZINC000543279071 940016441 /nfs/dbraw/zinc/01/64/41/940016441.db2.gz REYDNEFVRPWDLT-DEOSSOPVSA-N 2 0 405.586 4.123 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000543324193 940031386 /nfs/dbraw/zinc/03/13/86/940031386.db2.gz NVNXOTAHUXKVCM-AZGAKELHSA-N 2 0 417.597 4.408 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2c[nH]c3ccc(Br)cc23)[C@@H](C)C1 ZINC000543416746 940058308 /nfs/dbraw/zinc/05/83/08/940058308.db2.gz ZZQQNAOFEDFQIN-JXFKEZNVSA-N 2 0 422.411 4.200 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@H](c3ccccc3)c3cncnc3)CC2)cc1 ZINC000543591508 940122967 /nfs/dbraw/zinc/12/29/67/940122967.db2.gz JLNKZFNGJGSNPD-AREMUKBSSA-N 2 0 416.569 4.227 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@H]2CCCc3c(Cl)cccc32)cc1 ZINC000543601366 940126998 /nfs/dbraw/zinc/12/69/98/940126998.db2.gz FXMHOWXXWDMSQL-QHCPKHFHSA-N 2 0 411.977 4.333 20 0 HIADRP COc1ccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccccc2)cc1 ZINC000543772703 940180695 /nfs/dbraw/zinc/18/06/95/940180695.db2.gz BKTIIPZZOZNJHZ-RSXGOPAZSA-N 2 0 402.538 4.141 20 0 HIADRP COc1ccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2ccccc2)cc1 ZINC000543772700 940180860 /nfs/dbraw/zinc/18/08/60/940180860.db2.gz BKTIIPZZOZNJHZ-AHWVRZQESA-N 2 0 402.538 4.141 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)c2ccc(NC(C)=O)cc2)CC1 ZINC000543776649 940182754 /nfs/dbraw/zinc/18/27/54/940182754.db2.gz ZQGXMIFHYJOHDD-MSOLQXFVSA-N 2 0 412.553 4.338 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCc2c1cccc2Br ZINC000543777214 940183445 /nfs/dbraw/zinc/18/34/45/940183445.db2.gz PWAMWXGUQJWVOA-AVRDEDQJSA-N 2 0 415.375 4.183 20 0 HIADRP O[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)COc1cccc2ccccc21 ZINC000563798783 945303327 /nfs/dbraw/zinc/30/33/27/945303327.db2.gz IZYUDXMVFTYDEG-AAZCMCCISA-N 2 0 416.565 4.365 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)COC(c1ccccc1)c1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544425723 940424626 /nfs/dbraw/zinc/42/46/26/940424626.db2.gz XVKVXLFXCYQJPJ-PMWMKWCKSA-N 2 0 422.613 4.396 20 0 HIADRP COc1ccc(-c2ccccc2)cc1C[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000544596541 940487171 /nfs/dbraw/zinc/48/71/71/940487171.db2.gz OIIOYIUKQJWXCD-UHFFFAOYSA-N 2 0 407.602 4.212 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)ccn1 ZINC000544827614 940517827 /nfs/dbraw/zinc/51/78/27/940517827.db2.gz KZKNKSKYLZVHHU-JOCHJYFZSA-N 2 0 410.949 4.144 20 0 HIADRP C[NH+](C)CCOc1ccccc1-c1noc([C@H]2CCC[N@H+](Cc3cccc(F)c3)C2)n1 ZINC000545794794 940597742 /nfs/dbraw/zinc/59/77/42/940597742.db2.gz LOEVCDXQDQWBSF-IBGZPJMESA-N 2 0 424.520 4.196 20 0 HIADRP CCN(C(=O)C1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000546199153 940727919 /nfs/dbraw/zinc/72/79/19/940727919.db2.gz AJFMANYMCUOOKK-RUZDIDTESA-N 2 0 405.586 4.022 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000547363106 941058543 /nfs/dbraw/zinc/05/85/43/941058543.db2.gz PEXLMQWPYMLLCS-DNQXCXABSA-N 2 0 409.549 4.077 20 0 HIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000547395946 941060384 /nfs/dbraw/zinc/06/03/84/941060384.db2.gz ZLQZYWVZYWBWAY-XMSQKQJNSA-N 2 0 405.508 4.215 20 0 HIADRP C[C@@H]([NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547504799 941066164 /nfs/dbraw/zinc/06/61/64/941066164.db2.gz JUUROCZHWKTYEX-DENIHFKCSA-N 2 0 413.556 4.429 20 0 HIADRP CCCOC[C@H](Cc1cccc(Br)c1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000548485505 941108677 /nfs/dbraw/zinc/10/86/77/941108677.db2.gz GVWQSPSPPPFUJQ-NRFANRHFSA-N 2 0 409.412 4.251 20 0 HIADRP COC(=O)c1cc(C[NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c[nH]1 ZINC000548993413 941139683 /nfs/dbraw/zinc/13/96/83/941139683.db2.gz KQFQRUXTSZOCNR-ZJVRTDGDSA-N 2 0 401.938 4.158 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000549037956 941147107 /nfs/dbraw/zinc/14/71/07/941147107.db2.gz LAJYCOFSNQGUFB-UIOOFZCWSA-N 2 0 417.597 4.409 20 0 HIADRP Cc1cc2ncn(C[C@@H](O)C[NH2+]Cc3ccc(C[N@H+]4CCC[C@H](C)C4)cc3)c2cc1C ZINC000549192096 941169972 /nfs/dbraw/zinc/16/99/72/941169972.db2.gz SJGYWFIOLRQOHI-CYFREDJKSA-N 2 0 420.601 4.036 20 0 HIADRP COc1cc(C)c(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1OC ZINC000550270345 941306858 /nfs/dbraw/zinc/30/68/58/941306858.db2.gz VQIFFBZKCFAANU-HSZRJFAPSA-N 2 0 424.585 4.031 20 0 HIADRP Fc1ccc(/C=C/C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1F ZINC000550271173 941307341 /nfs/dbraw/zinc/30/73/41/941307341.db2.gz JQJSJLBQBRSWGT-ZMTJCJBESA-N 2 0 412.524 4.496 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CCc4sc(Br)cc43)cc2)CC1 ZINC000551008054 941394144 /nfs/dbraw/zinc/39/41/44/941394144.db2.gz JKUHIWDTXZBYDK-GOSISDBHSA-N 2 0 420.420 4.035 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccccc1O2 ZINC000551240990 941434057 /nfs/dbraw/zinc/43/40/57/941434057.db2.gz PKXAFJIJOXFEFC-GOSISDBHSA-N 2 0 405.464 4.221 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@H]3CCCOc4ccccc43)C3(C2)CCOCC3)cc1 ZINC000551265895 941439538 /nfs/dbraw/zinc/43/95/38/941439538.db2.gz ZVERXACISXPKLN-VWNXMTODSA-N 2 0 406.570 4.419 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+]C(C)(C)c2ccc(Cl)cc2)CC1 ZINC000551463736 941484751 /nfs/dbraw/zinc/48/47/51/941484751.db2.gz PQNTYCTTWPGNLS-UHFFFAOYSA-N 2 0 413.993 4.254 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000551574298 941504981 /nfs/dbraw/zinc/50/49/81/941504981.db2.gz GVSVAFCARXUMTG-QHCPKHFHSA-N 2 0 409.530 4.493 20 0 HIADRP COc1cc(F)c([C@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1OC ZINC000551814348 941551064 /nfs/dbraw/zinc/55/10/64/941551064.db2.gz VKOTXEFTIAUXGB-INIZCTEOSA-N 2 0 402.510 4.167 20 0 HIADRP CCO[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C12CCOCC2 ZINC000552065703 941577779 /nfs/dbraw/zinc/57/77/79/941577779.db2.gz KMTIJZPSWXYEIL-ARXROMJUSA-N 2 0 412.618 4.241 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000552332049 941634335 /nfs/dbraw/zinc/63/43/35/941634335.db2.gz ZGMGITULLPQLHC-ZJSXRUAMSA-N 2 0 412.622 4.221 20 0 HIADRP COc1cc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)c(-c2ccccc2)cc1OC ZINC000552497684 941688493 /nfs/dbraw/zinc/68/84/93/941688493.db2.gz UHQHZOFAYJOBEK-AKIFATBCSA-N 2 0 410.558 4.054 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H](C)c2cccc(OC(C)C)c2)CC1 ZINC000552875311 941796254 /nfs/dbraw/zinc/79/62/54/941796254.db2.gz MSMYCNZNDGANPD-OAQYLSRUSA-N 2 0 423.601 4.214 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)[C@@H]1C[N@@H+](C(C)(C)C)C[C@H]1C(F)(F)F)c1ccsc1 ZINC000553314686 941865978 /nfs/dbraw/zinc/86/59/78/941865978.db2.gz UHVQFRKZQODWDY-ZACQAIPSSA-N 2 0 419.557 4.156 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)[C@@H]1C[N@@H+](C(C)(C)C)C[C@H]1C(F)(F)F)c1ccsc1 ZINC000553314685 941866055 /nfs/dbraw/zinc/86/60/55/941866055.db2.gz UHVQFRKZQODWDY-BRWVUGGUSA-N 2 0 419.557 4.156 20 0 HIADRP C[C@@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000553394226 941878674 /nfs/dbraw/zinc/87/86/74/941878674.db2.gz IXXRCVULBXSTET-YKSBVNFPSA-N 2 0 420.601 4.183 20 0 HIADRP Cc1cc(C[NH+]2CCSCC2)ccc1NC(=O)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000553403801 941879942 /nfs/dbraw/zinc/87/99/42/941879942.db2.gz BQENJZOOLZFSLM-JOCHJYFZSA-N 2 0 409.599 4.004 20 0 HIADRP CCc1[nH+]c2ccccc2c(N2CCC(C(=O)NCCC[NH+](CC)CC)CC2)c1C ZINC000554284833 942090731 /nfs/dbraw/zinc/09/07/31/942090731.db2.gz HOXZPMWRUVPEHQ-UHFFFAOYSA-N 2 0 410.606 4.170 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555236437 942440684 /nfs/dbraw/zinc/44/06/84/942440684.db2.gz XQGCQLIEASGYGZ-BQQUOAEZSA-N 2 0 408.586 4.458 20 0 HIADRP FC(F)Oc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000555612335 942669259 /nfs/dbraw/zinc/66/92/59/942669259.db2.gz LFTWBPLFLOPHOF-NRFANRHFSA-N 2 0 416.512 4.306 20 0 HIADRP CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(C(=O)OC)cc1 ZINC000556076140 942801336 /nfs/dbraw/zinc/80/13/36/942801336.db2.gz KFYQMXLHYUOQJI-JTSKRJEESA-N 2 0 413.537 4.166 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1F ZINC000556234186 942824492 /nfs/dbraw/zinc/82/44/92/942824492.db2.gz VMOGMJHNHNLPGY-DENIHFKCSA-N 2 0 412.549 4.414 20 0 HIADRP Cc1cccc([C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C(=O)N(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000556317127 942840022 /nfs/dbraw/zinc/84/00/22/942840022.db2.gz MVUUTXNATKSWNZ-WSZJRCBQSA-N 2 0 419.613 4.152 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H]3CCC[C@@H]3c3cccc(C(F)(F)F)c3)ccn2)CC1 ZINC000556587143 942907034 /nfs/dbraw/zinc/90/70/34/942907034.db2.gz OKXXYLYXAJFJDH-NHCUHLMSSA-N 2 0 418.507 4.278 20 0 HIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000556608091 942913024 /nfs/dbraw/zinc/91/30/24/942913024.db2.gz KQSAMAHKOOASSV-URXFXBBRSA-N 3 0 407.602 4.302 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCNC(=O)NC[C@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000556637584 942922991 /nfs/dbraw/zinc/92/29/91/942922991.db2.gz ALNQIOHSBGRDCT-HGHGUNKESA-N 2 0 424.992 4.036 20 0 HIADRP COc1ccc(C[C@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(C)c1OC ZINC000556887487 942952179 /nfs/dbraw/zinc/95/21/79/942952179.db2.gz XVMIKFIDKOZPQV-SFHVURJKSA-N 2 0 412.574 4.206 20 0 HIADRP COc1ccc([C@H](CNC(=O)c2ccc(C[NH+]3CCCC3)cc2)[NH+]2CCCCC2)cc1 ZINC000556975221 942986294 /nfs/dbraw/zinc/98/62/94/942986294.db2.gz YSQMTFDLCFFNRV-VWLOTQADSA-N 2 0 421.585 4.248 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2nc(-c3ccccc3)c(C)s2)[C@@H](C)C1 ZINC000557278196 943065107 /nfs/dbraw/zinc/06/51/07/943065107.db2.gz YWTYFFULVYUSHC-RXVVDRJESA-N 2 0 401.620 4.388 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000558167134 943405122 /nfs/dbraw/zinc/40/51/22/943405122.db2.gz XTPPFNKEUSOURF-WOJBJXKFSA-N 2 0 407.480 4.467 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000558167124 943405387 /nfs/dbraw/zinc/40/53/87/943405387.db2.gz XTPPFNKEUSOURF-PMACEKPBSA-N 2 0 407.480 4.467 20 0 HIADRP O=C(NCCC[NH+]1CCCC1)C1CC[NH+](CC2CCC(c3ccccc3)CC2)CC1 ZINC000558415525 943553515 /nfs/dbraw/zinc/55/35/15/943553515.db2.gz APISLXCLLGPIDQ-UHFFFAOYSA-N 2 0 411.634 4.275 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CNC(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000558893288 943725694 /nfs/dbraw/zinc/72/56/94/943725694.db2.gz XUZRSARVIZDZSI-JYNUSOIKSA-N 2 0 419.013 4.037 20 0 HIADRP CC1CC[NH+](CC(=O)N[C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000558970222 943776127 /nfs/dbraw/zinc/77/61/27/943776127.db2.gz DESATPRVFFWJON-FGAQOYRHSA-N 2 0 403.998 4.102 20 0 HIADRP CC(=O)NC1CCC([NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000558975180 943778869 /nfs/dbraw/zinc/77/88/69/943778869.db2.gz KWVYKSOVCAJODD-JPLLKXPWSA-N 2 0 403.998 4.291 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCN(C)[C@H](c4ccccc4)C3)CC2)cc1 ZINC000559752338 944043560 /nfs/dbraw/zinc/04/35/60/944043560.db2.gz FYBRVGFNHUWUPH-AHWVRZQESA-N 2 0 407.602 4.332 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(CN3CCOCC3)cc2)CC1 ZINC000559896497 944079274 /nfs/dbraw/zinc/07/92/74/944079274.db2.gz UMBYGVYOOSEEDV-UHFFFAOYSA-N 2 0 407.602 4.052 20 0 HIADRP CC[N@H+](C)C[C@H]1CCN(C(=O)[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2c2cccc(C)c2)C1 ZINC000560083686 944152468 /nfs/dbraw/zinc/15/24/68/944152468.db2.gz PEUGHGQPXFCRNS-ARMFNRFLSA-N 2 0 419.613 4.011 20 0 HIADRP C[NH+](CCCC[N@@H+](C)C[C@@H]1OCCc2ccccc21)C[C@@H]1OCCc2ccccc21 ZINC000560331531 944227426 /nfs/dbraw/zinc/22/74/26/944227426.db2.gz FCEKMVAHKVAOJS-UIOOFZCWSA-N 2 0 408.586 4.258 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccc2c(c1)OCC(=O)N2 ZINC000560530114 944245110 /nfs/dbraw/zinc/24/51/10/944245110.db2.gz ZOSGALPTFHTGHS-INIZCTEOSA-N 2 0 413.949 4.234 20 0 HIADRP CC(C)C[C@H]([NH2+]CC(=O)NC1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000561126224 944467143 /nfs/dbraw/zinc/46/71/43/944467143.db2.gz RLQLUSJPZAIWBG-FQEVSTJZSA-N 2 0 411.512 4.125 20 0 HIADRP C[NH+](C)[C@@H](CNc1cncc(NC[C@@H](c2ccsc2)[NH+](C)C)n1)c1ccsc1 ZINC000561143460 944479667 /nfs/dbraw/zinc/47/96/67/944479667.db2.gz TYBKGFNWHQCTST-ROUUACIJSA-N 2 0 416.620 4.029 20 0 HIADRP C[C@@H](Cc1ccc(F)cc1Br)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000564123485 945388210 /nfs/dbraw/zinc/38/82/10/945388210.db2.gz ORZIOQNKIIXTJY-HNNXBMFYSA-N 2 0 406.343 4.420 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cc1O ZINC000564419384 945571714 /nfs/dbraw/zinc/57/17/14/945571714.db2.gz IIBDXVYZDQGXKZ-OAHLLOKOSA-N 2 0 423.479 4.022 20 0 HIADRP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2ccc(-c3ccccc3OC)cc2)C(C)C)CC1 ZINC000564575515 945683915 /nfs/dbraw/zinc/68/39/15/945683915.db2.gz QVVAPPFZRBRFNJ-UHFFFAOYSA-N 2 0 423.601 4.173 20 0 HIADRP CN1CC[C@H]([NH2+]C[C@H](c2ccc(Cl)cc2)N2CCOCC2)C[C@H]1c1ccccc1 ZINC000565097795 945774070 /nfs/dbraw/zinc/77/40/70/945774070.db2.gz SLCDDNRGPOFXFL-KMDXXIMOSA-N 2 0 413.993 4.138 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]C[C@H]4CC[C@@H](c5nc(C6CC6)no5)O4)[C@H]3C2)cc1 ZINC000565673205 945864507 /nfs/dbraw/zinc/86/45/07/945864507.db2.gz CDRSJZOOMPGPTH-SPHOGXRMSA-N 2 0 422.573 4.057 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](c3ccccc3)c3cncnc3)CC2)cc1 ZINC000565801476 945886996 /nfs/dbraw/zinc/88/69/96/945886996.db2.gz PYKVZQFYFJQHKH-RUZDIDTESA-N 2 0 402.542 4.076 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000565974848 945950792 /nfs/dbraw/zinc/95/07/92/945950792.db2.gz YCWHAVGALRIECW-QFIPXVFZSA-N 2 0 410.949 4.144 20 0 HIADRP CCO[C@@H]1C[C@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C12CCCC2 ZINC000567128943 946246255 /nfs/dbraw/zinc/24/62/55/946246255.db2.gz NQXXYWSRDZHULS-KMDXXIMOSA-N 2 0 412.618 4.243 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000568494510 946572127 /nfs/dbraw/zinc/57/21/27/946572127.db2.gz PIYVHYGJSUMSGH-HYBUGGRVSA-N 2 0 408.590 4.432 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccc(S(C)(=O)=O)cc1 ZINC000569036413 946803802 /nfs/dbraw/zinc/80/38/02/946803802.db2.gz CMBZCLINEUTHTO-LJQANCHMSA-N 2 0 400.588 4.173 20 0 HIADRP C[C@H]([NH2+]CCCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000569341949 946859644 /nfs/dbraw/zinc/85/96/44/946859644.db2.gz ZJZXCUSWDMHFJY-GHTZIAJQSA-N 2 0 408.521 4.309 20 0 HIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000569395726 946866023 /nfs/dbraw/zinc/86/60/23/946866023.db2.gz HPIAETFUKUJFSD-CHMLTUNVSA-N 2 0 416.512 4.438 20 0 HIADRP CC[NH+](CC)Cc1ccc(C[NH2+]CCC(=O)Nc2ccc(Br)cc2)cc1 ZINC000571538827 947693325 /nfs/dbraw/zinc/69/33/25/947693325.db2.gz DBABKCRJCXSTEM-UHFFFAOYSA-N 2 0 418.379 4.409 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](NC[C@@H]2CCCC[NH+](Cc3ccccc3)C2)[C@@H](C)C1 ZINC000571573406 947709164 /nfs/dbraw/zinc/70/91/64/947709164.db2.gz QRZCYQVJRMADAI-HVCNVCAESA-N 2 0 401.639 4.015 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000573942887 948329974 /nfs/dbraw/zinc/32/99/74/948329974.db2.gz HBSPTLKDDHDONB-RBBKRZOGSA-N 2 0 420.475 4.393 20 0 HIADRP COc1cccc(-c2nn(C(C)(C)C)cc2C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c1 ZINC000573961040 948336656 /nfs/dbraw/zinc/33/66/56/948336656.db2.gz AAYULDKCSMVGKB-NRFANRHFSA-N 2 0 410.606 4.477 20 0 HIADRP C[C@@H]1C[NH+](CCC2CC[NH+](Cc3ccc(OCc4cccnc4)cc3)CC2)C[C@@H](C)O1 ZINC000574062459 948355199 /nfs/dbraw/zinc/35/51/99/948355199.db2.gz UTRPOZFGOSCYSJ-FGZHOGPDSA-N 2 0 423.601 4.372 20 0 HIADRP COc1cc(C)c(C[C@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1OC ZINC000574350178 948420751 /nfs/dbraw/zinc/42/07/51/948420751.db2.gz TTYFBWGLVMIZKS-IBGZPJMESA-N 2 0 412.574 4.206 20 0 HIADRP COc1cc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc(OC)c1OCC(F)F ZINC000574481691 948454430 /nfs/dbraw/zinc/45/44/30/948454430.db2.gz ULGLUBRCWBEMPV-WBVHZDCISA-N 2 0 412.521 4.090 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000574846424 948543376 /nfs/dbraw/zinc/54/33/76/948543376.db2.gz PAASYNNMZCQNGZ-UHFFFAOYSA-N 2 0 415.553 4.146 20 0 HIADRP CC(C)[N@H+](C)Cc1cnc2n1CCN(c1[nH+]c(N3CCCC3)cc3ccccc31)[C@@H]2C ZINC001164858813 721006170 /nfs/dbraw/zinc/00/61/70/721006170.db2.gz HIJPAQDKSFXTRV-LJQANCHMSA-N 2 0 418.589 4.453 20 0 HIADRP CC[N@@H+]1CCCC[C@H]1c1ccc(-n2nc(-c3ccc(F)cc3)c3c2CC[NH2+]CC3)nc1 ZINC001164797330 721597340 /nfs/dbraw/zinc/59/73/40/721597340.db2.gz GGOSHOAZTRZVFY-QFIPXVFZSA-N 2 0 419.548 4.309 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]C2CCC(N3C(=O)c4ccccc4C3=O)CC2)c1 ZINC000436232896 861537614 /nfs/dbraw/zinc/53/76/14/861537614.db2.gz QPBHWLFVEXFELI-UHFFFAOYSA-N 2 0 419.569 4.224 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000025702624 847022533 /nfs/dbraw/zinc/02/25/33/847022533.db2.gz GRGRLPGEDVSYGE-INIZCTEOSA-N 2 0 418.379 4.408 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC([NH+]2CCCCC2)CC1 ZINC000045780584 848727529 /nfs/dbraw/zinc/72/75/29/848727529.db2.gz HLUQDYUUXBEOGM-NRFANRHFSA-N 2 0 412.622 4.221 20 0 HIADRP Cc1ccc([C@@H](OC[C@@H](O)C[NH+]2CCC(CC[NH+](C)C)CC2)c2ccccc2)cc1 ZINC000056523041 850382533 /nfs/dbraw/zinc/38/25/33/850382533.db2.gz PFTXPUBFPCYMBV-UIOOFZCWSA-N 2 0 410.602 4.126 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)cc1 ZINC000058467343 850832648 /nfs/dbraw/zinc/83/26/48/850832648.db2.gz BWTGLLFJVJZZKQ-JOCHJYFZSA-N 2 0 412.578 4.148 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)C1 ZINC000060954480 851257972 /nfs/dbraw/zinc/25/79/72/851257972.db2.gz JJCSDSPKMQOZEP-YKSBVNFPSA-N 2 0 408.590 4.021 20 0 HIADRP CC(C)[NH+](CCNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)C(C)C ZINC000060955400 851257997 /nfs/dbraw/zinc/25/79/97/851257997.db2.gz ATCKTEMSPVQXDY-UHFFFAOYSA-N 2 0 410.606 4.333 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2c(OC)ccc3ccccc32)CC1 ZINC000061070326 851287072 /nfs/dbraw/zinc/28/70/72/851287072.db2.gz HLRHTLHFQWRADN-UHFFFAOYSA-N 2 0 403.570 4.276 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3cc(Br)ccc3F)cc2)CC1 ZINC000061070072 851287518 /nfs/dbraw/zinc/28/75/18/851287518.db2.gz COSJQTDJFQPPKO-UHFFFAOYSA-N 2 0 420.370 4.016 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NCc1ccccc1C[NH+]1CCCC1)c1ccsc1 ZINC000061553281 851402408 /nfs/dbraw/zinc/40/24/08/851402408.db2.gz HHDGTCKPGYGSHE-QFIPXVFZSA-N 2 0 414.619 4.226 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NCc2ccc(C[NH+]3CCC(C)CC3)cc2)c1 ZINC000061860569 851461969 /nfs/dbraw/zinc/46/19/69/851461969.db2.gz VBNAEJYJZHNRSC-UHFFFAOYSA-N 2 0 422.617 4.370 20 0 HIADRP COc1cc(C[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)c(-c2ccccc2)cc1OC ZINC000062252883 851517531 /nfs/dbraw/zinc/51/75/31/851517531.db2.gz YHAGYKNXPDEUMR-PMACEKPBSA-N 2 0 412.574 4.350 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NCc2cccc(C[NH+](C)C)c2)c2ccccc2)CC1 ZINC000062646926 851584327 /nfs/dbraw/zinc/58/43/27/851584327.db2.gz FEGJKEQTUGJQNU-XMMPIXPASA-N 2 0 408.590 4.021 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000063464222 851695932 /nfs/dbraw/zinc/69/59/32/851695932.db2.gz UCEYLQOKBAMGMB-RUZDIDTESA-N 2 0 422.617 4.240 20 0 HIADRP CC(C)[C@@H](CNC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1)[NH+]1CCC(C)CC1 ZINC000064754594 851977072 /nfs/dbraw/zinc/97/70/72/851977072.db2.gz KBNKIMJSSNVQJF-IFMALSPDSA-N 2 0 420.667 4.016 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)N[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)CC1 ZINC000065523042 852167968 /nfs/dbraw/zinc/16/79/68/852167968.db2.gz ZVOWGYPHOBBMDM-PXDATVDWSA-N 2 0 420.601 4.094 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](CC(=O)N[C@@H](C)c2ccc(Br)cc2)CC1 ZINC000071954573 852444685 /nfs/dbraw/zinc/44/46/85/852444685.db2.gz GDGFZXNSYOVZCW-KRWDZBQOSA-N 2 0 424.427 4.070 20 0 HIADRP COc1ccc([C@@H](CNC(=O)c2cccc(C[NH+]3CCCC3)c2)[NH+]2CCCCC2)cc1 ZINC000108712741 852874431 /nfs/dbraw/zinc/87/44/31/852874431.db2.gz CFFKNWCJJBQKBX-RUZDIDTESA-N 2 0 421.585 4.248 20 0 HIADRP Cc1cc(C[NH+]2CCSCC2)ccc1NC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000109975500 853039335 /nfs/dbraw/zinc/03/93/35/853039335.db2.gz TXBZKMVHDFYOGL-HSZRJFAPSA-N 2 0 423.626 4.395 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NC[C@H](c1ccccc1OC)[NH+]1CCCC1)c1ccccc1 ZINC000111075252 853198022 /nfs/dbraw/zinc/19/80/22/853198022.db2.gz KKEHNWTXOMPPQS-VWNXMTODSA-N 2 0 409.574 4.031 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)C(=O)NCc1ccc(F)cc1 ZINC000195538720 853673476 /nfs/dbraw/zinc/67/34/76/853673476.db2.gz JNZOBXDQQMEDBL-VAMGGRTRSA-N 2 0 411.565 4.098 20 0 HIADRP CC(C)(C)OC(=O)NC1CCC([NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC000236783483 853922564 /nfs/dbraw/zinc/92/25/64/853922564.db2.gz VMGJEVSTUCAFMC-UHFFFAOYSA-N 2 0 417.594 4.087 20 0 HIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(OCc3c(C)noc3C)c(OC)c2)CC1 ZINC000236791507 853923469 /nfs/dbraw/zinc/92/34/69/853923469.db2.gz ZFPDFMASAMTTDJ-UHFFFAOYSA-N 2 0 401.551 4.091 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(-c4c(F)cccc4F)o3)cn2)CC1 ZINC000236866115 853930334 /nfs/dbraw/zinc/93/03/34/853930334.db2.gz FRTUSFZYGZXOLK-UHFFFAOYSA-N 2 0 412.484 4.052 20 0 HIADRP CCCOc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1OC ZINC000236949023 853941365 /nfs/dbraw/zinc/94/13/65/853941365.db2.gz SXTVEVFYOVVMBL-PMACEKPBSA-N 2 0 412.574 4.383 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2ccc(-c3ccccc3Br)s2)CC1 ZINC000236977689 853945191 /nfs/dbraw/zinc/94/51/91/853945191.db2.gz QHXGGRAMWJDHFJ-MRXNPFEDSA-N 2 0 422.436 4.293 20 0 HIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2cc(Cl)ccc2OC[C@H]2CCCO2)ccc1F ZINC000237063223 853958791 /nfs/dbraw/zinc/95/87/91/853958791.db2.gz XDQZBYALDSGIRQ-HXUWFJFHSA-N 2 0 406.929 4.388 20 0 HIADRP Cc1nn(-c2ccc(F)cc2F)c(C)c1C[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000237063892 853958941 /nfs/dbraw/zinc/95/89/41/853958941.db2.gz HDRFCFNYRQOUQG-UHFFFAOYSA-N 2 0 402.464 4.258 20 0 HIADRP CN(C)C(=O)c1ccc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)[nH]1 ZINC000237076486 853960986 /nfs/dbraw/zinc/96/09/86/853960986.db2.gz XTYDJKIQKXXGGK-UHFFFAOYSA-N 2 0 416.569 4.269 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+]Cc2sc(Sc3ccccc3)nc2Cl)CC1 ZINC000237173564 853975150 /nfs/dbraw/zinc/97/51/50/853975150.db2.gz VFGMGJNQCIMEDC-UHFFFAOYSA-N 2 0 411.040 4.065 20 0 HIADRP COc1cc(C[NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)c(-c2ccccc2)cc1OC ZINC000237390799 854020550 /nfs/dbraw/zinc/02/05/50/854020550.db2.gz XLEFFBRECDHRLR-UHFFFAOYSA-N 2 0 423.601 4.019 20 0 HIADRP COc1cc2c(c(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)c1)O[C@H](C)C2 ZINC000237396129 854022458 /nfs/dbraw/zinc/02/24/58/854022458.db2.gz GYZSYGVGKMLXSH-HXUWFJFHSA-N 2 0 424.585 4.180 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c2cccs2)CC1 ZINC000302977704 854705752 /nfs/dbraw/zinc/70/57/52/854705752.db2.gz ULOOTUYBJVGXNJ-SFTDATJTSA-N 2 0 414.619 4.123 20 0 HIADRP CC[NH+]1CCN(c2ccc(C(=O)Nc3ccc(C[N@@H+]4CCCC[C@H]4C)cc3)cc2)CC1 ZINC000303605043 855073370 /nfs/dbraw/zinc/07/33/70/855073370.db2.gz XXNRCTQQXVVXPM-OAQYLSRUSA-N 2 0 420.601 4.455 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NCC(C)(C)[N@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000303688210 855133797 /nfs/dbraw/zinc/13/37/97/855133797.db2.gz UMIQLHLKBHXCAZ-QHAWAJNXSA-N 2 0 414.638 4.268 20 0 HIADRP C[C@@H]1C[C@@H](N(C)C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1Cc1ccccc1 ZINC000303725052 855152293 /nfs/dbraw/zinc/15/22/93/855152293.db2.gz BUVBWRNANKAKGO-BWKNWUBXSA-N 2 0 405.586 4.408 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H](C)c1cc2cc(Br)ccc2o1)N1CC[NH+](C)CC1 ZINC000326501732 855410061 /nfs/dbraw/zinc/41/00/61/855410061.db2.gz PPRNVCWZSAANMO-MAUKXSAKSA-N 2 0 408.384 4.118 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H](C)c1cc2cc(Br)ccc2o1)N1CC[NH+](C)CC1 ZINC000326501734 855410434 /nfs/dbraw/zinc/41/04/34/855410434.db2.gz PPRNVCWZSAANMO-YJBOKZPZSA-N 2 0 408.384 4.118 20 0 HIADRP Brc1cc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc2c1OCO2 ZINC000382449736 855433452 /nfs/dbraw/zinc/43/34/52/855433452.db2.gz SWXCSOXJSNZKMA-KRWDZBQOSA-N 2 0 417.347 4.180 20 0 HIADRP COc1cc(C[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)cc(Br)c1O ZINC000388523457 855446679 /nfs/dbraw/zinc/44/66/79/855446679.db2.gz MQCKIUJEFDJREW-NRFANRHFSA-N 2 0 419.363 4.165 20 0 HIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000400511927 855479489 /nfs/dbraw/zinc/47/94/89/855479489.db2.gz JLXRJCWTGVPDHL-TZIWHRDSSA-N 2 0 401.595 4.134 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@H](c2cccs2)[NH+](C)C)cc1 ZINC000410336874 855935595 /nfs/dbraw/zinc/93/55/95/855935595.db2.gz KAKPRMCCHMIDTJ-WIYYLYMNSA-N 2 0 414.619 4.225 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1 ZINC000410344276 855939188 /nfs/dbraw/zinc/93/91/88/855939188.db2.gz JVUUWHWNEXHXBV-GOSISDBHSA-N 2 0 400.611 4.169 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NCCC[NH2+]C2CCCCC2)cc1 ZINC000410345402 855940535 /nfs/dbraw/zinc/94/05/35/855940535.db2.gz QUKNOQKZSPCWPJ-HXUWFJFHSA-N 2 0 400.611 4.173 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NCc2ccc(C[NH+](C)C)cc2)cc1 ZINC000410346985 855941810 /nfs/dbraw/zinc/94/18/10/855941810.db2.gz XTOQISIUWKTBPN-FQEVSTJZSA-N 2 0 408.590 4.122 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000410355033 855946015 /nfs/dbraw/zinc/94/60/15/855946015.db2.gz SDSXFTCMFQGGEB-GOSISDBHSA-N 2 0 400.611 4.169 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)CC1 ZINC000410358580 855948524 /nfs/dbraw/zinc/94/85/24/855948524.db2.gz GSGZIEQQWVOSHV-QFIPXVFZSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NCCCC[NH+]2CCCC[C@@H]2C)C1 ZINC000410360663 855949658 /nfs/dbraw/zinc/94/96/58/855949658.db2.gz SCYKTYXNNBNJLQ-YADHBBJMSA-N 2 0 414.638 4.372 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@H](c2cccs2)[NH+](C)C)C1 ZINC000410364277 855952774 /nfs/dbraw/zinc/95/27/74/855952774.db2.gz LMQVXZOZNRNIJV-WIYYLYMNSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NCCC[N@H+]1CCCC[C@@H]1C ZINC000410364468 855952845 /nfs/dbraw/zinc/95/28/45/855952845.db2.gz ILFDLRRDUVLGKP-LEWJYISDSA-N 2 0 400.611 4.125 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NCCC[NH2+]C1CCCCC1 ZINC000410393814 855970991 /nfs/dbraw/zinc/97/09/91/855970991.db2.gz RJTJEGRCDXIIBD-FQEVSTJZSA-N 2 0 400.611 4.173 20 0 HIADRP Cc1ccc2cc([C@@H](C)[NH2+]Cc3cccc(C[N@@H+]4CCC[C@@H](C(N)=O)C4)c3)oc2c1 ZINC000426029712 856057229 /nfs/dbraw/zinc/05/72/29/856057229.db2.gz LKOPHAZPHHNUEC-XMSQKQJNSA-N 2 0 405.542 4.289 20 0 HIADRP O=C(Nc1ccc(OCC[NH+]2CCCCC2)cc1)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000426128223 856125947 /nfs/dbraw/zinc/12/59/47/856125947.db2.gz MLHFJZYGFFYDOI-UHFFFAOYSA-N 2 0 414.594 4.034 20 0 HIADRP COc1ccc(CC[C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1O ZINC000426394885 856273508 /nfs/dbraw/zinc/27/35/08/856273508.db2.gz KRUKCFZIMZYGDW-AQNXPRMDSA-N 2 0 412.574 4.121 20 0 HIADRP C[C@@H]1CCN(C(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000426706781 856423524 /nfs/dbraw/zinc/42/35/24/856423524.db2.gz XANINEJHFMEBIS-JOCHJYFZSA-N 2 0 405.586 4.409 20 0 HIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000427489488 856839616 /nfs/dbraw/zinc/83/96/16/856839616.db2.gz BNHSBHSCRADAHJ-UHFFFAOYSA-N 2 0 409.599 4.392 20 0 HIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)c1ccc(N2CC[NH+](C(C)C)CC2)cc1 ZINC000427568743 856870651 /nfs/dbraw/zinc/87/06/51/856870651.db2.gz JHMASUODHXHIMB-UHFFFAOYSA-N 2 0 420.601 4.374 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCCc3ncc(C(F)(F)F)cc32)CC1 ZINC000427697245 856912657 /nfs/dbraw/zinc/91/26/57/856912657.db2.gz TWXNAKJGBSHJHB-NRFANRHFSA-N 2 0 419.491 4.224 20 0 HIADRP C[C@H]1C[C@H](NC(=O)NCc2ccccc2C[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000428110201 857075243 /nfs/dbraw/zinc/07/52/43/857075243.db2.gz GAEJNLZKCGHPFH-SQJMNOBHSA-N 2 0 420.601 4.135 20 0 HIADRP O=C(c1ccco1)N1CCC([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000428239073 857123135 /nfs/dbraw/zinc/12/31/35/857123135.db2.gz MWFSIDBIZPZRHZ-QPTUXGOLSA-N 2 0 421.585 4.165 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000428277475 857137282 /nfs/dbraw/zinc/13/72/82/857137282.db2.gz RBWGZAXTEYJSJE-IEZKXTBUSA-N 2 0 420.601 4.176 20 0 HIADRP CC1CCN(Cc2csc(NC(=O)C[NH2+][C@@H](c3cccs3)C3CC3)n2)CC1 ZINC000428291926 857143574 /nfs/dbraw/zinc/14/35/74/857143574.db2.gz VRKXMYGDOIBQDW-LJQANCHMSA-N 2 0 404.605 4.116 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000428312801 857148875 /nfs/dbraw/zinc/14/88/75/857148875.db2.gz XCSSMNGKMWOKEF-OFVILXPXSA-N 2 0 422.617 4.381 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000428653482 857290894 /nfs/dbraw/zinc/29/08/94/857290894.db2.gz WTZCTBXFYULHFV-KHUIQGCPSA-N 2 0 414.638 4.097 20 0 HIADRP c1cc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)ccc1C[NH+]1CCOC[C@@H](C2CCC2)C1 ZINC000429030746 857465629 /nfs/dbraw/zinc/46/56/29/857465629.db2.gz SOEYEAZYQQHYLT-UIOOFZCWSA-N 2 0 412.618 4.184 20 0 HIADRP Cc1noc(C[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)c2ccccc2)n1 ZINC000429461034 857682651 /nfs/dbraw/zinc/68/26/51/857682651.db2.gz GKWGWRRCADOMRD-QPXUXIHVSA-N 2 0 402.542 4.162 20 0 HIADRP Cc1noc(C[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)c2ccccc2)n1 ZINC000429461036 857682872 /nfs/dbraw/zinc/68/28/72/857682872.db2.gz GKWGWRRCADOMRD-YCAMKHIRSA-N 2 0 402.542 4.162 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cc(Cl)ccc1OCC1CC1 ZINC000430011211 857996573 /nfs/dbraw/zinc/99/65/73/857996573.db2.gz GLHPSCJZZSAOFR-QHCPKHFHSA-N 2 0 414.977 4.375 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)c2ccc(C[NH+]3CCSCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000430628161 858240850 /nfs/dbraw/zinc/24/08/50/858240850.db2.gz OGVDYDPGDPQQFZ-RDPSFJRHSA-N 2 0 423.626 4.018 20 0 HIADRP C[C@H]1C[C@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000431696608 858744776 /nfs/dbraw/zinc/74/47/76/858744776.db2.gz MAQAITJTIZKGSM-SQJMNOBHSA-N 2 0 420.601 4.135 20 0 HIADRP O[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CC(c3cccc(Br)c3)C2)CC1 ZINC000432411607 859151756 /nfs/dbraw/zinc/15/17/56/859151756.db2.gz ZNKURPJFMLUFSI-OLBNFPALSA-N 2 0 407.396 4.053 20 0 HIADRP COc1ccc(-c2nnc(C[N@@H+]3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)o2)cc1 ZINC000433059678 859504434 /nfs/dbraw/zinc/50/44/34/859504434.db2.gz UTIWBRIKNQOUIL-UHFFFAOYSA-N 2 0 418.541 4.233 20 0 HIADRP Cc1c(F)cccc1NC(=O)CC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433127778 859532024 /nfs/dbraw/zinc/53/20/24/859532024.db2.gz ULEVUISSYLKZBY-UHFFFAOYSA-N 2 0 409.549 4.451 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2ccc(Br)c(C)c2)CC1 ZINC000467778045 881600304 /nfs/dbraw/zinc/60/03/04/881600304.db2.gz OLQPOCIYFJUBFW-UHFFFAOYSA-N 2 0 416.407 4.185 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CN(CC[NH+](C)C)C(=O)Nc1cccc(-c2cccs2)c1 ZINC000438182126 863606190 /nfs/dbraw/zinc/60/61/90/863606190.db2.gz SRLIVARAAXEDBM-FQEVSTJZSA-N 2 0 400.592 4.295 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)NC[C@@H]2CCC[N@@H+]2C2CCCCC2)CC1 ZINC000438345277 863814821 /nfs/dbraw/zinc/81/48/21/863814821.db2.gz LWFYLHULPWZBME-DEOSSOPVSA-N 2 0 412.622 4.090 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cccc(NC(=O)[C@H]3CCCO3)c2)CC1 ZINC000438832498 864325531 /nfs/dbraw/zinc/32/55/31/864325531.db2.gz MNUFKTAJGZATFK-PUOLSWATSA-N 2 0 421.585 4.337 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccccc2CN2CCOCC2)CC1 ZINC000438839737 864333582 /nfs/dbraw/zinc/33/35/82/864333582.db2.gz IGLZYMXEAZGDSM-UHFFFAOYSA-N 2 0 407.602 4.052 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H](c2ccc(Br)s2)C2CC2)C[C@H](C)O1 ZINC000439139675 864572697 /nfs/dbraw/zinc/57/26/97/864572697.db2.gz YOEWFJPVUNXZLC-IYOUNJFTSA-N 2 0 401.414 4.441 20 0 HIADRP c1ccc(C[NH+]2CCC([C@@H]3CCCO3)CC2)c(C[NH+]2CCC([C@H]3CCCO3)CC2)c1 ZINC000439273982 864692186 /nfs/dbraw/zinc/69/21/86/864692186.db2.gz NMLRNMFSRPYRSX-WMPKNSHKSA-N 2 0 412.618 4.469 20 0 HIADRP Cc1ccc(NC(=O)[C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)cc1F ZINC000439592799 864916342 /nfs/dbraw/zinc/91/63/42/864916342.db2.gz HVKHEVJIPCZBEC-GOSISDBHSA-N 2 0 409.505 4.476 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCCN(c2ccccc2)C1=O ZINC000439600570 864922915 /nfs/dbraw/zinc/92/29/15/864922915.db2.gz WAGDDHQQVHJAHV-DEOSSOPVSA-N 2 0 403.526 4.197 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N(C)Cc1cccc(F)c1 ZINC000439599697 864923559 /nfs/dbraw/zinc/92/35/59/864923559.db2.gz WUSVBOMVLVUQAC-LJQANCHMSA-N 2 0 423.532 4.187 20 0 HIADRP COc1ccc(NC(=O)[C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)cc1 ZINC000439610866 864933138 /nfs/dbraw/zinc/93/31/38/864933138.db2.gz MSGTVOQNRHRTIV-GOSISDBHSA-N 2 0 407.514 4.037 20 0 HIADRP CC[NH+]1CCN(c2ccc(C(=O)Nc3ccc(CC[NH+]4CCCCC4)cc3)cc2)CC1 ZINC000467967259 881826160 /nfs/dbraw/zinc/82/61/60/881826160.db2.gz DLCJDWPQFNHNFV-UHFFFAOYSA-N 2 0 420.601 4.109 20 0 HIADRP CC(C)C[C@H](CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)[NH2+][C@H](C)c1ccccc1 ZINC000468023423 881858148 /nfs/dbraw/zinc/85/81/48/881858148.db2.gz AYZQBBGSFORPGM-UOFCYQDVSA-N 2 0 400.611 4.066 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCC(CC[NH+](C)C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000468026781 881860854 /nfs/dbraw/zinc/86/08/54/881860854.db2.gz ARVLNTNWKHLXKF-NZQKXSOJSA-N 2 0 402.627 4.125 20 0 HIADRP Cc1ccc(N[C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)cc1NC(=O)CC[NH+](C)C ZINC000468033852 881865752 /nfs/dbraw/zinc/86/57/52/881865752.db2.gz OYGITCMXHIYTLW-GMKZXUHWSA-N 2 0 420.601 4.208 20 0 HIADRP Cc1ccccc1[C@H](OC[C@@H](O)C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1)c1ccccc1 ZINC000441455370 866532179 /nfs/dbraw/zinc/53/21/79/866532179.db2.gz YPBGUXFOZDBQLG-SCTDOJESSA-N 2 0 422.613 4.270 20 0 HIADRP CC[NH+](CC)CCOc1ccc(-c2noc([C@@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)cc1OC ZINC000443201171 867873443 /nfs/dbraw/zinc/87/34/43/867873443.db2.gz HQPNVTDTVXQHHM-FGTMMUONSA-N 2 0 416.566 4.400 20 0 HIADRP C[C@@H](C(=O)N1CCC[C@H]1c1cccs1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443602540 868162518 /nfs/dbraw/zinc/16/25/18/868162518.db2.gz PNZURUTWGMXPQS-FPOVZHCZSA-N 2 0 403.636 4.388 20 0 HIADRP C[N@H+](C[C@@H](O)Cc1ccccc1C(F)(F)F)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000443609409 868171649 /nfs/dbraw/zinc/17/16/49/868171649.db2.gz MCYQQLIRWHRCAX-FPOVZHCZSA-N 2 0 406.492 4.063 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000446562734 870473664 /nfs/dbraw/zinc/47/36/64/870473664.db2.gz CYPMXMCRQXNHFX-ZCYQVOJMSA-N 2 0 420.601 4.309 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)Nc3ccccc3CC[NH+](C)C)cc2)C1 ZINC000446565641 870476778 /nfs/dbraw/zinc/47/67/78/870476778.db2.gz PVKHNHNFXDWHMQ-FQEVSTJZSA-N 2 0 408.590 4.344 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000446575795 870486453 /nfs/dbraw/zinc/48/64/53/870486453.db2.gz LNZKMQPGYPNAQI-WIYYLYMNSA-N 2 0 400.592 4.057 20 0 HIADRP C[C@H]1C[C@H](CCNC(=O)Nc2ccccc2CC[NH+](C)C)C[N@@H+]1Cc1ccccc1 ZINC000446576669 870487776 /nfs/dbraw/zinc/48/77/76/870487776.db2.gz HNGGQRXWDUQICR-UNMCSNQZSA-N 2 0 408.590 4.213 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)N1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000446589710 870497741 /nfs/dbraw/zinc/49/77/41/870497741.db2.gz BJNPRZBPVXQBJF-SANMLTNESA-N 2 0 420.601 4.311 20 0 HIADRP CN(c1ccccc1C[NH+]1CCC(CO)(Cc2ccccc2)CC1)C1CC[NH+](C)CC1 ZINC000446846277 870764849 /nfs/dbraw/zinc/76/48/49/870764849.db2.gz XKBDMBFFIHHHER-UHFFFAOYSA-N 2 0 421.629 4.034 20 0 HIADRP C[NH+](C)Cc1ccsc1C(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000447429929 871335405 /nfs/dbraw/zinc/33/54/05/871335405.db2.gz CENVAUUXRGWKTO-UHFFFAOYSA-N 2 0 405.995 4.105 20 0 HIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c2ccccc21 ZINC000447531211 871395968 /nfs/dbraw/zinc/39/59/68/871395968.db2.gz QGMSLAAXSOBIMJ-IEZKXTBUSA-N 2 0 405.586 4.358 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000447604503 871513442 /nfs/dbraw/zinc/51/34/42/871513442.db2.gz AYSRBMRNMPGMFP-CLJLJLNGSA-N 2 0 404.529 4.466 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000448208917 872105834 /nfs/dbraw/zinc/10/58/34/872105834.db2.gz MDRQRTONBNXOMH-NOZRDPDXSA-N 2 0 424.633 4.221 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)[C@H](C)C1 ZINC000448462623 872426686 /nfs/dbraw/zinc/42/66/86/872426686.db2.gz VPJOABIXFURGEH-CTVDGRRTSA-N 2 0 414.638 4.036 20 0 HIADRP C[NH+](C)CCCC1CCN(C(=O)NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000462748040 875815667 /nfs/dbraw/zinc/81/56/67/875815667.db2.gz ZVICVFSZKBVESW-DEOSSOPVSA-N 2 0 414.638 4.052 20 0 HIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000462800306 875848479 /nfs/dbraw/zinc/84/84/79/875848479.db2.gz DMVYRTOFKWPYBF-LJQANCHMSA-N 2 0 420.601 4.305 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+]CCCN2CCCCC2=O)c2ccc(F)cc2)CC1 ZINC000462815036 875857706 /nfs/dbraw/zinc/85/77/06/875857706.db2.gz BIKRFCUMNBHRKN-QHCPKHFHSA-N 2 0 403.586 4.371 20 0 HIADRP Clc1ccc([C@@H](CC2CC2)[NH2+]CCCC[NH+]2CCN(c3ncccn3)CC2)cc1 ZINC000468935394 883001597 /nfs/dbraw/zinc/00/15/97/883001597.db2.gz LJTWGZKRSXJPPI-JOCHJYFZSA-N 2 0 413.997 4.163 20 0 HIADRP FC(F)(F)CN1CCC(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000463240955 876296460 /nfs/dbraw/zinc/29/64/60/876296460.db2.gz XYYZJELWWVWKBH-FRIKZZABSA-N 2 0 409.540 4.436 20 0 HIADRP Cc1ccc([C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)N2CCOCC2)cc1 ZINC000463283799 876341273 /nfs/dbraw/zinc/34/12/73/876341273.db2.gz QGZZIEYXKPEJBX-UYCQPUOKSA-N 2 0 419.613 4.154 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]C2CCC(C(F)(F)F)CC2)c1)C1CCOCC1 ZINC000464089549 877243879 /nfs/dbraw/zinc/24/38/79/877243879.db2.gz CDXDLTPRDNIBAN-UHFFFAOYSA-N 2 0 414.512 4.387 20 0 HIADRP CCc1ccc([C@H](CNC(=O)N(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)[NH+](C)C)cc1 ZINC000465427307 878857757 /nfs/dbraw/zinc/85/77/57/878857757.db2.gz DXJDCVQTQUTCQJ-ZCYQVOJMSA-N 2 0 422.617 4.015 20 0 HIADRP C[C@H]1C[C@H](NC(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1C ZINC000465567801 879040319 /nfs/dbraw/zinc/04/03/19/879040319.db2.gz IWKDUFIINCFCAH-GBXCKJPGSA-N 2 0 420.601 4.231 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)NC[C@@H]2CCC[NH+](C)[C@@H]2c2cccs2)C1 ZINC000465594698 879080154 /nfs/dbraw/zinc/08/01/54/879080154.db2.gz IMXPGVPLGLVEBV-IIZPIQPGSA-N 2 0 420.667 4.188 20 0 HIADRP CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)NCc1ccccc1C[NH+](C)C1CCCCC1 ZINC000465718612 879291889 /nfs/dbraw/zinc/29/18/89/879291889.db2.gz MWLBVIGAFPYONG-DEOSSOPVSA-N 2 0 414.638 4.467 20 0 HIADRP CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)NCc1ccccc1C[NH+](C)C1CCCCC1 ZINC000465718613 879292667 /nfs/dbraw/zinc/29/26/67/879292667.db2.gz MWLBVIGAFPYONG-XMMPIXPASA-N 2 0 414.638 4.467 20 0 HIADRP CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000465772431 879373617 /nfs/dbraw/zinc/37/36/17/879373617.db2.gz CEDVZOSMUZWPJY-HSZRJFAPSA-N 2 0 400.611 4.078 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccco1 ZINC000465804652 879417484 /nfs/dbraw/zinc/41/74/84/879417484.db2.gz DXXLDEJYCGHXJW-OPYAIIAOSA-N 2 0 418.607 4.106 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccco1 ZINC000465804653 879417625 /nfs/dbraw/zinc/41/76/25/879417625.db2.gz DXXLDEJYCGHXJW-UEXGIBASSA-N 2 0 418.607 4.106 20 0 HIADRP CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)NCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000465805739 879421220 /nfs/dbraw/zinc/42/12/20/879421220.db2.gz FNSRXJHPLMWLBJ-QHCPKHFHSA-N 2 0 400.611 4.078 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](c1ccc(C)cc1)[NH+](C)C ZINC000465817088 879440536 /nfs/dbraw/zinc/44/05/36/879440536.db2.gz ORPHINXACFAAPT-ZCYQVOJMSA-N 2 0 422.617 4.151 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000503447753 912468071 /nfs/dbraw/zinc/46/80/71/912468071.db2.gz SELLFSRYVGIYRI-XMMPIXPASA-N 2 0 414.638 4.326 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)c1ccsc1 ZINC000503446329 912469334 /nfs/dbraw/zinc/46/93/34/912469334.db2.gz KONPSKBPWLTRCG-UNMCSNQZSA-N 2 0 420.667 4.285 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccsc1 ZINC000503448413 912470862 /nfs/dbraw/zinc/47/08/62/912470862.db2.gz XKQWAWXADBODJB-IRLDBZIGSA-N 2 0 420.667 4.429 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)NCCCCC[NH+]2CCCCC2)[C@H]1c1cccs1 ZINC000465951133 879618719 /nfs/dbraw/zinc/61/87/19/879618719.db2.gz NGNNKYTZFNXESU-FPOVZHCZSA-N 2 0 406.640 4.086 20 0 HIADRP O=C(C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)N(C1CCCCC1)C1CCCCC1 ZINC000466909439 880676563 /nfs/dbraw/zinc/67/65/63/880676563.db2.gz KBCXUFQANOUMIG-UHFFFAOYSA-N 2 0 419.654 4.057 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H]2CCC[C@H]([C@H]3CCOC3)C2)CC1 ZINC000467349617 881104144 /nfs/dbraw/zinc/10/41/44/881104144.db2.gz XXHUEHSTGBLXLP-BPBCIEFSSA-N 2 0 403.586 4.214 20 0 HIADRP Brc1cccc([C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)C2CCOCC2)c1 ZINC000467426274 881214553 /nfs/dbraw/zinc/21/45/53/881214553.db2.gz AKXROZYTFNHKIE-OAQYLSRUSA-N 2 0 407.396 4.381 20 0 HIADRP CC[C@H]1C[C@@H](C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)CCO1 ZINC000503597986 912686323 /nfs/dbraw/zinc/68/63/23/912686323.db2.gz NUJOOYXEEUMSSA-NVQXNPDNSA-N 2 0 407.602 4.304 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c1 ZINC000469221329 883321860 /nfs/dbraw/zinc/32/18/60/883321860.db2.gz JBXLZEZZTCMLCT-QHCPKHFHSA-N 2 0 415.528 4.087 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CCN(C(=O)[C@@H]2CCCC[NH+]2Cc2ccccc2)CC1 ZINC000469367051 883490124 /nfs/dbraw/zinc/49/01/24/883490124.db2.gz IIKJRHOYEIUBDR-SANMLTNESA-N 2 0 419.613 4.412 20 0 HIADRP CC(C)[C@@H](C[N@H+](C)Cc1ccccc1)NCc1nc2c(s1)C[NH+](C(C)C)CC2 ZINC000469563688 883815773 /nfs/dbraw/zinc/81/57/73/883815773.db2.gz LWZDMLCZGKSKJW-OAQYLSRUSA-N 2 0 400.636 4.156 20 0 HIADRP FC(F)(F)C(F)(F)COCC[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000469728296 883888481 /nfs/dbraw/zinc/88/84/81/883888481.db2.gz IZODAZAOXWTMMO-UHFFFAOYSA-N 2 0 406.439 4.189 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)[C@H]1c1cccs1 ZINC000469732960 883891961 /nfs/dbraw/zinc/89/19/61/883891961.db2.gz FXKWKFZFKWWGRA-AVRDEDQJSA-N 2 0 406.555 4.122 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CCCc1nc(-c2cccs2)no1 ZINC000469764466 883934256 /nfs/dbraw/zinc/93/42/56/883934256.db2.gz PGTUKIDNRJOOLO-QZTJIDSGSA-N 2 0 410.587 4.477 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H](NCc2ccc(Br)c(Cl)c2)[C@@H](C)C1 ZINC000469765940 883936469 /nfs/dbraw/zinc/93/64/69/883936469.db2.gz CUNQDNOCAPPVSN-KBXCAEBGSA-N 2 0 403.792 4.329 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2c(-c3ccccc3)nc3ccccn32)[C@H](C)C1 ZINC000469770689 883944914 /nfs/dbraw/zinc/94/49/14/883944914.db2.gz VWJXGCRBTYIDIA-IRLDBZIGSA-N 2 0 406.574 4.228 20 0 HIADRP CCS[C@@H]1CCCC[C@H]1[NH2+]CC1(C[NH2+][C@H]2CCCC[C@H]2SCC)COC1 ZINC000469775991 883950420 /nfs/dbraw/zinc/95/04/20/883950420.db2.gz PCVJNZYUPCOGEF-IYWMVGAKSA-N 2 0 400.698 4.311 20 0 HIADRP O[C@@H](C(F)F)[C@@H](Cc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000470253988 884590300 /nfs/dbraw/zinc/59/03/00/884590300.db2.gz GOKQWKWHABRRDQ-KLARFABHSA-N 2 0 400.513 4.009 20 0 HIADRP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CCCC[NH+]1Cc1ccccc1 ZINC000470543715 884949218 /nfs/dbraw/zinc/94/92/18/884949218.db2.gz OCXQAJGHDIPCCN-RPBOFIJWSA-N 2 0 405.586 4.022 20 0 HIADRP CN(C(=O)C1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470659702 885085219 /nfs/dbraw/zinc/08/52/19/885085219.db2.gz OUJJEMJYBHJRAQ-RUZDIDTESA-N 2 0 405.586 4.022 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N(C)[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000470737993 885196194 /nfs/dbraw/zinc/19/61/94/885196194.db2.gz RRPHPRRRRJGSEV-RUZDIDTESA-N 2 0 422.617 4.333 20 0 HIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CCC(=O)Nc2ccccc2Oc2ccccc2)C1 ZINC000470961932 885461596 /nfs/dbraw/zinc/46/15/96/885461596.db2.gz UAXCDHYAFXVCIM-NRFANRHFSA-N 2 0 407.558 4.471 20 0 HIADRP CC[NH+]1CCC(NC(=O)C[N@@H+]2CCCCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000471002504 885502372 /nfs/dbraw/zinc/50/23/72/885502372.db2.gz ZYROYZSNUUUZTD-FQEVSTJZSA-N 2 0 411.512 4.223 20 0 HIADRP CCN(C(=O)NC[C@H](c1cccs1)[NH+](C)C)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000471374866 886015574 /nfs/dbraw/zinc/01/55/74/886015574.db2.gz UDZDNRFNOMXPFA-HLAWJBBLSA-N 2 0 414.619 4.218 20 0 HIADRP COc1ccsc1[C@@H](C)[NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000472161802 886961106 /nfs/dbraw/zinc/96/11/06/886961106.db2.gz TWKSFJVJAFBQQI-CQSZACIVSA-N 2 0 413.509 4.378 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N(C)[C@H]2CC[NH+](CC)[C@@H](C)C2)c1 ZINC000473745400 888528226 /nfs/dbraw/zinc/52/82/26/888528226.db2.gz DTZSMUYUEYSRDW-REWPJTCUSA-N 2 0 402.627 4.323 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N(C)[C@H]2CC[NH+](CC)[C@H](C)C2)c1 ZINC000473745399 888529242 /nfs/dbraw/zinc/52/92/42/888529242.db2.gz DTZSMUYUEYSRDW-OFNKIYASSA-N 2 0 402.627 4.323 20 0 HIADRP CCN(C(=O)NC[C@H](c1ccsc1)[NH+](C)C)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473886942 888756252 /nfs/dbraw/zinc/75/62/52/888756252.db2.gz RACGCJVCGFLBCF-BVYCBKJFSA-N 2 0 414.619 4.218 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NC2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)c1 ZINC000474005139 888864163 /nfs/dbraw/zinc/86/41/63/888864163.db2.gz CDXMIVJRUDPNOX-NHCUHLMSSA-N 2 0 422.617 4.094 20 0 HIADRP CCC(CC)(CNC(=O)NC1CC([NH+]2CCCCC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000474368303 889245546 /nfs/dbraw/zinc/24/55/46/889245546.db2.gz RXSDXBQRGOGKRV-JSRJAPPDSA-N 2 0 400.611 4.212 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)cc2-n2cncn2)C1 ZINC000474471771 889335804 /nfs/dbraw/zinc/33/58/04/889335804.db2.gz NUMRWQIYJPCNIF-GOSISDBHSA-N 2 0 409.965 4.442 20 0 HIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc(Cl)cc3-n3cncn3)cc2)CC1 ZINC000474483147 889343761 /nfs/dbraw/zinc/34/37/61/889343761.db2.gz SOLHIQAUPXRUTP-UHFFFAOYSA-N 2 0 409.965 4.442 20 0 HIADRP C[C@H](CCc1ccc(I)cc1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000474621596 889486246 /nfs/dbraw/zinc/48/62/46/889486246.db2.gz XMOLIPXTYYOIOU-OAHLLOKOSA-N 2 0 412.359 4.076 20 0 HIADRP FC(F)(F)c1cc(Br)ccc1CNC1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000474793350 889648701 /nfs/dbraw/zinc/64/87/01/889648701.db2.gz DJPTYVGGXQDFEQ-CYBMUJFWSA-N 2 0 421.301 4.058 20 0 HIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc(Cl)cc2-n2cncn2)CC1 ZINC000474880488 889735367 /nfs/dbraw/zinc/73/53/67/889735367.db2.gz TUMDROTYZILUAF-UHFFFAOYSA-N 2 0 409.965 4.442 20 0 HIADRP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000475994428 890917475 /nfs/dbraw/zinc/91/74/75/890917475.db2.gz BFBALIWKOKQCDH-OAQYLSRUSA-N 2 0 404.643 4.081 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)c1ccco1 ZINC000476847439 891820129 /nfs/dbraw/zinc/82/01/29/891820129.db2.gz RLZYIMOTNCGFER-UGKGYDQZSA-N 2 0 412.578 4.194 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1cccc(NS(C)(=O)=O)c1 ZINC000477936027 893024288 /nfs/dbraw/zinc/02/42/88/893024288.db2.gz KCRJTTSWPJJVNF-LJQANCHMSA-N 2 0 415.603 4.141 20 0 HIADRP C[C@@H]1[C@H]([NH+]2CCCC2)CCN1C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000478222284 893383204 /nfs/dbraw/zinc/38/32/04/893383204.db2.gz DAKVSZCXCZCDEW-CJFMBICVSA-N 2 0 420.601 4.183 20 0 HIADRP CC[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479055461 894313406 /nfs/dbraw/zinc/31/34/06/894313406.db2.gz FUEFMAYTOAVOFV-SUMWQHHRSA-N 2 0 422.333 4.145 20 0 HIADRP c1c2c(nn1-c1ccccc1)CCC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000479064564 894326076 /nfs/dbraw/zinc/32/60/76/894326076.db2.gz RXWNXOJDLJVUQX-DHLKQENFSA-N 2 0 400.570 4.404 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCc4cc(OC)c(OC)cc43)CC2)cc1 ZINC000479075755 894340084 /nfs/dbraw/zinc/34/00/84/894340084.db2.gz YGHIUKHISZDSQY-HSZRJFAPSA-N 2 0 410.558 4.202 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+][C@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479291562 894572972 /nfs/dbraw/zinc/57/29/72/894572972.db2.gz ZJTMDUUVTRJJEN-JOCHJYFZSA-N 2 0 416.407 4.154 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H](c2ccc(Br)cc2F)C2CC2)ccn1 ZINC000479417567 894727485 /nfs/dbraw/zinc/72/74/85/894727485.db2.gz XEGUTTATNNXWBH-HXUWFJFHSA-N 2 0 422.342 4.165 20 0 HIADRP C[C@H]([NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000479474884 894798219 /nfs/dbraw/zinc/79/82/19/894798219.db2.gz FJHJAZFAGUEGBJ-DZIBYMRMSA-N 2 0 413.528 4.083 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3CCN(Cc4ccccn4)C[C@H]3C)cc2)C1 ZINC000480603853 895967984 /nfs/dbraw/zinc/96/79/84/895967984.db2.gz CLBIAALPNGHHAI-DRLORSAXSA-N 2 0 406.618 4.314 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000480603658 895968290 /nfs/dbraw/zinc/96/82/90/895968290.db2.gz DZOIPCBWRLOZBZ-QFBILLFUSA-N 2 0 419.038 4.457 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCC[C@@H]2C)[C@@H](C)C1 ZINC000480610280 895975192 /nfs/dbraw/zinc/97/51/92/895975192.db2.gz NFBRKRMSFWFUFR-HWBMXIPRSA-N 3 0 401.639 4.288 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC[C@H](C)C2)[C@H](C)C1 ZINC000480617748 895983899 /nfs/dbraw/zinc/98/38/99/895983899.db2.gz VTMFXFBRQQDEIG-FBLLAGFSSA-N 3 0 401.639 4.145 20 0 HIADRP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000480623054 895991212 /nfs/dbraw/zinc/99/12/12/895991212.db2.gz HMHURLIZDAEPTL-VQTJNVASSA-N 2 0 409.640 4.022 20 0 HIADRP CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000480623051 895991386 /nfs/dbraw/zinc/99/13/86/895991386.db2.gz HMHURLIZDAEPTL-UXHICEINSA-N 2 0 409.640 4.022 20 0 HIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480630933 896000527 /nfs/dbraw/zinc/00/05/27/896000527.db2.gz LVPVLPSVFRWCIA-NHCUHLMSSA-N 2 0 421.651 4.024 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480645628 896014309 /nfs/dbraw/zinc/01/43/09/896014309.db2.gz SAUATXWGTFSBAT-RTBURBONSA-N 2 0 415.603 4.283 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)[C@H](c1ccccc1)N1CCOCC1 ZINC000480671146 896034318 /nfs/dbraw/zinc/03/43/18/896034318.db2.gz BBZPTHDAFZXVFA-HYBUGGRVSA-N 2 0 413.631 4.012 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc2cc(OC)ccc2c1 ZINC000480719759 896079189 /nfs/dbraw/zinc/07/91/89/896079189.db2.gz HQUAKWBJBXIKFQ-XMMPIXPASA-N 2 0 404.558 4.236 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]C2CCN(Cc3ccccn3)CC2)C1 ZINC000480718379 896079538 /nfs/dbraw/zinc/07/95/38/896079538.db2.gz OBSRZIUBOHISLZ-FGZHOGPDSA-N 2 0 406.618 4.314 20 0 HIADRP C[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1cccc(OCc2ccccc2)c1 ZINC000480723472 896085018 /nfs/dbraw/zinc/08/50/18/896085018.db2.gz ZHCWCSSTQCBZSE-NRFANRHFSA-N 2 0 416.569 4.263 20 0 HIADRP CCC[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1cccc(C(F)(F)F)c1 ZINC000480735817 896097424 /nfs/dbraw/zinc/09/74/24/896097424.db2.gz ADZLLMHLPAYFDV-FQEVSTJZSA-N 2 0 406.496 4.483 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccccc2OC(F)F)CC1 ZINC000480740322 896100470 /nfs/dbraw/zinc/10/04/70/896100470.db2.gz LALQQIZOTWEITD-SFHVURJKSA-N 2 0 403.517 4.276 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3cc(OC)c(OC)cc3C)cc2)CC1 ZINC000480739164 896100759 /nfs/dbraw/zinc/10/07/59/896100759.db2.gz MAFCETYLDOYXPR-HXUWFJFHSA-N 2 0 411.590 4.001 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccc(Br)s2)CC1 ZINC000480740429 896102465 /nfs/dbraw/zinc/10/24/65/896102465.db2.gz PLACCWWYZPBCPD-MRXNPFEDSA-N 2 0 422.436 4.499 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1)c1cncc(F)c1 ZINC000480752095 896116114 /nfs/dbraw/zinc/11/61/14/896116114.db2.gz XFITWXDEVZBWFP-FQEVSTJZSA-N 2 0 404.533 4.394 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1 ZINC000480779406 896144541 /nfs/dbraw/zinc/14/45/41/896144541.db2.gz KIKJQWFNZYNKSS-GOSISDBHSA-N 2 0 403.592 4.139 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(OC(F)(F)F)cc1 ZINC000480884184 896239986 /nfs/dbraw/zinc/23/99/86/896239986.db2.gz SBZIDDDNLAOAMF-QGZVFWFLSA-N 2 0 407.480 4.183 20 0 HIADRP CC[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc2cc(OC)ccc2c1 ZINC000481224697 896576089 /nfs/dbraw/zinc/57/60/89/896576089.db2.gz WLFODJVMWBAZTF-DEOSSOPVSA-N 2 0 404.558 4.236 20 0 HIADRP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)C(c1ccccc1)c1ccccc1 ZINC000481242053 896592053 /nfs/dbraw/zinc/59/20/53/896592053.db2.gz MYDKGTSNJAKPAL-OAQYLSRUSA-N 2 0 400.570 4.144 20 0 HIADRP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)C(c1ccccc1)c1ccccc1 ZINC000481242052 896592545 /nfs/dbraw/zinc/59/25/45/896592545.db2.gz MYDKGTSNJAKPAL-NRFANRHFSA-N 2 0 400.570 4.144 20 0 HIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000481301397 896645200 /nfs/dbraw/zinc/64/52/00/896645200.db2.gz YYTJNXBHPWJFFZ-KBMIEXCESA-N 2 0 413.556 4.429 20 0 HIADRP COc1ccc(Cc2nc(C)c([C@H](C)NC[C@H](C)C[NH+]3CCCC3)s2)cc1OC ZINC000481344326 896711234 /nfs/dbraw/zinc/71/12/34/896711234.db2.gz WTLKEVQHSWQVDL-IRXDYDNUSA-N 2 0 417.619 4.442 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1cccc(NS(C)(=O)=O)c1 ZINC000481721927 897116090 /nfs/dbraw/zinc/11/60/90/897116090.db2.gz YILMAFMYVDFYDF-LJQANCHMSA-N 2 0 415.603 4.285 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCCOc2cc(Br)ccc21 ZINC000481746791 897140903 /nfs/dbraw/zinc/14/09/03/897140903.db2.gz QUHPRHMYWRIQOO-IBGZPJMESA-N 2 0 419.363 4.393 20 0 HIADRP CN(CC1CC[NH+](C)CC1)C(=O)NCCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000481788523 897168967 /nfs/dbraw/zinc/16/89/67/897168967.db2.gz NSVZKXIMJCEQIB-UHFFFAOYSA-N 2 0 422.617 4.062 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H]1CCC(C)(C)c2ccc(Br)cc21 ZINC000482000115 897397851 /nfs/dbraw/zinc/39/78/51/897397851.db2.gz RGHRCIDXNJNGIK-OXJNMPFZSA-N 2 0 408.428 4.177 20 0 HIADRP COc1ccc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1Br ZINC000482032346 897443025 /nfs/dbraw/zinc/44/30/25/897443025.db2.gz KXGHZKBDSUJPPE-OAHLLOKOSA-N 2 0 407.352 4.249 20 0 HIADRP C[C@@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1nc(-c2ccccc2)cs1 ZINC000482131473 897589281 /nfs/dbraw/zinc/58/92/81/897589281.db2.gz WTTBDQRCDLUQKR-LJQANCHMSA-N 2 0 407.587 4.068 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CCC[C@@]2(C1)OCc1ccccc12)C1CC[NH+](C)CC1 ZINC000482424751 897977777 /nfs/dbraw/zinc/97/77/77/897977777.db2.gz QNMLLDOGDWHQDG-SANMLTNESA-N 2 0 405.586 4.239 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc(Cl)ccc1Cl ZINC000482436035 897996414 /nfs/dbraw/zinc/99/64/14/897996414.db2.gz BRMFZBMQXCJFGF-INIZCTEOSA-N 2 0 408.377 4.036 20 0 HIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(OCc2nccn2C)cc1 ZINC000482445359 898008519 /nfs/dbraw/zinc/00/85/19/898008519.db2.gz JGJGQKXGRQTZLF-FYYLOGMGSA-N 2 0 418.585 4.214 20 0 HIADRP CC(C)Oc1ccc([C@H](CNC(=O)Nc2ccccc2CC[NH+](C)C)[NH+](C)C)cc1 ZINC000482449582 898013591 /nfs/dbraw/zinc/01/35/91/898013591.db2.gz RZXACLHPUQLMGG-QHCPKHFHSA-N 2 0 412.578 4.002 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000482476982 898054401 /nfs/dbraw/zinc/05/44/01/898054401.db2.gz JDRPFVOFWMGRQV-QFIPXVFZSA-N 2 0 405.542 4.135 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000482513897 898100210 /nfs/dbraw/zinc/10/02/10/898100210.db2.gz UGRYVIGVCVJQPQ-CYFREDJKSA-N 2 0 401.545 4.112 20 0 HIADRP CCc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CCC2 ZINC000482529109 898116597 /nfs/dbraw/zinc/11/65/97/898116597.db2.gz APYLSIFSBQFYSS-YJBOKZPZSA-N 2 0 402.583 4.325 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2cccc(NC(C)=O)c2)CC1 ZINC000482555597 898147206 /nfs/dbraw/zinc/14/72/06/898147206.db2.gz RYRKBZKBJLZISG-QZTJIDSGSA-N 2 0 412.553 4.338 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(F)c(Br)c1 ZINC000482557693 898149181 /nfs/dbraw/zinc/14/91/81/898149181.db2.gz SBGXBJQREPTBID-HNNXBMFYSA-N 2 0 421.354 4.396 20 0 HIADRP C[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(-c2ccc(Br)cc2)s1 ZINC000482560555 898152750 /nfs/dbraw/zinc/15/27/50/898152750.db2.gz QFLGUFSHQPNSKF-HZPDHXFCSA-N 2 0 422.436 4.464 20 0 HIADRP CC(C)COc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)cc1 ZINC000482627441 898230088 /nfs/dbraw/zinc/23/00/88/898230088.db2.gz HJLCZWMWNXFMDP-GBXCKJPGSA-N 2 0 423.601 4.270 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)[C@H](C)C1 ZINC000482632054 898235189 /nfs/dbraw/zinc/23/51/89/898235189.db2.gz PJPRWLZJIUYGNY-HYBUGGRVSA-N 3 0 422.057 4.279 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](CCSc1ccccc1)c1ccc(F)cc1 ZINC000482634136 898237222 /nfs/dbraw/zinc/23/72/22/898237222.db2.gz UEXXESMYBIKVEK-XXBNENTESA-N 2 0 401.595 4.275 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000482639107 898243394 /nfs/dbraw/zinc/24/33/94/898243394.db2.gz RJRALEYBGLEOAP-QAPCUYQASA-N 2 0 405.011 4.066 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cc2c(s1)CCCC2 ZINC000482648948 898252622 /nfs/dbraw/zinc/25/26/22/898252622.db2.gz GOJQZFMSWBNHAR-LAUBAEHRSA-N 2 0 411.615 4.175 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NCC2([NH+]3CCSCC3)CCCCC2)cc1)C1CC1 ZINC000482846399 898456241 /nfs/dbraw/zinc/45/62/41/898456241.db2.gz DHKLOOHYSYQURF-UHFFFAOYSA-N 2 0 415.647 4.152 20 0 HIADRP CN(c1ccccc1C[N@H+](C)Cc1ccc(OC(F)F)cc1)C1CC[NH+](C)CC1 ZINC000505560584 914264190 /nfs/dbraw/zinc/26/41/90/914264190.db2.gz UQFJNOQZDBGHHZ-UHFFFAOYSA-N 2 0 403.517 4.450 20 0 HIADRP O=C([C@@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000483140897 898820612 /nfs/dbraw/zinc/82/06/12/898820612.db2.gz DZRUOWLJIHKCLV-ZEQKJWHPSA-N 2 0 409.618 4.156 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCCc2ccc(Br)cc2F)[C@@H](C)C1 ZINC000483176183 898842510 /nfs/dbraw/zinc/84/25/10/898842510.db2.gz CGWGPNSNXCNBIX-JXFKEZNVSA-N 2 0 415.391 4.247 20 0 HIADRP CC1(C(=O)N2CCC(CCC[NH+]3CCCC3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000483242965 898885562 /nfs/dbraw/zinc/88/55/62/898885562.db2.gz KZBKSRZLSJQWPQ-UHFFFAOYSA-N 2 0 411.634 4.403 20 0 HIADRP CC(C)[NH+]1CCN(C2CC[NH+](Cc3ccc(-c4cccc(F)c4F)o3)CC2)CC1 ZINC000483292007 898926454 /nfs/dbraw/zinc/92/64/54/898926454.db2.gz DQUCFRJSJKEOKV-UHFFFAOYSA-N 2 0 403.517 4.215 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)C[C@@H]1C ZINC000483677164 899337441 /nfs/dbraw/zinc/33/74/41/899337441.db2.gz FLBZDXWECMQEJU-YOEKFXIASA-N 2 0 414.638 4.179 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC3CC[NH+](C4CCCC4)CC3)cc2)C1 ZINC000483708340 899364217 /nfs/dbraw/zinc/36/42/17/899364217.db2.gz HTVXNMPOOZOFTL-HXUWFJFHSA-N 2 0 412.622 4.125 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CCCN(C)[C@@H]1c1cccs1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483710520 899365844 /nfs/dbraw/zinc/36/58/44/899365844.db2.gz HQLYSNZIYONOGY-NOXFTYBFSA-N 2 0 401.620 4.422 20 0 HIADRP COc1cccc([C@@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)c1 ZINC000483737275 899399743 /nfs/dbraw/zinc/39/97/43/899399743.db2.gz ZUITXMJPKTWJTA-MRXNPFEDSA-N 2 0 407.480 4.317 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2CC[NH+](Cc3ccccc3Cl)CC2)C[C@H]1C ZINC000483741823 899405009 /nfs/dbraw/zinc/40/50/09/899405009.db2.gz FDWQFGGGOSZABY-NQIIRXRSSA-N 2 0 421.029 4.066 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000483743101 899405180 /nfs/dbraw/zinc/40/51/80/899405180.db2.gz MLGKHQODAPISSW-MRXNPFEDSA-N 2 0 407.480 4.317 20 0 HIADRP C[C@H]([NH2+][C@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc(OCC[NH+](C)C)cc1 ZINC000483747141 899411476 /nfs/dbraw/zinc/41/14/76/899411476.db2.gz OQRFVWKNAQTIHJ-UWJYYQICSA-N 2 0 415.965 4.127 20 0 HIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+][C@@H]4CCO[C@]5(CCSC5)C4)[C@H]3C2)cc1 ZINC000485258681 900543375 /nfs/dbraw/zinc/54/33/75/900543375.db2.gz HEVVBLAKLTWKMZ-VHJOFQCFSA-N 2 0 400.632 4.322 20 0 HIADRP COc1ccc(NC(=O)CC[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1Cl ZINC000485440051 900737553 /nfs/dbraw/zinc/73/75/53/900737553.db2.gz QDGJZIORMIVSFO-LJQANCHMSA-N 2 0 415.965 4.131 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CC[C@H]2[C@@H](CCC[NH+]2C)C1)C1CCCCC1 ZINC000485614850 900872446 /nfs/dbraw/zinc/87/24/46/900872446.db2.gz OSCMXJNVCBVYEP-UPVQGACJSA-N 2 0 412.622 4.077 20 0 HIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCC(=O)Nc2ccc(OCc3ccccc3)cc2)C[C@H]1C ZINC000485676634 900927685 /nfs/dbraw/zinc/92/76/85/900927685.db2.gz VRGTWPKIUFHAHW-NFBKMPQASA-N 2 0 409.574 4.399 20 0 HIADRP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000487742218 902333599 /nfs/dbraw/zinc/33/35/99/902333599.db2.gz VEXSVFLFLZWCNM-JOCHJYFZSA-N 2 0 406.014 4.495 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](CC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)CC1 ZINC000488282955 902745374 /nfs/dbraw/zinc/74/53/74/902745374.db2.gz RVGSKZOZBSHTLG-SANMLTNESA-N 2 0 419.613 4.215 20 0 HIADRP O=C(C[NH+]1CCC(C[NH+]2CCCC2)CC1)N(CCc1ccccc1)Cc1ccccc1 ZINC000488418354 902818354 /nfs/dbraw/zinc/81/83/54/902818354.db2.gz IRBVAAAQRYPNLO-UHFFFAOYSA-N 2 0 419.613 4.066 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C)cc1)C1CC1 ZINC000488531351 902871802 /nfs/dbraw/zinc/87/18/02/902871802.db2.gz LZGRQNPTOLUEDD-CPJSRVTESA-N 2 0 405.586 4.311 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000489529734 903440139 /nfs/dbraw/zinc/44/01/39/903440139.db2.gz VPSJECLQBFDVOK-SDUSCBPUSA-N 2 0 420.601 4.033 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2cccc(SC)c2)c2cc(F)ccc2F)CC1 ZINC000490118999 903774646 /nfs/dbraw/zinc/77/46/46/903774646.db2.gz MSOHTNRGTWJDSP-HSZRJFAPSA-N 2 0 419.585 4.393 20 0 HIADRP Cc1ccc(-c2nnc([C@H](C)[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)o2)cc1C ZINC000506051909 914750791 /nfs/dbraw/zinc/75/07/91/914750791.db2.gz ORTIGSSLTAIDEJ-FQEVSTJZSA-N 2 0 412.578 4.239 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000490167742 903806589 /nfs/dbraw/zinc/80/65/89/903806589.db2.gz NAOZKVNSTMZRAU-JPYJTQIMSA-N 2 0 401.982 4.054 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]Cc2cnnn2Cc2ccccc2)cc1 ZINC000490572125 904110264 /nfs/dbraw/zinc/11/02/64/904110264.db2.gz QRSBSZWNMNHBBG-UHFFFAOYSA-N 2 0 411.553 4.345 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@@H](C)[C@H]2CC[NH+](Cc3ccccc3)C2)cc1)C1CC1 ZINC000490792890 904238521 /nfs/dbraw/zinc/23/85/21/904238521.db2.gz IBGZMXWAXVJRBV-RDPSFJRHSA-N 2 0 405.586 4.311 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1 ZINC000491018471 904371089 /nfs/dbraw/zinc/37/10/89/904371089.db2.gz IBECWOYMYDNSQW-KKSFZXQISA-N 2 0 423.935 4.256 20 0 HIADRP CSc1cccc([C@@H]([NH2+]C[C@H](C)N2CC[NH+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491025644 904376500 /nfs/dbraw/zinc/37/65/00/904376500.db2.gz WUAZDEKBRSVKIH-KSFYIVLOSA-N 2 0 405.558 4.002 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H](O)CO[C@H]2CCCc3ccccc32)CC1 ZINC000491029210 904381065 /nfs/dbraw/zinc/38/10/65/904381065.db2.gz QLWXEPMJSNFGON-VPUSJEBWSA-N 2 0 422.613 4.286 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C(=O)NCc2ccco2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492582774 904872379 /nfs/dbraw/zinc/87/23/79/904872379.db2.gz XREZRWALZCYAOU-YKSBVNFPSA-N 2 0 417.553 4.210 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C(=O)NCc2ccco2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492582773 904872535 /nfs/dbraw/zinc/87/25/35/904872535.db2.gz XREZRWALZCYAOU-RDPSFJRHSA-N 2 0 417.553 4.210 20 0 HIADRP CSc1cccc([C@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2ccc(F)c(F)c2)c1 ZINC000493056813 905003616 /nfs/dbraw/zinc/00/36/16/905003616.db2.gz KZVRXHUJEDMSON-QHCPKHFHSA-N 2 0 419.585 4.392 20 0 HIADRP CCOc1ccc([C@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2ccccc2Cl)cc1 ZINC000493054310 905003854 /nfs/dbraw/zinc/00/38/54/905003854.db2.gz HZQBLPGIERJKIK-DEOSSOPVSA-N 2 0 416.009 4.444 20 0 HIADRP CC(C)[C@@H](CSc1ccccc1)[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000493202215 905046733 /nfs/dbraw/zinc/04/67/33/905046733.db2.gz GHTNLLBQYJRFSB-OAQYLSRUSA-N 2 0 405.652 4.020 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CC(c3ccc(Br)cc3)C2)[C@@H](C)C1 ZINC000493892939 905251074 /nfs/dbraw/zinc/25/10/74/905251074.db2.gz APQWSWARTWNLMG-CTHNVIJVSA-N 2 0 409.412 4.422 20 0 HIADRP C[C@@H]1[C@@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000494050589 905388258 /nfs/dbraw/zinc/38/82/58/905388258.db2.gz QZUBYQIBBOVXLL-QPPBQGQZSA-N 2 0 405.586 4.068 20 0 HIADRP C[C@H]1[C@@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000494050597 905388396 /nfs/dbraw/zinc/38/83/96/905388396.db2.gz QZUBYQIBBOVXLL-URXFXBBRSA-N 2 0 405.586 4.068 20 0 HIADRP Cc1ccc([C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+](C)C)cc2)c2ccccc2)cc1 ZINC000494067120 905403804 /nfs/dbraw/zinc/40/38/04/905403804.db2.gz VHMYIHFGTDWYPB-RUZDIDTESA-N 2 0 401.554 4.166 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c2ccccc2C1 ZINC000494945574 906116265 /nfs/dbraw/zinc/11/62/65/906116265.db2.gz ATHJIRBXYBANPZ-WIOYSNFSSA-N 2 0 405.586 4.370 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H](C[C@H]1CCOC1)c1ccc(F)cc1 ZINC000495000774 906162864 /nfs/dbraw/zinc/16/28/64/906162864.db2.gz VMORDFNRQQMHHV-BTZRARBUSA-N 2 0 412.549 4.040 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](Cc3ccccc3)c3ccccc3)cn2)CC1 ZINC000495529937 906497359 /nfs/dbraw/zinc/49/73/59/906497359.db2.gz LUBVHGXGYTXFQU-VWLOTQADSA-N 2 0 400.570 4.297 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)C(=O)NCCc1cccs1 ZINC000495548529 906500424 /nfs/dbraw/zinc/50/04/24/906500424.db2.gz QPRCCWHXCMALOJ-HSALFYBXSA-N 2 0 413.631 4.063 20 0 HIADRP CCCN(CC[NH+]1CCCCC1)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000496629435 906723193 /nfs/dbraw/zinc/72/31/93/906723193.db2.gz GWDAOZGRRDSUJC-CWAQXLGLSA-N 2 0 412.622 4.090 20 0 HIADRP C[C@H](c1ccncc1)N1CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000512613300 921260860 /nfs/dbraw/zinc/26/08/60/921260860.db2.gz RNTCBOSOJSSRQO-FQPZXIKYSA-N 2 0 418.629 4.497 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)Nc1ccc(F)c(F)c1 ZINC000497276773 906827540 /nfs/dbraw/zinc/82/75/40/906827540.db2.gz PEWZNNJTLAPVCF-QGZVFWFLSA-N 2 0 401.501 4.458 20 0 HIADRP C[NH+](C)Cc1cccc(CNC(=O)NCc2ccccc2C[NH+]2CCCCCC2)c1 ZINC000497344843 906842531 /nfs/dbraw/zinc/84/25/31/906842531.db2.gz ONPFKRDWKZHFIC-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CCC[C@H]2C[NH+](C)CC[C@@H]21)C1CCCCC1 ZINC000497401563 906881578 /nfs/dbraw/zinc/88/15/78/906881578.db2.gz PEHXYEKUUXYYBU-UPVQGACJSA-N 2 0 412.622 4.077 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC1CC[NH+](CC2CCCC2)CC1)c1ccccc1 ZINC000497566157 907051670 /nfs/dbraw/zinc/05/16/70/907051670.db2.gz LZLFITXVYUZFCH-LJQANCHMSA-N 2 0 400.611 4.070 20 0 HIADRP CC1CC[NH+](CCCC[NH2+]Cc2cnn(-c3ccc(Br)cc3)c2)CC1 ZINC000512809384 921315629 /nfs/dbraw/zinc/31/56/29/921315629.db2.gz KOZVNROVBGIWID-UHFFFAOYSA-N 2 0 405.384 4.237 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccco1 ZINC000498049161 907559804 /nfs/dbraw/zinc/55/98/04/907559804.db2.gz RMHJHTZYGRZGBN-OOSNJVJTSA-N 2 0 418.607 4.153 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccco1 ZINC000498049163 907560879 /nfs/dbraw/zinc/56/08/79/907560879.db2.gz RMHJHTZYGRZGBN-XKGFGPFHSA-N 2 0 418.607 4.153 20 0 HIADRP O=C(NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000498600777 908049563 /nfs/dbraw/zinc/04/95/63/908049563.db2.gz OHPONMZMAZSFPZ-HSZRJFAPSA-N 2 0 411.977 4.085 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)CC[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000498909916 908320306 /nfs/dbraw/zinc/32/03/06/908320306.db2.gz KHNPEBFMEWMFEH-SFHVURJKSA-N 2 0 407.986 4.121 20 0 HIADRP Cc1nccn1CCN(CC(=O)Nc1ccccc1F)Cc1ccc(Cl)cc1 ZINC000499065314 908431444 /nfs/dbraw/zinc/43/14/44/908431444.db2.gz RBFYDCSSEHMBFL-UHFFFAOYSA-N 2 0 400.885 4.125 20 0 HIADRP C[C@H](c1ccncc1)N1CCC([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499176992 908531659 /nfs/dbraw/zinc/53/16/59/908531659.db2.gz NTYQMBOTTLMKCN-YEHREXKJSA-N 2 0 404.602 4.392 20 0 HIADRP O=C(CCc1ccccc1)N1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000499243299 908610850 /nfs/dbraw/zinc/61/08/50/908610850.db2.gz JYKXNIRXTXWNSX-ASDGIDEWSA-N 2 0 417.597 4.005 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)cc1)C1CC1 ZINC000499470041 908808755 /nfs/dbraw/zinc/80/87/55/908808755.db2.gz JIVOPEBDNHUPIF-UHFFFAOYSA-N 2 0 405.586 4.408 20 0 HIADRP CN(C(=O)[C@H]1CCC[N@H+](Cc2cccc(F)c2)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000499647155 908864399 /nfs/dbraw/zinc/86/43/99/908864399.db2.gz IYOSAPYPWNNQJX-QHCPKHFHSA-N 2 0 423.576 4.161 20 0 HIADRP CC(C)C[NH+]1CCC(NC(=O)NCc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)CC1 ZINC000500647104 909990648 /nfs/dbraw/zinc/99/06/48/909990648.db2.gz HOYFTONYLLUPMP-SFTDATJTSA-N 2 0 414.638 4.084 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(CNC(=O)NCc3cccc(C[NH+](C)C)c3)cc2)C1 ZINC000500694085 910026637 /nfs/dbraw/zinc/02/66/37/910026637.db2.gz GINMCOZCNVXCKJ-OYRHEFFESA-N 2 0 422.617 4.226 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)N2CCC(CCC[NH+](C)C)CC2)c2cccs2)CC1 ZINC000500794566 910083699 /nfs/dbraw/zinc/08/36/99/910083699.db2.gz UEKZCXMULGXLRF-OAQYLSRUSA-N 2 0 420.667 4.285 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(Br)cc2)C2CCC2)CC1 ZINC000501019352 910237107 /nfs/dbraw/zinc/23/71/07/910237107.db2.gz CICBVDPXTSIWRO-OAQYLSRUSA-N 2 0 408.428 4.296 20 0 HIADRP Cc1cc(C)c(NC(=O)C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000501041085 910254611 /nfs/dbraw/zinc/25/46/11/910254611.db2.gz VJSVRCHCDUKQIM-UHFFFAOYSA-N 2 0 400.954 4.139 20 0 HIADRP Cc1ccc(NC(=O)[C@H](C)[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000501047748 910258467 /nfs/dbraw/zinc/25/84/67/910258467.db2.gz OVISMOYPWFXYEL-KRWDZBQOSA-N 2 0 400.954 4.219 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)CC1 ZINC000501054362 910265570 /nfs/dbraw/zinc/26/55/70/910265570.db2.gz YCBOEAIJWQWVKM-JOCHJYFZSA-N 2 0 421.029 4.288 20 0 HIADRP C[C@@H](C(=O)Nc1ccc(C(F)(F)F)cc1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501080946 910280671 /nfs/dbraw/zinc/28/06/71/910280671.db2.gz WJSZTHIWFSXUQL-INIZCTEOSA-N 2 0 420.479 4.276 20 0 HIADRP COc1ccc(C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cc1Br ZINC000501085150 910283338 /nfs/dbraw/zinc/28/33/38/910283338.db2.gz HJYQVSNOTVNDOB-UHFFFAOYSA-N 2 0 404.352 4.201 20 0 HIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000501404991 910535942 /nfs/dbraw/zinc/53/59/42/910535942.db2.gz HQQPBPOLRMDBEV-GHRIWEEISA-N 2 0 404.480 4.045 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)c1)C1CCOCC1 ZINC000501482779 910597726 /nfs/dbraw/zinc/59/77/26/910597726.db2.gz UPIMCPVSAKDFAE-UPVQGACJSA-N 2 0 423.601 4.387 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)CC1 ZINC000501772007 910826358 /nfs/dbraw/zinc/82/63/58/910826358.db2.gz HYJVSTWGQGEVPE-HXUWFJFHSA-N 2 0 414.594 4.485 20 0 HIADRP COc1ccc(NC(=O)[C@@H](c2ccccc2)[NH+]2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000501787901 910840838 /nfs/dbraw/zinc/84/08/38/910840838.db2.gz BTYLKASGTMKUMN-XMMPIXPASA-N 2 0 409.574 4.429 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000501793556 910845556 /nfs/dbraw/zinc/84/55/56/910845556.db2.gz AQHKSJNPYFTFLB-NHCUHLMSSA-N 2 0 412.603 4.021 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1)c1ccco1 ZINC000502563263 911568070 /nfs/dbraw/zinc/56/80/70/911568070.db2.gz LWITVOJWXGAZPL-CBNMVNINSA-N 2 0 404.599 4.005 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000502846793 911857813 /nfs/dbraw/zinc/85/78/13/911857813.db2.gz OZCJCAUHJXXIRH-LJQANCHMSA-N 2 0 421.029 4.258 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)NCc2ccccc2C[NH+]2CCCCC2)C1 ZINC000502864166 911870702 /nfs/dbraw/zinc/87/07/02/911870702.db2.gz SOUICMPDZCGKCP-SZPZYZBQSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1)c1ccccc1 ZINC000502930805 911917246 /nfs/dbraw/zinc/91/72/46/911917246.db2.gz AAKMYRXODUFHAA-OFNKIYASSA-N 2 0 408.590 4.252 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1ccccc1 ZINC000503141507 912102288 /nfs/dbraw/zinc/10/22/88/912102288.db2.gz SKZFVMMJRZEJSK-CTNGQTDRSA-N 2 0 412.578 4.235 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)C1 ZINC000506938483 915742716 /nfs/dbraw/zinc/74/27/16/915742716.db2.gz DSEFJWWSQAODKD-GSPCLOLRSA-N 2 0 406.659 4.041 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000506957646 915764439 /nfs/dbraw/zinc/76/44/39/915764439.db2.gz XDHOAJBXSURFDC-QPPBQGQZSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12)c1cccc(N2CCCC2=O)c1 ZINC000507469642 916238532 /nfs/dbraw/zinc/23/85/32/916238532.db2.gz KXRVQWOZHIJGBU-ILJKJKDTSA-N 2 0 403.570 4.375 20 0 HIADRP CC[N@H+](CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)[C@@H](C)c1ccc(F)cc1 ZINC000507703140 916488741 /nfs/dbraw/zinc/48/87/41/916488741.db2.gz PGQSJFKLYUXSHC-FQEVSTJZSA-N 2 0 411.565 4.298 20 0 HIADRP CCOc1cc(CNCCC[N@H+](C)Cc2ccccc2)cc(Br)c1O ZINC000508331024 917133453 /nfs/dbraw/zinc/13/34/53/917133453.db2.gz XSTUXPMZMKQUOB-UHFFFAOYSA-N 2 0 407.352 4.165 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccccc2N2CC[NH+](CC)CC2)cc1 ZINC000508501712 917285789 /nfs/dbraw/zinc/28/57/89/917285789.db2.gz DYKVXTCTOHVBFO-UHFFFAOYSA-N 2 0 408.590 4.313 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(NC(=O)c2ccccn2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721151 917482682 /nfs/dbraw/zinc/48/26/82/917482682.db2.gz TWVRQIQNBYAOSY-OFNKIYASSA-N 2 0 414.553 4.334 20 0 HIADRP C[C@H](NC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H](c1ccccc1)[NH+](C)C ZINC000508913344 917670378 /nfs/dbraw/zinc/67/03/78/917670378.db2.gz BZUPRKVNPLESNZ-RDPSFJRHSA-N 2 0 423.605 4.021 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)[C@@]2(C(F)(F)F)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508926237 917687074 /nfs/dbraw/zinc/68/70/74/917687074.db2.gz JNJCTVRQUCDLDF-OAQYLSRUSA-N 2 0 405.464 4.141 20 0 HIADRP Fc1ccc2nc([C@@H]3CCC[N@H+](CCCN4CCN(c5ccccc5)CC4)C3)oc2c1 ZINC000508978597 917731975 /nfs/dbraw/zinc/73/19/75/917731975.db2.gz OOHGMSSYBJJBPB-HXUWFJFHSA-N 2 0 422.548 4.359 20 0 HIADRP C[N@@H+](Cc1nc2cc(Br)ccc2o1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000509024080 917779017 /nfs/dbraw/zinc/77/90/17/917779017.db2.gz TUYYJTIAWOXOBZ-UHFFFAOYSA-N 2 0 415.335 4.334 20 0 HIADRP CCC[N@H+](C)[C@@H](CNC(=O)N1CC[C@H](C[NH+](C)CC2CC2)C1)c1ccc(Cl)cc1 ZINC000509040470 917793210 /nfs/dbraw/zinc/79/32/10/917793210.db2.gz SETMHHRIJRJXMZ-KNQAVFIVSA-N 2 0 421.029 4.096 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(-c3cnn(C)c3)s2)C[C@H](C)O1 ZINC000509487800 918133934 /nfs/dbraw/zinc/13/39/34/918133934.db2.gz SUFBBWCYXYXPNB-ROUUACIJSA-N 2 0 410.587 4.048 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccco1 ZINC000509586652 918235216 /nfs/dbraw/zinc/23/52/16/918235216.db2.gz ICJSLGRAMUHYKM-TUNNFDKTSA-N 2 0 412.578 4.015 20 0 HIADRP CN(c1ccccc1C[NH+]1CCC(c2c[nH]c3ncccc23)CC1)C1CC[NH+](C)CC1 ZINC000509586466 918235441 /nfs/dbraw/zinc/23/54/41/918235441.db2.gz IYTAHZXMXSKZEO-UHFFFAOYSA-N 2 0 417.601 4.473 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1)c1ccco1 ZINC000509595928 918246394 /nfs/dbraw/zinc/24/63/94/918246394.db2.gz LKLHIEUVMGJRLA-XSDIEEQYSA-N 2 0 404.599 4.005 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1)c1ccco1 ZINC000509595927 918246817 /nfs/dbraw/zinc/24/68/17/918246817.db2.gz LKLHIEUVMGJRLA-UWHLTILDSA-N 2 0 404.599 4.005 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1)c1ccco1 ZINC000509612161 918258493 /nfs/dbraw/zinc/25/84/93/918258493.db2.gz WVHMCHXMWUOOFG-XTJBDQBJSA-N 2 0 424.589 4.016 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000510084325 918651105 /nfs/dbraw/zinc/65/11/05/918651105.db2.gz GAHDMLXMALUSOX-HSZRJFAPSA-N 2 0 424.589 4.292 20 0 HIADRP CN(c1ccccc1C[NH+]1CCC(Nc2ccc(F)cc2)CC1)C1CC[NH+](C)CC1 ZINC000510222750 918767438 /nfs/dbraw/zinc/76/74/38/918767438.db2.gz NEVXBZKHTIHVQD-UHFFFAOYSA-N 2 0 410.581 4.433 20 0 HIADRP CCC[NH+]1CCC(CNC(=O)[C@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)CC1 ZINC000510389213 918867717 /nfs/dbraw/zinc/86/77/17/918867717.db2.gz OIDWSOVQRDFTAC-FQEVSTJZSA-N 2 0 413.528 4.327 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000510388665 918867863 /nfs/dbraw/zinc/86/78/63/918867863.db2.gz KGOIJXCGBFWOMK-KRWDZBQOSA-N 2 0 411.571 4.198 20 0 HIADRP C[C@@H](NC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000510492969 918940509 /nfs/dbraw/zinc/94/05/09/918940509.db2.gz SPARTXZMUMXBDH-OFNKIYASSA-N 2 0 412.622 4.125 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000510523580 918969235 /nfs/dbraw/zinc/96/92/35/918969235.db2.gz MFXLELBRYFVYOD-KJXAQDMKSA-N 2 0 400.611 4.022 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(CN3CC[NH+](CC)CC3)cc2)cc1)C1CC1 ZINC000510860449 919352168 /nfs/dbraw/zinc/35/21/68/919352168.db2.gz KOWKUIVLVRLOCS-UHFFFAOYSA-N 2 0 420.601 4.061 20 0 HIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000510952596 919485817 /nfs/dbraw/zinc/48/58/17/919485817.db2.gz RSNDLWSWRMSDPB-JTSKRJEESA-N 2 0 406.492 4.383 20 0 HIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000510952598 919486627 /nfs/dbraw/zinc/48/66/27/919486627.db2.gz RSNDLWSWRMSDPB-VGSWGCGISA-N 2 0 406.492 4.383 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)c1cccc(C[N@H+](C)Cc2ccccc2)c1)c1cccs1 ZINC000511064349 919663079 /nfs/dbraw/zinc/66/30/79/919663079.db2.gz NZHRHMGDMCSTCQ-QFIPXVFZSA-N 2 0 407.583 4.413 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)c1 ZINC000511379200 919981274 /nfs/dbraw/zinc/98/12/74/919981274.db2.gz PJVUMLMOKSNBRM-RPWUZVMVSA-N 2 0 416.009 4.343 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)c1 ZINC000511379199 919981799 /nfs/dbraw/zinc/98/17/99/919981799.db2.gz PJVUMLMOKSNBRM-DNQXCXABSA-N 2 0 416.009 4.343 20 0 HIADRP Cc1ccc(C[N@@H+](CC(=O)NC2CC[NH+](C(C)C)CC2)[C@@H]2CCc3ccccc32)cc1 ZINC000511634404 920296612 /nfs/dbraw/zinc/29/66/12/920296612.db2.gz MKEYMGZELMKYMR-AREMUKBSSA-N 2 0 419.613 4.474 20 0 HIADRP CCOc1cc(C[NH+]2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)ccc1OC(F)F ZINC000512188155 920929523 /nfs/dbraw/zinc/92/95/23/920929523.db2.gz WHWAHEVOXWZREZ-IRXDYDNUSA-N 2 0 412.521 4.008 20 0 HIADRP CC1CC[NH+](C[C@@H]2CCCN(Cc3ccccc3N(C)C3CC[NH+](C)CC3)C2)CC1 ZINC000512192005 920934800 /nfs/dbraw/zinc/93/48/00/920934800.db2.gz CHRUEPOAMHYEOK-QHCPKHFHSA-N 2 0 412.666 4.161 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)N[C@H]2CC[N@H+](Cc3ccc(C(F)(F)F)cc3)C2)c1 ZINC000512234006 920987624 /nfs/dbraw/zinc/98/76/24/920987624.db2.gz NMGBTVQRVCPXAX-FQEVSTJZSA-N 2 0 420.479 4.163 20 0 HIADRP Cc1cc(C[NH+]2CCSCC2)ccc1NC(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000512286808 921040966 /nfs/dbraw/zinc/04/09/66/921040966.db2.gz WZTKBOVCJKKVBL-UHFFFAOYSA-N 2 0 409.599 4.392 20 0 HIADRP c1cc(Sc2ccccn2)oc1C[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000512334445 921081898 /nfs/dbraw/zinc/08/18/98/921081898.db2.gz RZNWNNOUFWWFOJ-UHFFFAOYSA-N 2 0 401.576 4.150 20 0 HIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2c[nH]nc2-c2ccc3c(c2)OCO3)C[N@@H+]1Cc1ccccc1 ZINC000513501606 921851303 /nfs/dbraw/zinc/85/13/03/921851303.db2.gz UMUXDQBQBRSTJA-AZUAARDMSA-N 2 0 418.541 4.196 20 0 HIADRP Cc1nc(COc2ccc(C[NH2+]CC[C@@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)cc2)no1 ZINC000513546021 921883549 /nfs/dbraw/zinc/88/35/49/921883549.db2.gz VIYHXQVSSUEQCB-AUSIDOKSSA-N 2 0 420.557 4.347 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCN(c3ccccc3Cl)C2=O)CC1 ZINC000513654632 921975603 /nfs/dbraw/zinc/97/56/03/921975603.db2.gz JBGRBYPTQYDERC-AOMIVXANSA-N 2 0 411.977 4.478 20 0 HIADRP C[N@@H+](Cc1cc(Br)ccc1OCc1ccccn1)CC1CC[NH+](C)CC1 ZINC000513733164 922053213 /nfs/dbraw/zinc/05/32/13/922053213.db2.gz OETYLFDBGLLVJB-UHFFFAOYSA-N 2 0 418.379 4.197 20 0 HIADRP O=C(NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)Nc1cccc(-c2cccs2)c1 ZINC000513971298 922289061 /nfs/dbraw/zinc/28/90/61/922289061.db2.gz HMLNNKDPFYOMQU-UHFFFAOYSA-N 2 0 421.570 4.144 20 0 HIADRP CCCN(C(=O)NCc1cccc(C[NH+](C)C)c1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000514064149 922389314 /nfs/dbraw/zinc/38/93/14/922389314.db2.gz QILQQEKPOUVVPM-VWLOTQADSA-N 2 0 422.617 4.334 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000514162626 922500125 /nfs/dbraw/zinc/50/01/25/922500125.db2.gz NQTHNQLNTZMTDH-HLAWJBBLSA-N 2 0 412.603 4.020 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@H](c1ccc(C)cc1)[NH+](C)C)c1ccsc1 ZINC000514221954 922557203 /nfs/dbraw/zinc/55/72/03/922557203.db2.gz LENXOCBKIQEKQZ-NHCUHLMSSA-N 2 0 402.608 4.042 20 0 HIADRP COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000514962762 922856520 /nfs/dbraw/zinc/85/65/20/922856520.db2.gz FKQIGGOGMKSRTJ-WOJBJXKFSA-N 2 0 409.574 4.037 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)N2CCC([NH+]3CCCCC3)CC2)c2cccs2)CC1 ZINC000515291839 923039740 /nfs/dbraw/zinc/03/97/40/923039740.db2.gz PYQMZFFWFKHFIP-OAQYLSRUSA-N 2 0 418.651 4.181 20 0 HIADRP Cc1ccccc1CCNC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000515518810 923148904 /nfs/dbraw/zinc/14/89/04/923148904.db2.gz OIUOWHQOHVPDHF-VXKWHMMOSA-N 2 0 407.602 4.206 20 0 HIADRP CCOc1ccccc1NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000515756751 923328959 /nfs/dbraw/zinc/32/89/59/923328959.db2.gz UZHQOJXTSQTWCY-UXHICEINSA-N 2 0 409.574 4.434 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C(=O)N1CCc2sccc2C1 ZINC000515757887 923331081 /nfs/dbraw/zinc/33/10/81/923331081.db2.gz VLLRMSFOGIUKAK-RBUKOAKNSA-N 2 0 411.615 4.043 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)N2CCC(CC[NH+](C)C)CC2)C1 ZINC000515802594 923359731 /nfs/dbraw/zinc/35/97/31/923359731.db2.gz YAMZGTUSPNJGBI-NHCUHLMSSA-N 2 0 414.638 4.038 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000515873128 923404684 /nfs/dbraw/zinc/40/46/84/923404684.db2.gz MFGCCWURHALCRF-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@@H]1CC[NH+]([C@@H](C)c2ccccc2)C1 ZINC000516579807 923800349 /nfs/dbraw/zinc/80/03/49/923800349.db2.gz TUGJSJGMGSRAOC-GBXCKJPGSA-N 2 0 408.590 4.162 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1Cl ZINC000517104061 923998829 /nfs/dbraw/zinc/99/88/29/923998829.db2.gz PDXICXQYWXGZOQ-RXVVDRJESA-N 2 0 409.018 4.143 20 0 HIADRP C[C@H](CNC(=O)N1CCC(C[N@H+](C)Cc2ccccc2)CC1)[NH+](C)Cc1ccccc1 ZINC000517703028 926803972 /nfs/dbraw/zinc/80/39/72/926803972.db2.gz WZJNSTGCJVBQBV-JOCHJYFZSA-N 2 0 422.617 4.061 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCC1)N1CCC[N@H+](CC2CCCCC2)CC1 ZINC000517724064 926814963 /nfs/dbraw/zinc/81/49/63/926814963.db2.gz FDZFYPXGHNMMRE-UHFFFAOYSA-N 2 0 412.622 4.080 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2cnc(-c3ccccc3)s2)[C@H](c2ccccc2)C1 ZINC000518269505 927126608 /nfs/dbraw/zinc/12/66/08/927126608.db2.gz FOTAXHDJZSNTJZ-QHCPKHFHSA-N 2 0 406.599 4.279 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC[C@H](c2cccs2)[NH+](C)C)c2ccccc2)CC1 ZINC000518363459 927222630 /nfs/dbraw/zinc/22/26/30/927222630.db2.gz KNYKLIAPVAUFBV-NHCUHLMSSA-N 2 0 414.619 4.123 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1)c1ccsc1 ZINC000518406852 927247689 /nfs/dbraw/zinc/24/76/89/927247689.db2.gz IIPOHVXPLKJFSS-BVYCBKJFSA-N 2 0 414.619 4.266 20 0 HIADRP CC[N@H+](C)[C@H](C(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccccc1 ZINC000518587754 927365271 /nfs/dbraw/zinc/36/52/71/927365271.db2.gz BMJDMSHVWXFGMZ-QHCPKHFHSA-N 2 0 413.993 4.361 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000518632081 927392182 /nfs/dbraw/zinc/39/21/82/927392182.db2.gz YCCMBWCNZQURMG-XUZZJYLKSA-N 2 0 412.622 4.221 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CC[C@H]([NH+]2CCCCC2)C1)C1CCCCC1 ZINC000521699204 929372919 /nfs/dbraw/zinc/37/29/19/929372919.db2.gz YVKDVUVMAKMXLF-DEOSSOPVSA-N 2 0 412.622 4.221 20 0 HIADRP C[NH+]1CCN(Cc2ccc(C[NH2+]Cc3cccc(OCc4ccccc4)c3)cc2)CC1 ZINC000521813833 929472059 /nfs/dbraw/zinc/47/20/59/929472059.db2.gz DBPIBDDMLZIXOB-UHFFFAOYSA-N 2 0 415.581 4.303 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(Cc2ccncc2)C[C@H]2CCC[NH+]2CC)cc1)C(C)C ZINC000521881584 929530151 /nfs/dbraw/zinc/53/01/51/929530151.db2.gz HJUGLCHSVPLSHJ-RUZDIDTESA-N 2 0 422.617 4.439 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC000525383900 930210270 /nfs/dbraw/zinc/21/02/70/930210270.db2.gz FXDJRSQXHIGHSN-WIOPSUGQSA-N 2 0 405.586 4.022 20 0 HIADRP Cc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(-n2cc(Cl)cn2)n1 ZINC000526049885 930514812 /nfs/dbraw/zinc/51/48/12/930514812.db2.gz DFGLQGTVUQLGIB-WIYYLYMNSA-N 2 0 409.965 4.229 20 0 HIADRP C[C@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000527223047 930615273 /nfs/dbraw/zinc/61/52/73/930615273.db2.gz LJDIQXPHQPLGOC-IJXRJRJASA-N 2 0 404.023 4.472 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)N1CC[C@@H](C[NH+]2CCCC2)C1)c1cccc(C(F)(F)F)c1 ZINC000530582513 930758201 /nfs/dbraw/zinc/75/82/01/930758201.db2.gz JKZAUZIHVBOAAB-FXAWDEMLSA-N 2 0 411.512 4.033 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccc(-c3nc(-c4ccc(C[NH+](C)C)cc4)no3)cc2)C[C@@H](C)O1 ZINC000530871668 930844767 /nfs/dbraw/zinc/84/47/67/930844767.db2.gz RWJKVHVTOAWIPA-QZTJIDSGSA-N 2 0 406.530 4.074 20 0 HIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3ccc(OCc4ccncc4)cc3)CC2)C[C@H](C)O1 ZINC000531416850 931048046 /nfs/dbraw/zinc/04/80/46/931048046.db2.gz PPZIESRRYCRUDJ-SZPZYZBQSA-N 2 0 423.601 4.372 20 0 HIADRP COc1cc(C[NH+]2CCC(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1OC(F)F ZINC000531416801 931048194 /nfs/dbraw/zinc/04/81/94/931048194.db2.gz GVPOOXUFCUPZOS-CALCHBBNSA-N 2 0 412.521 4.008 20 0 HIADRP C[C@@H](c1ccccc1)N1CC[C@@H]([NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000531594425 931113446 /nfs/dbraw/zinc/11/34/46/931113446.db2.gz KAYARRVNTNPWKC-XUZZJYLKSA-N 2 0 406.618 4.142 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@@H]1CCCO[C@@H]1c1ccccc1)C1CC[NH+](C)CC1 ZINC000531596854 931115809 /nfs/dbraw/zinc/11/58/09/931115809.db2.gz AOVFLSYXSNFEAN-JYFHCDHNSA-N 2 0 407.602 4.475 20 0 HIADRP COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000531942256 931256046 /nfs/dbraw/zinc/25/60/46/931256046.db2.gz DJHPNYKMLQZKRL-NRFANRHFSA-N 2 0 416.997 4.372 20 0 HIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)C1 ZINC000531958624 931264884 /nfs/dbraw/zinc/26/48/84/931264884.db2.gz QRUFTPQHSHRQFI-HOTGVXAUSA-N 2 0 401.473 4.012 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000532016104 931285040 /nfs/dbraw/zinc/28/50/40/931285040.db2.gz QHFBIUMEIHLIGW-BJKOFHAPSA-N 2 0 414.977 4.386 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(N3CCC(C)CC3)nc2)CC1 ZINC000532042245 931295204 /nfs/dbraw/zinc/29/52/04/931295204.db2.gz GZPKGTDWARMZOY-UHFFFAOYSA-N 2 0 421.633 4.140 20 0 HIADRP C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000532196139 931345045 /nfs/dbraw/zinc/34/50/45/931345045.db2.gz ZDDKAAUVPJJBER-QWHCGFSZSA-N 2 0 403.876 4.150 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccccc1C(F)(F)F ZINC000532230545 931364380 /nfs/dbraw/zinc/36/43/80/931364380.db2.gz ADXOVAVHGHPMCL-APWZRJJASA-N 2 0 419.491 4.254 20 0 HIADRP CCC(CC)[C@@H](C[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1)[NH+]1CCCC1 ZINC000532458861 931444869 /nfs/dbraw/zinc/44/48/69/931444869.db2.gz WGWYDOPVUXVALX-JOCHJYFZSA-N 2 0 406.014 4.435 20 0 HIADRP C(CN1CCC[C@@H](C[NH+]2CCCCCC2)C1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000532950330 931708547 /nfs/dbraw/zinc/70/85/47/931708547.db2.gz IFWTVDRGGDBHPG-UIOOFZCWSA-N 2 0 418.714 4.162 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1C[C@@H](c2ccc(F)cc2)C[C@H]1C ZINC000533300024 931832983 /nfs/dbraw/zinc/83/29/83/931832983.db2.gz XBQSNYDSEKWLFU-VIZSFHNOSA-N 2 0 423.576 4.173 20 0 HIADRP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1C[C@H](c2ccc(F)cc2)C[C@H]1C ZINC000533300025 931833145 /nfs/dbraw/zinc/83/31/45/931833145.db2.gz XBQSNYDSEKWLFU-ZRCGQRJVSA-N 2 0 423.576 4.173 20 0 HIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+]([C@@H](C)c3cccc(NC(=O)c4ccccc4)c3)C2)CC1 ZINC000533308223 931834798 /nfs/dbraw/zinc/83/47/98/931834798.db2.gz LYKYXPLVECEQDE-SQJMNOBHSA-N 2 0 420.601 4.100 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000533435487 931868043 /nfs/dbraw/zinc/86/80/43/931868043.db2.gz FDKRURJTLLULCF-PQNGQFLHSA-N 2 0 405.586 4.034 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1)c1ccccc1Cl ZINC000533763320 932018227 /nfs/dbraw/zinc/01/82/27/932018227.db2.gz BPHWGJCZZGVYDA-DENIHFKCSA-N 2 0 421.029 4.096 20 0 HIADRP CCOc1ccccc1NC(=O)CC[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534963735 932863102 /nfs/dbraw/zinc/86/31/02/932863102.db2.gz JQNXKNOCYOGCGZ-UHFFFAOYSA-N 2 0 421.585 4.402 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H]2CCc3c2cc(Cl)cc3Br)CC1 ZINC000535506506 933199402 /nfs/dbraw/zinc/19/94/02/933199402.db2.gz FAQVKUPFIBNEDE-IBGZPJMESA-N 2 0 414.819 4.097 20 0 HIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]Cc2ccc(-c3ccncc3)cc2)CC1 ZINC000536137341 933681834 /nfs/dbraw/zinc/68/18/34/933681834.db2.gz QLSRONPMGIDDHW-UHFFFAOYSA-N 2 0 406.961 4.444 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc2cc(Cl)ccc2o1 ZINC000537295541 933702592 /nfs/dbraw/zinc/70/25/92/933702592.db2.gz MBUSXYIZZSYPKD-OAHLLOKOSA-N 2 0 405.970 4.364 20 0 HIADRP Cc1cc(Br)cc2cc([C@@H]([NH2+]CCCN3CC[NH+](C)CC3)C(C)C)oc21 ZINC000537351746 933731387 /nfs/dbraw/zinc/73/13/87/933731387.db2.gz LVTKTRQRCSEYLO-FQEVSTJZSA-N 2 0 422.411 4.428 20 0 HIADRP CCOc1ccc(-c2noc(C[N@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)n2)cc1 ZINC000537841984 938387106 /nfs/dbraw/zinc/38/71/06/938387106.db2.gz QUWQRNBUYFIZRN-UHFFFAOYSA-N 2 0 421.545 4.269 20 0 HIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(I)cc1 ZINC000537934744 938421943 /nfs/dbraw/zinc/42/19/43/938421943.db2.gz BGUIAJCEUSAJOS-OAHLLOKOSA-N 2 0 421.326 4.253 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CCCOc3cc(Br)ccc32)C[C@@H](C)O1 ZINC000537971354 938441384 /nfs/dbraw/zinc/44/13/84/938441384.db2.gz LDPJDGYQQUXQAM-GPMSIDNRSA-N 2 0 411.384 4.142 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)cc1Cl ZINC000537972696 938442044 /nfs/dbraw/zinc/44/20/44/938442044.db2.gz XXECQUUPDOGSBN-KRWDZBQOSA-N 2 0 415.965 4.025 20 0 HIADRP C[NH+]1CCN(C[C@@H]([NH2+][C@H]2CCc3c2cccc3Br)c2ccccc2)CC1 ZINC000538100524 938502438 /nfs/dbraw/zinc/50/24/38/938502438.db2.gz PHGVAYSJCQRXCF-FCHUYYIVSA-N 2 0 414.391 4.015 20 0 HIADRP CC(C)([NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)c1cccc(Cl)c1 ZINC000538215732 938560002 /nfs/dbraw/zinc/56/00/02/938560002.db2.gz ZHXNISVQNDQHJR-UHFFFAOYSA-N 2 0 418.006 4.352 20 0 HIADRP C[C@@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2sccc2C1 ZINC000538276827 938581671 /nfs/dbraw/zinc/58/16/71/938581671.db2.gz SHQWQXGGCBVZSV-RXVVDRJESA-N 2 0 411.615 4.073 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@@H]1CCN(c3c(F)cccc3F)C1)c1ccccc1O2 ZINC000538293576 938585131 /nfs/dbraw/zinc/58/51/31/938585131.db2.gz IVXKQZPLYZWXEV-UTKZUKDTSA-N 2 0 413.512 4.121 20 0 HIADRP COc1ccc(C[C@H](C)[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1OC ZINC000538299319 938586727 /nfs/dbraw/zinc/58/67/27/938586727.db2.gz TXNWNXCOTVMVAQ-RXVVDRJESA-N 2 0 410.558 4.213 20 0 HIADRP Cc1nc(COc2ccc(C[NH+]3CCC(CC[N@H+]4CCCC[C@@H]4C)CC3)cc2)no1 ZINC000538721340 938690859 /nfs/dbraw/zinc/69/08/59/938690859.db2.gz CSALIASEJSMEOS-IBGZPJMESA-N 2 0 412.578 4.434 20 0 HIADRP CCC[NH+]1CCC(N(C)C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)CC1 ZINC000538773429 938706728 /nfs/dbraw/zinc/70/67/28/938706728.db2.gz OECOGVUFJJEYGU-UHFFFAOYSA-N 2 0 400.611 4.299 20 0 HIADRP C[C@H](C(=O)N[C@@H](C)c1ccc(F)cc1)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538945299 938743329 /nfs/dbraw/zinc/74/33/29/938743329.db2.gz YSUUPTZSYWJHKK-RBUKOAKNSA-N 2 0 412.553 4.025 20 0 HIADRP C[C@H](NC(=O)[C@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000538945298 938743632 /nfs/dbraw/zinc/74/36/32/938743632.db2.gz YSUUPTZSYWJHKK-OALUTQOASA-N 2 0 412.553 4.025 20 0 HIADRP Cc1cc(C[C@@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)n(-c2ccccc2)n1 ZINC000539048805 938782771 /nfs/dbraw/zinc/78/27/71/938782771.db2.gz VMBAGXQQVWVALS-CTNGQTDRSA-N 2 0 406.574 4.403 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(COC2CCOCC2)cc1 ZINC000539052476 938783733 /nfs/dbraw/zinc/78/37/33/938783733.db2.gz IRMPBBBOYYOKCZ-HFZDXXHNSA-N 2 0 408.586 4.382 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000539063537 938789111 /nfs/dbraw/zinc/78/91/11/938789111.db2.gz JXKNJSOXSOBUOG-ZOCIIQOWSA-N 2 0 402.526 4.369 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1cccc(-c2ccccc2)c1 ZINC000539074301 938794633 /nfs/dbraw/zinc/79/46/33/938794633.db2.gz VWNDHGOUDLNKJD-HXUWFJFHSA-N 2 0 401.554 4.496 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)C2CCN(c3cc[nH+]cc3C)CC2)CC1)CC(C)C ZINC000539136117 938809163 /nfs/dbraw/zinc/80/91/63/938809163.db2.gz STXYDMOMCXZAJS-UHFFFAOYSA-N 2 0 414.638 4.213 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000539200207 938818466 /nfs/dbraw/zinc/81/84/66/938818466.db2.gz CDZPBNKVOVFRAD-HXUWFJFHSA-N 2 0 404.480 4.093 20 0 HIADRP COc1ccc(OC)c(CCC[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c1 ZINC000539409557 938856405 /nfs/dbraw/zinc/85/64/05/938856405.db2.gz JZEWBDXXXUOWFK-JOCHJYFZSA-N 2 0 410.558 4.214 20 0 HIADRP CC[NH+]1CCN(c2ccc(N[C@@H](C)c3ccc(OCC[NH+](C)C)cc3)c(C)c2)CC1 ZINC000539610090 938887591 /nfs/dbraw/zinc/88/75/91/938887591.db2.gz PJWVEFIXVWKBET-NRFANRHFSA-N 2 0 410.606 4.250 20 0 HIADRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000539832654 938951815 /nfs/dbraw/zinc/95/18/15/938951815.db2.gz YVNIDJYBHQZUEW-UHFFFAOYSA-N 2 0 407.352 4.252 20 0 HIADRP Cc1ccc(COc2ccc(C[N@H+]3CC[C@@H](N4CC[NH+](C(C)C)CC4)C3)cc2)cc1 ZINC000539862711 938960902 /nfs/dbraw/zinc/96/09/02/938960902.db2.gz URNLHLFFGWFQGC-RUZDIDTESA-N 2 0 407.602 4.174 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)N3CCCC[C@H]([NH+]4CCCC4)C3)c2)CC1 ZINC000539871570 938962885 /nfs/dbraw/zinc/96/28/85/938962885.db2.gz CCTJXBSBWGDJGT-DEOSSOPVSA-N 2 0 412.622 4.443 20 0 HIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000540140957 939088887 /nfs/dbraw/zinc/08/88/87/939088887.db2.gz BPMZZKOUUJUFLP-IRFCIJBXSA-N 2 0 400.588 4.041 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1 ZINC000540143017 939089573 /nfs/dbraw/zinc/08/95/73/939089573.db2.gz BEHURRLPEIJVTC-HOHBBMLPSA-N 2 0 407.624 4.142 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H]2CCSc3ccc(Br)cc32)ccn1 ZINC000540144310 939089838 /nfs/dbraw/zinc/08/98/38/939089838.db2.gz XLMJHZTWOPIXBQ-QGZVFWFLSA-N 2 0 422.392 4.111 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000540299508 939186611 /nfs/dbraw/zinc/18/66/11/939186611.db2.gz JORFHRCMZBTWCO-HSZRJFAPSA-N 2 0 409.530 4.495 20 0 HIADRP C[C@H](CCN[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000540494675 939274668 /nfs/dbraw/zinc/27/46/68/939274668.db2.gz HDQRYNJFISTBKU-QPPBQGQZSA-N 2 0 407.602 4.475 20 0 HIADRP CC(C)[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1F ZINC000540988912 939426411 /nfs/dbraw/zinc/42/64/11/939426411.db2.gz KVGRJPZPGOCJOQ-OAQYLSRUSA-N 2 0 419.976 4.158 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(OCC(F)(F)F)cc1 ZINC000540991126 939426769 /nfs/dbraw/zinc/42/67/69/939426769.db2.gz XZXOIPRFNBAXHR-LAUBAEHRSA-N 2 0 422.491 4.435 20 0 HIADRP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(-c4cccc(C(F)(F)F)c4)o3)C2)CC1 ZINC000540996845 939427769 /nfs/dbraw/zinc/42/77/69/939427769.db2.gz PURLVHCXRZRJFY-IBGZPJMESA-N 2 0 407.480 4.177 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]C2CC(c3ccc(F)cc3)C2)c1)C1CCOCC1 ZINC000541245903 939487421 /nfs/dbraw/zinc/48/74/21/939487421.db2.gz DXHWDBMWZZZLBN-UHFFFAOYSA-N 2 0 412.549 4.351 20 0 HIADRP Brc1cncc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000541328733 939491006 /nfs/dbraw/zinc/49/10/06/939491006.db2.gz QQRKRRRKDSTNTJ-UHFFFAOYSA-N 2 0 400.364 4.332 20 0 HIADRP CCN1CC[C@@H]([NH2+]Cc2cn(-c3cc[nH+]cc3)nc2C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000541377667 939500871 /nfs/dbraw/zinc/50/08/71/939500871.db2.gz HGVORXAXYJERIA-FGZHOGPDSA-N 2 0 413.928 4.293 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]C3CC(c4ccc(Cl)cc4)C3)c2)C1 ZINC000541541698 939548600 /nfs/dbraw/zinc/54/86/00/939548600.db2.gz SJSMOJQZJCGILO-ZJOBEGKPSA-N 2 0 411.977 4.073 20 0 HIADRP Cc1cc([C@H]([NH2+]CCc2ccc(OCC[NH+](C)C)cc2)c2cccnc2)ccc1F ZINC000541544616 939549655 /nfs/dbraw/zinc/54/96/55/939549655.db2.gz XULOPYLPXQIOGX-VWLOTQADSA-N 2 0 407.533 4.391 20 0 HIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)N1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000541574070 939558337 /nfs/dbraw/zinc/55/83/37/939558337.db2.gz HBDINDGJDAZJPA-MRXNPFEDSA-N 2 0 413.528 4.295 20 0 HIADRP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000541785556 939629462 /nfs/dbraw/zinc/62/94/62/939629462.db2.gz WJRHSENRWAQDNF-HBMCJLEFSA-N 2 0 414.638 4.036 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](c3ccccc3)c3ccc(Cl)cc3)cn2)CC1 ZINC000541844438 939646455 /nfs/dbraw/zinc/64/64/55/939646455.db2.gz MZMQZLBAWXKKQW-XMMPIXPASA-N 2 0 406.961 4.366 20 0 HIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c1 ZINC000541917994 939653838 /nfs/dbraw/zinc/65/38/38/939653838.db2.gz KDKQDNBTZODGDT-YLJYHZDGSA-N 2 0 404.501 4.404 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)CC1 ZINC000542085860 939705543 /nfs/dbraw/zinc/70/55/43/939705543.db2.gz SHJSPZVWOAMGHJ-IFMALSPDSA-N 2 0 406.659 4.183 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000542474824 939829399 /nfs/dbraw/zinc/82/93/99/939829399.db2.gz OLWHJKBQAKMIHR-RUZDIDTESA-N 2 0 406.549 4.081 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000542477660 939829795 /nfs/dbraw/zinc/82/97/95/939829795.db2.gz ONHWXRARZDNNKO-VQTJNVASSA-N 2 0 410.558 4.321 20 0 HIADRP C[C@H]([NH2+]C[C@@H](O)Cn1c2ccccc2c2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542534728 939839323 /nfs/dbraw/zinc/83/93/23/939839323.db2.gz WBXWXCOHYJEXMW-JAXLGGSGSA-N 2 0 405.586 4.398 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccccc3OCc3ccccc3)CC2)CC1 ZINC000542688554 939854232 /nfs/dbraw/zinc/85/42/32/939854232.db2.gz CXASPKOLJFMYIJ-UHFFFAOYSA-N 2 0 407.602 4.115 20 0 HIADRP Cc1cc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)ccc1Oc1cccnc1 ZINC000542689155 939854380 /nfs/dbraw/zinc/85/43/80/939854380.db2.gz PWTHWKFFKACNEM-UHFFFAOYSA-N 2 0 408.590 4.032 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(C)[C@@H](C)C1CC[NH+](C)CC1)c1ccccc1Cl ZINC000542726009 939857172 /nfs/dbraw/zinc/85/71/72/939857172.db2.gz HLBMBOJTPADVDW-UWJYYQICSA-N 2 0 409.018 4.095 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cnn1-c1ccc(F)cc1 ZINC000542849011 939862858 /nfs/dbraw/zinc/86/28/58/939862858.db2.gz JALHYIHVIODYEX-MHECFPHRSA-N 2 0 422.548 4.127 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000543118437 939955026 /nfs/dbraw/zinc/95/50/26/939955026.db2.gz HFHPKXLUOQINSW-RUZDIDTESA-N 2 0 405.586 4.409 20 0 HIADRP CC1(C(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)CC[NH+](Cc2ccccc2)CC1 ZINC000543416783 940058336 /nfs/dbraw/zinc/05/83/36/940058336.db2.gz DQDRJXNCXFRALB-OAQYLSRUSA-N 2 0 411.615 4.304 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(-c2ccccc2)s1 ZINC000543594022 940124311 /nfs/dbraw/zinc/12/43/11/940124311.db2.gz FUIDKMLLFNMTOC-FQEVSTJZSA-N 2 0 421.614 4.458 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cnn1-c1cc(C)ccc1C ZINC000543776318 940182189 /nfs/dbraw/zinc/18/21/89/940182189.db2.gz FZZOEDGVFFODBI-RDPSFJRHSA-N 2 0 418.585 4.215 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(OC(F)F)cc1 ZINC000543775250 940182302 /nfs/dbraw/zinc/18/23/02/940182302.db2.gz JJWOAWHNGKARFO-IRLDBZIGSA-N 2 0 404.501 4.486 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(OC(F)F)cc1 ZINC000543775252 940182737 /nfs/dbraw/zinc/18/27/37/940182737.db2.gz JJWOAWHNGKARFO-RBBKRZOGSA-N 2 0 404.501 4.486 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000543776958 940183113 /nfs/dbraw/zinc/18/31/13/940183113.db2.gz RASMRMSTQAPQQA-OXJNMPFZSA-N 2 0 408.464 4.045 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000543776960 940183145 /nfs/dbraw/zinc/18/31/45/940183145.db2.gz RASMRMSTQAPQQA-OXQOHEQNSA-N 2 0 408.464 4.045 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2Br ZINC000543777217 940183233 /nfs/dbraw/zinc/18/32/33/940183233.db2.gz PWAMWXGUQJWVOA-XMSQKQJNSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(Br)s1 ZINC000543777907 940184209 /nfs/dbraw/zinc/18/42/09/940184209.db2.gz XNUVOVBWJYBBAZ-PBHICJAKSA-N 2 0 409.393 4.318 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+](CC(=O)N(C)Cc2ccc(Cl)s2)CC1 ZINC000543876223 940221667 /nfs/dbraw/zinc/22/16/67/940221667.db2.gz VSZXPJDVMBBRBG-UHFFFAOYSA-N 2 0 400.032 4.194 20 0 HIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000543998490 940291239 /nfs/dbraw/zinc/29/12/39/940291239.db2.gz LRSMYSQYOJSIPK-ZIAGYGMSSA-N 2 0 405.892 4.397 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000544357684 940399807 /nfs/dbraw/zinc/39/98/07/940399807.db2.gz WUSHMHCNFZEEFF-NOZRDPDXSA-N 2 0 407.533 4.290 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+][C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)CC1 ZINC000544596898 940487272 /nfs/dbraw/zinc/48/72/72/940487272.db2.gz ZKWQWQPQLOWAPL-ILBGXUMGSA-N 2 0 411.565 4.368 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]C/C=C/c2ccc(F)cc2F)c1)C1CCOCC1 ZINC000544607778 940489619 /nfs/dbraw/zinc/48/96/19/940489619.db2.gz DRJAISKAZIGCLO-HWKANZROSA-N 2 0 416.512 4.257 20 0 HIADRP C[NH+](C)CC1(C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)CCCC1 ZINC000544710777 940505701 /nfs/dbraw/zinc/50/57/01/940505701.db2.gz OVASAEINHWJBMZ-UHFFFAOYSA-N 2 0 403.574 4.205 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000545459410 940570917 /nfs/dbraw/zinc/57/09/17/940570917.db2.gz VPIMEPZHPNKHOH-RBZQAINGSA-N 2 0 413.993 4.376 20 0 HIADRP CC[NH+](CC)C[C@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000563977638 945333761 /nfs/dbraw/zinc/33/37/61/945333761.db2.gz FFBIYQYNOVTPAF-PHASAHSISA-N 2 0 421.029 4.283 20 0 HIADRP CCN(C(=O)C1CC[NH+](Cc2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000546199155 940727722 /nfs/dbraw/zinc/72/77/22/940727722.db2.gz AJFMANYMCUOOKK-VWLOTQADSA-N 2 0 405.586 4.022 20 0 HIADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(N2CCOCC2)c1 ZINC000564007638 945346325 /nfs/dbraw/zinc/34/63/25/945346325.db2.gz KDGOFWWBGFDPBM-VWNXMTODSA-N 2 0 407.602 4.476 20 0 HIADRP C[NH+](C)CCOc1ccccc1-c1noc([C@@H]2CCC[N@H+](Cc3ccccc3)C2)n1 ZINC000547109753 941000228 /nfs/dbraw/zinc/00/02/28/941000228.db2.gz NVXLSBXXCQRLQV-HXUWFJFHSA-N 2 0 406.530 4.057 20 0 HIADRP C[N@H+](CCC(=O)Nc1ccc(NC(=O)C[NH+]2CCCCCC2)cc1)C1CCCCC1 ZINC000548061374 941084810 /nfs/dbraw/zinc/08/48/10/941084810.db2.gz NUHWIEMLZDZHPW-UHFFFAOYSA-N 2 0 414.594 4.094 20 0 HIADRP O=C(NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)c1ccc(C[NH+]2CCCC2)cc1 ZINC000548079759 941085830 /nfs/dbraw/zinc/08/58/30/941085830.db2.gz SOXLQWOENPKVDJ-UHFFFAOYSA-N 2 0 411.977 4.330 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(COC2CCOCC2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483860 941107801 /nfs/dbraw/zinc/10/78/01/941107801.db2.gz KNXUBLIFVWAQEL-SQJMNOBHSA-N 2 0 408.586 4.382 20 0 HIADRP C[NH+](C)CCOc1ccc(NC(=O)c2ccc(C[NH+]3CCCC3)cc2)cc1Cl ZINC000549035862 941146633 /nfs/dbraw/zinc/14/66/33/941146633.db2.gz BYVSUQQAPNXNGC-UHFFFAOYSA-N 2 0 401.938 4.129 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)C2CC[NH+](C3CC3)CC2)cc1)C[C@@H]1CCCCO1 ZINC000549260166 941174838 /nfs/dbraw/zinc/17/48/38/941174838.db2.gz OAZZNWZNZDRFIN-DEOSSOPVSA-N 2 0 413.606 4.279 20 0 HIADRP C[C@@H](c1ccc(F)cc1)N1CC[C@H](N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)C1=O ZINC000549446485 941190859 /nfs/dbraw/zinc/19/08/59/941190859.db2.gz SUUJZZNNECMEFL-NVJIOZQYSA-N 2 0 401.570 4.074 20 0 HIADRP Clc1cccc(N2CCOCC2)c1C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000549686889 941204521 /nfs/dbraw/zinc/20/45/21/941204521.db2.gz FYSNFYYZFYUBRM-UHFFFAOYSA-N 2 0 413.993 4.452 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+]([C@@H]2CCN([C@@H](C)c3ccc(F)cc3)C2=O)CC1 ZINC000549932069 941241679 /nfs/dbraw/zinc/24/16/79/941241679.db2.gz PFBGCNQPSIMCKJ-WMZHIEFXSA-N 2 0 403.586 4.322 20 0 HIADRP Brc1ccccc1CN1CCC([NH2+]CCCCC[NH+]2CCCC2)CC1 ZINC000550265607 941306343 /nfs/dbraw/zinc/30/63/43/941306343.db2.gz SXMVCMHQUOFQLB-UHFFFAOYSA-N 2 0 408.428 4.269 20 0 HIADRP CCCOc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000550269985 941306931 /nfs/dbraw/zinc/30/69/31/941306931.db2.gz DMBMUIBTTDBTSP-DEOSSOPVSA-N 2 0 408.586 4.494 20 0 HIADRP CC(C)[C@]1(CO)CCC[N@H+](Cc2ccc(C[NH+]3CCC[C@](CO)(C(C)C)C3)cc2)C1 ZINC000550433607 941326632 /nfs/dbraw/zinc/32/66/32/941326632.db2.gz MQWDTQGKIZUZLF-WMPKNSHKSA-N 2 0 416.650 4.148 20 0 HIADRP C[N@@H+]1CCCC[C@H]1CN1CC[NH+](CC(Cc2ccccc2)Cc2ccccc2)CC1 ZINC000550954388 941386134 /nfs/dbraw/zinc/38/61/34/941386134.db2.gz PDFQMCVIKIIIMY-MHZLTWQESA-N 2 0 405.630 4.190 20 0 HIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551265288 941439389 /nfs/dbraw/zinc/43/93/89/941439389.db2.gz SGHSPRGOSPXOBP-XUZZJYLKSA-N 2 0 424.560 4.340 20 0 HIADRP Cc1ccnc(-c2n[nH]c([C@H](C)[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)n2)c1 ZINC000551277248 941442157 /nfs/dbraw/zinc/44/21/57/941442157.db2.gz BUAIJXXJLIVEHU-PELRDEGISA-N 2 0 404.562 4.269 20 0 HIADRP COCC[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000551423568 941476390 /nfs/dbraw/zinc/47/63/90/941476390.db2.gz LYRLVZGMSLPPEN-FQEVSTJZSA-N 2 0 402.410 4.077 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(Br)cc3F)cc2)CC1 ZINC000551581320 941506432 /nfs/dbraw/zinc/50/64/32/941506432.db2.gz IJKQWOKORGRJHD-UHFFFAOYSA-N 2 0 407.327 4.351 20 0 HIADRP COC1CCN(C(C)(C)C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000552043512 941572566 /nfs/dbraw/zinc/57/25/66/941572566.db2.gz PZAMOGKJTXLABX-QLBJFCOMSA-N 2 0 413.650 4.156 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000552050723 941574349 /nfs/dbraw/zinc/57/43/49/941574349.db2.gz PYSRZORKLKOMIT-QRVBRYPASA-N 2 0 407.558 4.346 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1cccc(C(F)(F)F)c1 ZINC000552757102 941753849 /nfs/dbraw/zinc/75/38/49/941753849.db2.gz XABWRUKEFOBBPN-NRFANRHFSA-N 2 0 421.507 4.484 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H](C)C(C)(C)c2ccccc2)CC1 ZINC000552946985 941806311 /nfs/dbraw/zinc/80/63/11/941806311.db2.gz FDPCCNXKOJOIMR-OAQYLSRUSA-N 2 0 407.602 4.032 20 0 HIADRP COCCC[NH+]1CCC([NH2+][C@@H]2c3cc(Br)ccc3SC[C@H]2C)CC1 ZINC000553293925 941862278 /nfs/dbraw/zinc/86/22/78/941862278.db2.gz QCROPVWMJZSKCW-KUHUBIRLSA-N 2 0 413.425 4.323 20 0 HIADRP CN(C)C(=O)c1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)[nH]1 ZINC000554937602 942325949 /nfs/dbraw/zinc/32/59/49/942325949.db2.gz LLQSKQMMEZCCIH-MIMBSXMBSA-N 2 0 414.981 4.074 20 0 HIADRP C[N@@H+]1CCCC[C@@H]1CN1CC[NH+](CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000555335248 942481551 /nfs/dbraw/zinc/48/15/51/942481551.db2.gz DSRWOVWTCHSGBX-XMMPIXPASA-N 2 0 413.556 4.199 20 0 HIADRP COc1cc(OC)cc(C2(F)CC[NH+](Cc3cn(-c4cc[nH+]cc4)nc3C)CC2)c1 ZINC000555339512 942483933 /nfs/dbraw/zinc/48/39/33/942483933.db2.gz AMKIQXMHIBTYFW-UHFFFAOYSA-N 2 0 410.493 4.054 20 0 HIADRP CC[C@H](C(=O)Nc1cccc(C[NH+]2CCSCC2)c1C)[N@H+](C)Cc1ccccc1 ZINC000555548633 942638869 /nfs/dbraw/zinc/63/88/69/942638869.db2.gz DNITVFMCUZFCKE-HSZRJFAPSA-N 2 0 411.615 4.393 20 0 HIADRP CC[C@@H](C(=O)Nc1cccc(C[NH+]2CCSCC2)c1C)[N@H+](C)Cc1ccccc1 ZINC000555548634 942638896 /nfs/dbraw/zinc/63/88/96/942638896.db2.gz DNITVFMCUZFCKE-QHCPKHFHSA-N 2 0 411.615 4.393 20 0 HIADRP Fc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c2ncccc12 ZINC000555617815 942672183 /nfs/dbraw/zinc/67/21/83/942672183.db2.gz WJFHKAUCNAEVDP-JOCHJYFZSA-N 2 0 419.544 4.392 20 0 HIADRP CN1CC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000557337028 943076907 /nfs/dbraw/zinc/07/69/07/943076907.db2.gz ZDABOOFQVPSRPU-VPUSJEBWSA-N 2 0 421.629 4.483 20 0 HIADRP CCC[N@H+](C)[C@@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)c1ccc(Cl)cc1 ZINC000557810110 943299053 /nfs/dbraw/zinc/29/90/53/943299053.db2.gz XCJNBNXCPDLBNI-FQEVSTJZSA-N 2 0 409.018 4.285 20 0 HIADRP C[C@H](c1ccc(F)cc1)N1CC[C@H]([NH+]2CCC(CCC[NH+]3CCCC3)CC2)C1=O ZINC000559145601 943853587 /nfs/dbraw/zinc/85/35/87/943853587.db2.gz MVHOYFOEMIFVEY-XXBNENTESA-N 2 0 401.570 4.076 20 0 HIADRP COc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c(C)c1OC ZINC000559326936 943897098 /nfs/dbraw/zinc/89/70/98/943897098.db2.gz SSGODIPYBWUONE-HSZRJFAPSA-N 2 0 424.585 4.031 20 0 HIADRP CC(C)Oc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000559333322 943898036 /nfs/dbraw/zinc/89/80/36/943898036.db2.gz ZERSOSUXJBFISW-XMMPIXPASA-N 2 0 408.586 4.492 20 0 HIADRP C[NH+](C)CCCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ccc2c[nH+]cn2c1 ZINC000559492074 943981087 /nfs/dbraw/zinc/98/10/87/943981087.db2.gz VLXIFLDTKLXRQJ-UHFFFAOYSA-N 2 0 405.329 4.235 20 0 HIADRP COc1ccsc1[C@@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000559892576 944077888 /nfs/dbraw/zinc/07/78/88/944077888.db2.gz KNEWVGZBMWOFLL-UYAOXDASSA-N 2 0 400.588 4.336 20 0 HIADRP COc1ccsc1[C@@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000559892574 944077925 /nfs/dbraw/zinc/07/79/25/944077925.db2.gz KNEWVGZBMWOFLL-QUCCMNQESA-N 2 0 400.588 4.336 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cc(Cl)c4c(c3)OCCCO4)cc2)CC1 ZINC000560071864 944149308 /nfs/dbraw/zinc/14/93/08/944149308.db2.gz IHYXSMMRABRFOH-UHFFFAOYSA-N 2 0 416.949 4.264 20 0 HIADRP COc1cc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)ccc1OC(F)F ZINC000560094935 944157412 /nfs/dbraw/zinc/15/74/12/944157412.db2.gz MHQAZJLWAWLSKT-UHFFFAOYSA-N 2 0 406.473 4.059 20 0 HIADRP O=C(NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1C[N@@H+](Cc2ccccc2)CCC1(F)F ZINC000560553482 944252690 /nfs/dbraw/zinc/25/26/90/944252690.db2.gz URTSMXXMUHFEQZ-QFIPXVFZSA-N 2 0 419.560 4.057 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(C(F)(F)F)c1 ZINC000561242443 944525494 /nfs/dbraw/zinc/52/54/94/944525494.db2.gz UATAJLOMMHMYQV-XNMUZJSGSA-N 2 0 411.512 4.172 20 0 HIADRP C[C@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000561502690 944640664 /nfs/dbraw/zinc/64/06/64/944640664.db2.gz SORSEMMPOMZLPR-RDPSFJRHSA-N 2 0 412.622 4.219 20 0 HIADRP CC[NH+](CC)CCOc1ccc(NC(=O)N2CC[NH+](C3CCC(C)CC3)CC2)cc1 ZINC000561846413 944820299 /nfs/dbraw/zinc/82/02/99/944820299.db2.gz WLPBMHCZMMVGAX-UHFFFAOYSA-N 2 0 416.610 4.135 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)cc2)CC1 ZINC000564744238 945744786 /nfs/dbraw/zinc/74/47/86/945744786.db2.gz MPKNRYJTILXCAF-QEIWAGNOSA-N 3 0 419.613 4.445 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]C[C@H]4CC[C@@H](c5nc(C6CC6)no5)O4)[C@@H]3C2)cc1 ZINC000565673201 945864377 /nfs/dbraw/zinc/86/43/77/945864377.db2.gz CDRSJZOOMPGPTH-NQQQLTFYSA-N 2 0 422.573 4.057 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)cc1 ZINC000565812632 945890484 /nfs/dbraw/zinc/89/04/84/945890484.db2.gz REQLVXBELWJSCV-UHFFFAOYSA-N 2 0 423.601 4.144 20 0 HIADRP CSc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)cc1F ZINC000566587398 946049184 /nfs/dbraw/zinc/04/91/84/946049184.db2.gz HKIDVBJRIFWYLE-JXFKEZNVSA-N 2 0 415.578 4.096 20 0 HIADRP Fc1ccc([C@@H]2CC[NH+](CC3(C[N@H+]4CC[C@@H](c5ccc(F)cc5)C4)COC3)C2)cc1 ZINC000566994369 946205361 /nfs/dbraw/zinc/20/53/61/946205361.db2.gz WUBOUBONGWWVTB-FGZHOGPDSA-N 2 0 412.524 4.260 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000568494512 946572288 /nfs/dbraw/zinc/57/22/88/946572288.db2.gz PIYVHYGJSUMSGH-YKSBVNFPSA-N 2 0 408.590 4.432 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000568494511 946572770 /nfs/dbraw/zinc/57/27/70/946572770.db2.gz PIYVHYGJSUMSGH-RDPSFJRHSA-N 2 0 408.590 4.432 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H]1CCSc2ccc(Br)cc21 ZINC000568744113 946678462 /nfs/dbraw/zinc/67/84/62/946678462.db2.gz YKLRZFJQZBWEAS-KRWDZBQOSA-N 2 0 422.392 4.111 20 0 HIADRP CCOc1cc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc(Br)c1OC ZINC000569507808 946881831 /nfs/dbraw/zinc/88/18/31/946881831.db2.gz HQEJHHRJGKTRJP-KRWDZBQOSA-N 2 0 411.384 4.020 20 0 HIADRP CC(C)(C)[C@H](CN1CCc2ccccc2C1)[NH2+]C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000569711679 946949563 /nfs/dbraw/zinc/94/95/63/946949563.db2.gz KGGDURHGKGMCQZ-OFVILXPXSA-N 2 0 419.613 4.211 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccccc2N2CCO[C@H](C)C2)C1 ZINC000570587589 947304520 /nfs/dbraw/zinc/30/45/20/947304520.db2.gz ZQUZNOSFKMWPHW-FGZHOGPDSA-N 2 0 407.602 4.433 20 0 HIADRP C[NH+]1CCN(C[C@@H]([NH2+][C@@H]2CCc3ccc(Br)cc32)c2ccccc2)CC1 ZINC000571890341 947807574 /nfs/dbraw/zinc/80/75/74/947807574.db2.gz POHRAEZEEJQDGX-FGZHOGPDSA-N 2 0 414.391 4.015 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000572440154 947905760 /nfs/dbraw/zinc/90/57/60/947905760.db2.gz SHKOJOSPGAREGL-VWLOTQADSA-N 2 0 402.586 4.391 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(=O)N(C)Cc1cccc(F)c1 ZINC000572867385 948025889 /nfs/dbraw/zinc/02/58/89/948025889.db2.gz OOLICMNIDHWZBQ-WOJBJXKFSA-N 2 0 411.565 4.194 20 0 HIADRP C[C@H](Cc1ccc(F)cc1Br)[NH2+]Cc1ccncc1OCCC[NH+](C)C ZINC000573671638 948272697 /nfs/dbraw/zinc/27/26/97/948272697.db2.gz SLIKYRVKWBHCLM-OAHLLOKOSA-N 2 0 424.358 4.035 20 0 HIADRP c1ccc(C[N@@H+]2CCc3nc(N4CC[C@@]5(C[NH2+]C[C@H]5c5ccccc5)C4)ccc3C2)cc1 ZINC001164618369 719044914 /nfs/dbraw/zinc/04/49/14/719044914.db2.gz AVVPIFMNMMODOK-LBNVMWSVSA-N 2 0 424.592 4.223 20 0 HIADRP CC(C)CN1c2ccccc2[C@H]2CN(c3cc(OC4CC[NH+](C)CC4)cc[nH+]3)CC[C@H]21 ZINC001165003997 722245768 /nfs/dbraw/zinc/24/57/68/722245768.db2.gz MEBSAVDKDAZUQX-ILBGXUMGSA-N 2 0 420.601 4.393 20 0 HIADRP Brc1cc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc2c1OCO2 ZINC000015580601 846065983 /nfs/dbraw/zinc/06/59/83/846065983.db2.gz XSPJHMWOIYLXEL-UHFFFAOYSA-N 2 0 417.347 4.454 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)o1 ZINC000042034029 848277028 /nfs/dbraw/zinc/27/70/28/848277028.db2.gz KMZFKYPDCRLRRD-UHFFFAOYSA-N 2 0 403.954 4.169 20 0 HIADRP O=C(NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)c1cccc(C[NH+]2CCCC2)c1 ZINC000049973304 849336969 /nfs/dbraw/zinc/33/69/69/849336969.db2.gz RQSJEDVYFNPBOR-UHFFFAOYSA-N 2 0 411.977 4.330 20 0 HIADRP c1csc(-c2nc(C[NH2+]CCCN3CC[NH+](Cc4ccccc4)CC3)cs2)c1 ZINC000058179054 850777658 /nfs/dbraw/zinc/77/76/58/850777658.db2.gz IMDNIFSHKMSKCS-UHFFFAOYSA-N 2 0 412.628 4.169 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000058216723 850783530 /nfs/dbraw/zinc/78/35/30/850783530.db2.gz GAHDMLXMALUSOX-QHCPKHFHSA-N 2 0 424.589 4.292 20 0 HIADRP CN(c1ccc(NC(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1)C1CC[NH+](C)CC1 ZINC000058820387 850938226 /nfs/dbraw/zinc/93/82/26/850938226.db2.gz IYQGZKLPLOBPJL-JOCHJYFZSA-N 2 0 420.601 4.068 20 0 HIADRP CC1CC[NH+](C[C@H]2CCCN(C(=O)[C@H]3CCC[N@H+](Cc4cccc(F)c4)C3)C2)CC1 ZINC000060275556 851058077 /nfs/dbraw/zinc/05/80/77/851058077.db2.gz BHFYXAGSZJLJPB-PKTZIBPZSA-N 2 0 415.597 4.008 20 0 HIADRP CC[C@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1ccc(Br)cc1Cl ZINC000437031141 862216597 /nfs/dbraw/zinc/21/65/97/862216597.db2.gz VUAWUQNHWPKQNG-KSSFIOAISA-N 2 0 402.808 4.169 20 0 HIADRP CC[C@@H]([NH2+][C@H](C)CCN1CC[NH+](C)CC1)c1ccc(Br)cc1Cl ZINC000437031143 862218030 /nfs/dbraw/zinc/21/80/30/862218030.db2.gz VUAWUQNHWPKQNG-RDTXWAMCSA-N 2 0 402.808 4.169 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)cc1 ZINC000060954477 851258043 /nfs/dbraw/zinc/25/80/43/851258043.db2.gz HIXXEGFBWFDCQK-YKSBVNFPSA-N 2 0 408.590 4.163 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NC2CC[NH+](Cc3ccccc3)CC2)[NH+]2CCCC2)cc1 ZINC000060971941 851263305 /nfs/dbraw/zinc/26/33/05/851263305.db2.gz MZHODPDGIHJVHY-RUZDIDTESA-N 2 0 420.601 4.096 20 0 HIADRP Brc1cccc(-c2ccc(C[NH2+]CCCC[NH+]3CCOCC3)s2)c1 ZINC000060979586 851266670 /nfs/dbraw/zinc/26/66/70/851266670.db2.gz XAUSQYKFDSHPNZ-UHFFFAOYSA-N 2 0 409.393 4.380 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)C1 ZINC000061141874 851303996 /nfs/dbraw/zinc/30/39/96/851303996.db2.gz FXWIKQNSLOCJJW-OFNKIYASSA-N 2 0 424.589 4.148 20 0 HIADRP O[C@H](COc1c(Cl)cccc1Cl)C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000061735379 851433684 /nfs/dbraw/zinc/43/36/84/851433684.db2.gz LCQWFLPRTCQLAH-SFHVURJKSA-N 2 0 415.405 4.321 20 0 HIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2cc(Br)ccc2OC(F)F)C[C@H](C)O1 ZINC000062253117 851517434 /nfs/dbraw/zinc/51/74/34/851517434.db2.gz RMFDVTDDXWKEOU-KBPBESRZSA-N 2 0 421.326 4.030 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000063464530 851695946 /nfs/dbraw/zinc/69/59/46/851695946.db2.gz GWRRDKNYUGROCR-RUZDIDTESA-N 2 0 422.617 4.240 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCCCC[N@H+]2CCCC[C@@H]2C)[NH+]2CCCC2)cc1 ZINC000064237166 851855439 /nfs/dbraw/zinc/85/54/39/851855439.db2.gz LSMLVTVJDRFYGZ-GMAHTHKFSA-N 2 0 400.611 4.086 20 0 HIADRP CCC(CC)[C@@H](CNC(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1)[NH+]1CCCC1 ZINC000064754692 851977926 /nfs/dbraw/zinc/97/79/26/851977926.db2.gz JWHOUZUQDOAJJI-DENIHFKCSA-N 2 0 420.667 4.160 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)[NH+](C)C)cc1 ZINC000065466919 852144031 /nfs/dbraw/zinc/14/40/31/852144031.db2.gz WTGKYHCPVVTVRM-DEOSSOPVSA-N 2 0 408.590 4.083 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000065931916 852322661 /nfs/dbraw/zinc/32/26/61/852322661.db2.gz BXGSUUOTZAQQPN-MRXNPFEDSA-N 2 0 411.384 4.212 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCC2)cc1)NC1CC[NH+](CC2CCCCC2)CC1 ZINC000066037523 852362343 /nfs/dbraw/zinc/36/23/43/852362343.db2.gz HNXMZNLSUQAQAY-UHFFFAOYSA-N 2 0 412.622 4.126 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NC[C@H](c2ccccc2OC)[NH+]2CCCC2)cc1 ZINC000106106384 852754111 /nfs/dbraw/zinc/75/41/11/852754111.db2.gz OXGQJFDGIYQTDO-HSZRJFAPSA-N 2 0 409.574 4.104 20 0 HIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ncc(Br)cc1Br ZINC000135275611 853374251 /nfs/dbraw/zinc/37/42/51/853374251.db2.gz XTOZXOSIPFKMFG-LBPRGKRZSA-N 2 0 407.194 4.207 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H](NC(=O)c1cccc(C[NH+]3CCCC3)c1)c1ccccc1O2 ZINC000195651819 853738681 /nfs/dbraw/zinc/73/86/81/853738681.db2.gz MCODRZVHPJFZHJ-HSZRJFAPSA-N 2 0 419.569 4.000 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)[C@@H](C)C1 ZINC000236865723 853929860 /nfs/dbraw/zinc/92/98/60/853929860.db2.gz RBLDDLAZENAVDK-FXAWDEMLSA-N 2 0 424.511 4.118 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+]Cc2ccc(-c3ccccc3Br)s2)CC1 ZINC000236945140 853941588 /nfs/dbraw/zinc/94/15/88/853941588.db2.gz QNNCIICLHDRYFE-UHFFFAOYSA-N 2 0 422.436 4.295 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2ccc(-c3ccc(Br)cc3)s2)CC1 ZINC000236973652 853944035 /nfs/dbraw/zinc/94/40/35/853944035.db2.gz PCJZNJLEMIPURJ-INIZCTEOSA-N 2 0 422.436 4.293 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2cnc(C(C)(C)C)s2)c1)C1CCOCC1 ZINC000237203874 853980989 /nfs/dbraw/zinc/98/09/89/853980989.db2.gz NCCUEGAJTYXTJU-UHFFFAOYSA-N 2 0 417.619 4.220 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2cccc3c2OC(C)(C)C3)c1)C1CCOCC1 ZINC000237205202 853982516 /nfs/dbraw/zinc/98/25/16/853982516.db2.gz FHQLMXSDFRDEGU-UHFFFAOYSA-N 2 0 424.585 4.180 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000237425537 854030810 /nfs/dbraw/zinc/03/08/10/854030810.db2.gz UXDAKUDFUPLJKI-OAHLLOKOSA-N 2 0 404.352 4.018 20 0 HIADRP Cc1csc(C[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)n1 ZINC000237639070 854065693 /nfs/dbraw/zinc/06/56/93/854065693.db2.gz JIUSRPAVQBGHDM-UHFFFAOYSA-N 2 0 412.525 4.162 20 0 HIADRP Cc1ccc(-c2ccc(C[NH2+]Cc3cccc(C[N@@H+]4CCC[C@H](C(N)=O)C4)c3)o2)cc1 ZINC000237727022 854084557 /nfs/dbraw/zinc/08/45/57/854084557.db2.gz CBIYDZADSHFXCF-QHCPKHFHSA-N 2 0 417.553 4.242 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2c(F)cccc2N2CCCC2)C[C@H](C)O1 ZINC000237775820 854094669 /nfs/dbraw/zinc/09/46/69/854094669.db2.gz PJLMJUGGQYWPKU-PMACEKPBSA-N 2 0 411.565 4.325 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2c(F)cccc2N2CCCC2)C[C@H](C)O1 ZINC000237775790 854094721 /nfs/dbraw/zinc/09/47/21/854094721.db2.gz PJLMJUGGQYWPKU-BGYRXZFFSA-N 2 0 411.565 4.325 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2C[NH2+]Cc2cnn(-c3ccc(Cl)cc3)c2)C[C@H](C)O1 ZINC000237779069 854096309 /nfs/dbraw/zinc/09/63/09/854096309.db2.gz DQJZBABNLLZWSZ-KDURUIRLSA-N 2 0 424.976 4.425 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3cccc(-c4ccccc4)c3)c2)C1 ZINC000237940674 854122723 /nfs/dbraw/zinc/12/27/23/854122723.db2.gz FVGHMDDOCVFZHT-SANMLTNESA-N 2 0 413.565 4.341 20 0 HIADRP O=C(CC[NH+]1CCC(C[NH+]2CCCC2)CC1)N[C@@H](c1cccs1)c1ccccc1 ZINC000261456189 854268990 /nfs/dbraw/zinc/26/89/90/854268990.db2.gz ZLPXWYXBRQAHOW-XMMPIXPASA-N 2 0 411.615 4.152 20 0 HIADRP c1nc(NC2CC[NH+](C3CCCC3)CC2)cc(NC2CC[NH+](C3CCCC3)CC2)n1 ZINC000302284200 854559195 /nfs/dbraw/zinc/55/91/95/854559195.db2.gz LCYFEZFUYGQTAD-UHFFFAOYSA-N 2 0 412.626 4.114 20 0 HIADRP C[C@@H](NC(=O)[C@@H](C)[NH+]1CCC(C[NH+]2CCCC2)CC1)c1ccc(Cl)cc1Cl ZINC000303054377 854740585 /nfs/dbraw/zinc/74/05/85/854740585.db2.gz JZKDGQSLSXUGIQ-HZPDHXFCSA-N 2 0 412.405 4.367 20 0 HIADRP C[N@H+](CCCNC(=O)NC1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1)Cc1ccccc1 ZINC000303454818 854954508 /nfs/dbraw/zinc/95/45/08/854954508.db2.gz JQHXHYAIRVOUQL-QILAJZQNSA-N 2 0 420.601 4.003 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC000303639314 855095641 /nfs/dbraw/zinc/09/56/41/855095641.db2.gz HNHZOHDECYHWLK-BHIFYINESA-N 2 0 414.638 4.269 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)CC1 ZINC000303639320 855095913 /nfs/dbraw/zinc/09/59/13/855095913.db2.gz HNHZOHDECYHWLK-YPAWHYETSA-N 2 0 414.638 4.269 20 0 HIADRP C[C@@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309805431 855363908 /nfs/dbraw/zinc/36/39/08/855363908.db2.gz UFGNIXHSRZCZCL-CZAYHTPWSA-N 2 0 401.595 4.132 20 0 HIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cccc(I)c2)cc1 ZINC000318951019 855385470 /nfs/dbraw/zinc/38/54/70/855385470.db2.gz CYYOAHVGFIYSTD-UHFFFAOYSA-N 2 0 408.327 4.423 20 0 HIADRP C[C@H](CC[NH2+]C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C)[N@H+](C)Cc1ccccc1 ZINC000379615799 855423817 /nfs/dbraw/zinc/42/38/17/855423817.db2.gz BCOPMPJVTMMNEE-VEEZFSHISA-N 2 0 401.595 4.417 20 0 HIADRP C[C@H]([NH2+]C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381779469 855431645 /nfs/dbraw/zinc/43/16/45/855431645.db2.gz YKNOPYYLGAHRPP-BVSLBCMMSA-N 2 0 401.595 4.134 20 0 HIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381878462 855432765 /nfs/dbraw/zinc/43/27/65/855432765.db2.gz NVHSSGIKOSMSSM-DNKMKRHMSA-N 2 0 413.606 4.417 20 0 HIADRP CC(C)(C)OC(=O)N1CCC([NH2+][C@H]2CCN(Cc3ccccc3)CC2(C)C)CC1 ZINC000390721465 855456407 /nfs/dbraw/zinc/45/64/07/855456407.db2.gz ZKURPAJWIGIALJ-NRFANRHFSA-N 2 0 401.595 4.276 20 0 HIADRP C[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(F)c(Br)c1 ZINC000397626177 855472830 /nfs/dbraw/zinc/47/28/30/855472830.db2.gz YBJOFWWNZCPUNK-INIZCTEOSA-N 2 0 421.354 4.266 20 0 HIADRP OC1(C[NH2+][C@@H]2CCc3ccc(Br)cc32)CC[NH+](Cc2ccccc2)CC1 ZINC000397587792 855472922 /nfs/dbraw/zinc/47/29/22/855472922.db2.gz HYWJPONCZZHWGG-OAQYLSRUSA-N 2 0 415.375 4.053 20 0 HIADRP C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CN1C(=O)OC(C)(C)C ZINC000399221211 855478660 /nfs/dbraw/zinc/47/86/60/855478660.db2.gz BYXNPBRLQYBLES-DENIHFKCSA-N 2 0 401.595 4.276 20 0 HIADRP CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]([NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)C[C@@H]2C1 ZINC000401122386 855479755 /nfs/dbraw/zinc/47/97/55/855479755.db2.gz KCNNSGYDLNEPNZ-GPJHCHHRSA-N 2 0 413.606 4.134 20 0 HIADRP CC(C)(C)OC(=O)N[C@@H]1C[C@H]([NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)C1(C)C ZINC000404887184 855481571 /nfs/dbraw/zinc/48/15/71/855481571.db2.gz GAFZOHLXMTVYHB-DCLXLUIPSA-N 2 0 401.595 4.180 20 0 HIADRP CSc1ccccc1[C@@H](C)[NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000409848379 855685494 /nfs/dbraw/zinc/68/54/94/855685494.db2.gz CPBVJKUJHYSSFX-MOPGFXCFSA-N 2 0 411.615 4.228 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000410313749 855922522 /nfs/dbraw/zinc/92/25/22/855922522.db2.gz WTCZWQKAIZCQPP-VWLOTQADSA-N 2 0 422.617 4.076 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NCc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)C1 ZINC000410337763 855936668 /nfs/dbraw/zinc/93/66/68/855936668.db2.gz PSCNBOBLAYSWRI-YADHBBJMSA-N 2 0 414.638 4.372 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NCc2cccc(C[NH+](C)C)c2)cc1 ZINC000410340108 855937594 /nfs/dbraw/zinc/93/75/94/855937594.db2.gz MAUYXLAJPTXEIT-FQEVSTJZSA-N 2 0 408.590 4.122 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NC[C@@H](c3ccsc3)[NH+](C)C)cc2)CC1 ZINC000410341216 855938295 /nfs/dbraw/zinc/93/82/95/855938295.db2.gz UTUUZBZDUYKHRI-QFIPXVFZSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCNC(=O)NCc1ccc(C[NH+]2CCCC[C@@H]2C)cc1 ZINC000410346192 855940147 /nfs/dbraw/zinc/94/01/47/855940147.db2.gz UODFTPZHHYZHNV-RTWAWAEBSA-N 2 0 400.611 4.125 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000410372488 855957891 /nfs/dbraw/zinc/95/78/91/855957891.db2.gz NRJDEZPREKSPMQ-DEOSSOPVSA-N 2 0 408.590 4.163 20 0 HIADRP COCC1(C[NH2+][C@H](CCC[NH+]2CCC(C)CC2)c2ccc(F)cc2)CCOCC1 ZINC000425930374 856005238 /nfs/dbraw/zinc/00/52/38/856005238.db2.gz WTMSCFXQPBXZNH-HSZRJFAPSA-N 2 0 406.586 4.412 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)Nc1ccc(OCC[NH+]2CCCCC2)cc1)c1cccs1 ZINC000426162473 856147373 /nfs/dbraw/zinc/14/73/73/856147373.db2.gz RVDBTJSZJLFEKX-HXUWFJFHSA-N 2 0 416.591 4.037 20 0 HIADRP FC(F)(F)CN1CC[C@H](C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000428216369 857115346 /nfs/dbraw/zinc/11/53/46/857115346.db2.gz FKXXOTDFUKPQNJ-CLAROIROSA-N 2 0 409.540 4.151 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)NCC2CC[NH+](C3CC3)CC2)cc1 ZINC000428265724 857133367 /nfs/dbraw/zinc/13/33/67/857133367.db2.gz ZULIIEJLHKBYRI-UHFFFAOYSA-N 2 0 420.601 4.089 20 0 HIADRP C[N@H+](C[C@H](O)Cc1ccc(C(F)(F)F)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000437582093 862898252 /nfs/dbraw/zinc/89/82/52/862898252.db2.gz UDIONTZHHDFNAX-RBBKRZOGSA-N 2 0 406.492 4.063 20 0 HIADRP O=C(NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1)[C@@H]1CCC[N@@H+]1C1CC1 ZINC000429061549 857485362 /nfs/dbraw/zinc/48/53/62/857485362.db2.gz CMILIKBLFJIZRZ-VWLOTQADSA-N 2 0 403.570 4.192 20 0 HIADRP Cc1cc(Br)cc(C)c1NC(=O)CCC[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000429544440 857734654 /nfs/dbraw/zinc/73/46/54/857734654.db2.gz YMQYWACETUOPFB-GOSISDBHSA-N 2 0 410.400 4.201 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CCCOc3cccc(Cl)c3)CC2)CC1 ZINC000430928006 858372778 /nfs/dbraw/zinc/37/27/78/858372778.db2.gz RYOKFHCVDKVTTG-UHFFFAOYSA-N 2 0 408.030 4.237 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NCC2CC[NH+](CCC(C)C)CC2)CC1 ZINC000431626891 858698458 /nfs/dbraw/zinc/69/84/58/858698458.db2.gz CPGPSESLIZMAEN-UHFFFAOYSA-N 2 0 414.638 4.017 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000431695026 858743926 /nfs/dbraw/zinc/74/39/26/858743926.db2.gz VXWCOSYSNKHUBE-AKIFATBCSA-N 2 0 424.589 4.159 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000431696606 858745025 /nfs/dbraw/zinc/74/50/25/858745025.db2.gz MAQAITJTIZKGSM-OFVILXPXSA-N 2 0 420.601 4.135 20 0 HIADRP C[C@@H]1C[N@H+](CCC[NH2+]Cc2cn(-c3ccccc3)nc2-c2cccs2)CCCO1 ZINC000432357690 859119215 /nfs/dbraw/zinc/11/92/15/859119215.db2.gz MRRTYCPDXRQIPP-LJQANCHMSA-N 2 0 410.587 4.191 20 0 HIADRP COc1ccc(C[C@H]([NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)c2ccc(OC)cc2)cc1 ZINC000432416214 859155102 /nfs/dbraw/zinc/15/51/02/859155102.db2.gz QAHFWYFMGFTGBV-NLFFAJNJSA-N 2 0 412.574 4.078 20 0 HIADRP COC[C@@H]1CCCC[N@H+](Cc2cc(C[NH+]3CCCC[C@H](COC)C3)cc(OC)c2)C1 ZINC000432784018 859358427 /nfs/dbraw/zinc/35/84/27/859358427.db2.gz DUQAEYIIFTZCJP-SZPZYZBQSA-N 2 0 418.622 4.192 20 0 HIADRP Cc1cc(-c2nnc(CN3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)o2)c(C)o1 ZINC000433172658 859552965 /nfs/dbraw/zinc/55/29/65/859552965.db2.gz GBNXTTOKOAZLFP-UHFFFAOYSA-N 2 0 406.530 4.435 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)[C@@H]2CCCC[NH+]2C2CCCC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000433368630 859659687 /nfs/dbraw/zinc/65/96/87/859659687.db2.gz UOEBDDXJKMSGDH-VOQZNFBZSA-N 2 0 421.988 4.385 20 0 HIADRP CN(C(=O)c1cccc(C[NH+]2CCCC2)c1)c1ccc(OCC[NH+]2CCCC2)cc1 ZINC000434642638 860443439 /nfs/dbraw/zinc/44/34/39/860443439.db2.gz KNXWNRWQGCXKPT-UHFFFAOYSA-N 2 0 407.558 4.034 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000467747661 881551724 /nfs/dbraw/zinc/55/17/24/881551724.db2.gz UHLNGOGRZHVXCE-INIZCTEOSA-N 2 0 412.525 4.415 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccc(Br)c1 ZINC000467842759 881683858 /nfs/dbraw/zinc/68/38/58/881683858.db2.gz DZAYRDNDJMCYTR-KRWDZBQOSA-N 2 0 402.380 4.047 20 0 HIADRP Cc1ccc(NC(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)c(OCC[NH+](C)C)c1 ZINC000438296367 863775700 /nfs/dbraw/zinc/77/57/00/863775700.db2.gz DANRRYQTSQZWNA-SFTDATJTSA-N 2 0 416.610 4.054 20 0 HIADRP O=C(C[NH2+][C@H](CCCc1ccccc1)c1ccccc1)NC1CC[NH+](C2CC2)CC1 ZINC000438768333 864262391 /nfs/dbraw/zinc/26/23/91/864262391.db2.gz DHHMKGCFPCZVLF-RUZDIDTESA-N 2 0 405.586 4.083 20 0 HIADRP C[NH+](C)CCN(Cc1cccs1)C(=O)NCc1ccccc1C[NH+]1CCCCC1 ZINC000439201013 864626286 /nfs/dbraw/zinc/62/62/86/864626286.db2.gz JFPKBEQNQCHWBP-UHFFFAOYSA-N 2 0 414.619 4.007 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000439593348 864914821 /nfs/dbraw/zinc/91/48/21/864914821.db2.gz GWNXAVVDBGWXEL-HSZRJFAPSA-N 2 0 423.944 4.460 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N1c2ccccc2C[C@H]1C ZINC000439595422 864917744 /nfs/dbraw/zinc/91/77/44/864917744.db2.gz JXLQMAOBGNPIBC-WOJBJXKFSA-N 2 0 417.553 4.368 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)cc1)C1CC1 ZINC000439739218 865070326 /nfs/dbraw/zinc/07/03/26/865070326.db2.gz MUTUHSCVTLQCPO-IBGZPJMESA-N 2 0 406.574 4.021 20 0 HIADRP CC(C)C[C@@H](CNC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)[NH2+][C@@H](C)c1ccccc1 ZINC000468023422 881857927 /nfs/dbraw/zinc/85/79/27/881857927.db2.gz AYZQBBGSFORPGM-TWNQGAOESA-N 2 0 400.611 4.066 20 0 HIADRP Cc1ccc(N[C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)cc1NC(=O)CC[NH+](C)C ZINC000468033855 881865835 /nfs/dbraw/zinc/86/58/35/881865835.db2.gz OYGITCMXHIYTLW-YFNKSVMNSA-N 2 0 420.601 4.208 20 0 HIADRP Cc1ccc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1NC(=O)CC[NH+](C)C ZINC000468039001 881869797 /nfs/dbraw/zinc/86/97/97/881869797.db2.gz NIXAREMRIIVUIW-REWPJTCUSA-N 2 0 408.590 4.350 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@H](c2ccccc2)c2ccccc2C)[C@H](C)C1 ZINC000440688522 865866740 /nfs/dbraw/zinc/86/67/40/865866740.db2.gz AGAJNZKMZCMLRI-PLKPRKFZSA-N 2 0 410.602 4.124 20 0 HIADRP C[NH+](C)CC1CCC(NC(=O)NCc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000440818078 865933870 /nfs/dbraw/zinc/93/38/70/865933870.db2.gz FZJOGTDJYBBUPT-UHFFFAOYSA-N 2 0 414.638 4.371 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2CCCCOc1cccc(C(F)(F)F)c1 ZINC000441267000 866341646 /nfs/dbraw/zinc/34/16/46/866341646.db2.gz OQWCXGSBISFRCC-MISYRCLQSA-N 2 0 400.485 4.048 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1(C)C ZINC000442872459 867707171 /nfs/dbraw/zinc/70/71/71/867707171.db2.gz JNSBFJALFZPJSN-GOSISDBHSA-N 2 0 419.038 4.457 20 0 HIADRP C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443596929 868152847 /nfs/dbraw/zinc/15/28/47/868152847.db2.gz BYOWZHWAXJQTLD-SFHVURJKSA-N 2 0 407.549 4.072 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+]Cc3ccc(Oc4cccc(F)c4)cc3)ccn2)CC1 ZINC000443983992 868508798 /nfs/dbraw/zinc/50/87/98/868508798.db2.gz RYQOXMBFDHJQGL-UHFFFAOYSA-N 2 0 406.505 4.055 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)c1 ZINC000443987327 868510399 /nfs/dbraw/zinc/51/03/99/868510399.db2.gz XMTUGKVXKXJIID-UHFFFAOYSA-N 2 0 421.516 4.199 20 0 HIADRP O=C(CC[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1)N[C@H](c1cccs1)c1ccccc1 ZINC000444214563 868670248 /nfs/dbraw/zinc/67/02/48/868670248.db2.gz RRQHTFDCQNIQCQ-YKSBVNFPSA-N 2 0 411.615 4.152 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)Nc2ccccc2CC[NH+](C)C)cc1 ZINC000446562714 870473899 /nfs/dbraw/zinc/47/38/99/870473899.db2.gz DCPLTURUAUDNRC-HXUWFJFHSA-N 2 0 408.590 4.487 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)Nc1ccccc1CC[NH+](C)C ZINC000446571719 870483027 /nfs/dbraw/zinc/48/30/27/870483027.db2.gz GTOLOAHZUPHKCS-JOCHJYFZSA-N 2 0 408.590 4.167 20 0 HIADRP C[C@H]1C[C@H](N(C)C(=O)Nc2ccccc2CC[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000446595980 870502970 /nfs/dbraw/zinc/50/29/70/870502970.db2.gz XSTYAIHLIAWTGZ-NZQKXSOJSA-N 2 0 408.590 4.308 20 0 HIADRP CC[C@H]([NH2+]C[C@H](C)N1CC[NH+](CC)CC1)c1ccc(Br)cc1Cl ZINC000446757459 870670867 /nfs/dbraw/zinc/67/08/67/870670867.db2.gz UKYFERUBZKLOPY-KSSFIOAISA-N 2 0 402.808 4.169 20 0 HIADRP Cc1ccc([C@H](CCn2cncn2)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000446757618 870670962 /nfs/dbraw/zinc/67/09/62/870670962.db2.gz VEVVIGQEENEBOA-VWLOTQADSA-N 2 0 403.574 4.220 20 0 HIADRP CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)c2ccccc21 ZINC000447584905 871489643 /nfs/dbraw/zinc/48/96/43/871489643.db2.gz HJQRLUYACKZKNI-JWQCQUIFSA-N 2 0 405.586 4.486 20 0 HIADRP OC[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1cc(F)c(F)c(F)c1 ZINC000447608106 871516762 /nfs/dbraw/zinc/51/67/62/871516762.db2.gz UKUIIKQNDBZTKL-NCYKPQTJSA-N 2 0 418.503 4.040 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N(C)[C@@H]2CC[NH+](CC)C[C@H]2C)c1 ZINC000448524492 872517466 /nfs/dbraw/zinc/51/74/66/872517466.db2.gz IOANNEJWNFWKFD-NFBKMPQASA-N 2 0 402.627 4.180 20 0 HIADRP CC[NH+]1CCC([NH2+]Cc2ccc(NC(=O)CCCOc3ccc(C)cc3)cc2)CC1 ZINC000461788674 874906022 /nfs/dbraw/zinc/90/60/22/874906022.db2.gz AWVBIXHMGUFOER-UHFFFAOYSA-N 2 0 409.574 4.367 20 0 HIADRP Fc1ccccc1CC(Cc1ccccc1F)[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000462121183 875222942 /nfs/dbraw/zinc/22/29/42/875222942.db2.gz WWYFAFXQTURQNU-IBGZPJMESA-N 2 0 414.540 4.209 20 0 HIADRP Fc1ccccc1CC(Cc1ccccc1F)[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000462121184 875223066 /nfs/dbraw/zinc/22/30/66/875223066.db2.gz WWYFAFXQTURQNU-LJQANCHMSA-N 2 0 414.540 4.209 20 0 HIADRP COc1ccccc1/C=C/C[NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000462722964 875800306 /nfs/dbraw/zinc/80/03/06/875800306.db2.gz CTQREGIJZHTNKI-FNORWQNLSA-N 2 0 419.491 4.269 20 0 HIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)(N2CCCCC2)CC1 ZINC000462740295 875811488 /nfs/dbraw/zinc/81/14/88/875811488.db2.gz ZIDGVOVXDMUGNT-UHFFFAOYSA-N 2 0 403.517 4.265 20 0 HIADRP CCOc1ccc(C2(C[NH2+]C3CC[NH+](CCc4ccccc4)CC3)CCOCC2)cc1 ZINC000463076438 876107915 /nfs/dbraw/zinc/10/79/15/876107915.db2.gz HBKJBVBOHVCYCC-UHFFFAOYSA-N 2 0 422.613 4.430 20 0 HIADRP C[C@@H]([NH2+]C1(CNC2CC[NH+](CCc3ccccc3)CC2)CCOCC1)c1ccccc1 ZINC000463119432 876162184 /nfs/dbraw/zinc/16/21/84/876162184.db2.gz ISORJWKZCSCGQF-HSZRJFAPSA-N 2 0 421.629 4.183 20 0 HIADRP C[N@H+](CCC(=O)Nc1ccc(Cl)cc1F)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464839781 878106333 /nfs/dbraw/zinc/10/63/33/878106333.db2.gz YZNJPFIIOHSRBL-SFHVURJKSA-N 2 0 403.929 4.262 20 0 HIADRP C[N@H+](C[C@H](O)COc1cc(Cl)ccc1Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464848693 878123614 /nfs/dbraw/zinc/12/36/14/878123614.db2.gz MTSYVHKCWKLJHE-QUCCMNQESA-N 2 0 423.384 4.187 20 0 HIADRP C[NH+](C)CCn1ccc2ccc(NC(=O)c3ccc(C[NH+]4CCCCC4)cc3)cc21 ZINC000465136298 878518993 /nfs/dbraw/zinc/51/89/93/878518993.db2.gz QACAIQKDUMHQKR-UHFFFAOYSA-N 2 0 404.558 4.441 20 0 HIADRP C[C@@H]1CC[N@H+](CCOc2ccc(NC(=O)[C@H]3CCC[NH+]3Cc3ccccc3)cc2)C1 ZINC000465201256 878606356 /nfs/dbraw/zinc/60/63/56/878606356.db2.gz UJMZHGUUTALDRV-HYBUGGRVSA-N 2 0 407.558 4.010 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNC(=O)N(C)CC[C@@H]2CCCC[NH+]2C)C1 ZINC000465540513 879000351 /nfs/dbraw/zinc/00/03/51/879000351.db2.gz LLJQDRMXEFCOHR-IMSXRSKXSA-N 2 0 414.638 4.180 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCc1ccccc1C[NH+]1CCC[C@H](C)C1)CC2 ZINC000465552860 879019272 /nfs/dbraw/zinc/01/92/72/879019272.db2.gz BMQJCBNGGAJCDH-ZTCOLXNVSA-N 2 0 412.622 4.075 20 0 HIADRP CCC(CC)[C@H](CNC(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[NH+]1CCCC1 ZINC000465564731 879036799 /nfs/dbraw/zinc/03/67/99/879036799.db2.gz IGOYKFOIESXZFQ-ONTIZHBOSA-N 2 0 420.667 4.331 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000503440879 912454899 /nfs/dbraw/zinc/45/48/99/912454899.db2.gz ZLUPNLDEFUPUKB-JOCHJYFZSA-N 2 0 414.638 4.180 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccsc1 ZINC000503448415 912471602 /nfs/dbraw/zinc/47/16/02/912471602.db2.gz XKQWAWXADBODJB-UNMCSNQZSA-N 2 0 420.667 4.429 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccsc1 ZINC000503448412 912471693 /nfs/dbraw/zinc/47/16/93/912471693.db2.gz XKQWAWXADBODJB-IFMALSPDSA-N 2 0 420.667 4.429 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)C1 ZINC000465927805 879591459 /nfs/dbraw/zinc/59/14/59/879591459.db2.gz QASLJLWGRRILOA-SFTDATJTSA-N 2 0 400.611 4.023 20 0 HIADRP O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000503505451 912553377 /nfs/dbraw/zinc/55/33/77/912553377.db2.gz UQTYIKZIKSTKDB-FCHUYYIVSA-N 2 0 416.610 4.104 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)CC1 ZINC000467349623 881105283 /nfs/dbraw/zinc/10/52/83/881105283.db2.gz XXHUEHSTGBLXLP-ITTUMRLJSA-N 2 0 403.586 4.214 20 0 HIADRP CC[C@@H]1C[C@@H](C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)CCO1 ZINC000503597984 912688484 /nfs/dbraw/zinc/68/84/84/912688484.db2.gz NUJOOYXEEUMSSA-BKMJKUGQSA-N 2 0 407.602 4.304 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@H](C)c2cnn(C(C)C)c2C)CC1 ZINC000469240327 883338622 /nfs/dbraw/zinc/33/86/22/883338622.db2.gz PTQIYXKLGWMHOT-QZTJIDSGSA-N 2 0 401.574 4.465 20 0 HIADRP CC(C)S(=O)(=O)c1ccc(C[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000469755428 883919786 /nfs/dbraw/zinc/91/97/86/883919786.db2.gz AHPVGCCGFGJRFB-WOJBJXKFSA-N 2 0 414.615 4.115 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C(=O)Nc3ccccc3)cc2)[C@H](C)C1 ZINC000469769262 883941987 /nfs/dbraw/zinc/94/19/87/883941987.db2.gz OHGRMPRDZRQQNM-HYBUGGRVSA-N 2 0 409.574 4.166 20 0 HIADRP C[NH+](C)CCn1ccc2ccc(NC(=O)[C@@H]3CCCC[N@@H+]3Cc3ccccc3)cc21 ZINC000469833172 884013504 /nfs/dbraw/zinc/01/35/04/884013504.db2.gz DKEFJFFDIKAORC-QHCPKHFHSA-N 2 0 404.558 4.196 20 0 HIADRP COc1ccc(C[C@@H](C)C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)cc1F ZINC000469950883 884151045 /nfs/dbraw/zinc/15/10/45/884151045.db2.gz RWSUPWIPAPCQQB-HXUWFJFHSA-N 2 0 419.629 4.141 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)CC1 ZINC000503725063 912810404 /nfs/dbraw/zinc/81/04/04/912810404.db2.gz JZTJDYHVRHQJAG-FQEVSTJZSA-N 2 0 402.627 4.269 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@H]([NH+]2CCCCC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000503723964 912810561 /nfs/dbraw/zinc/81/05/61/912810561.db2.gz HFVPURVVGLFEND-IRLDBZIGSA-N 2 0 400.611 4.166 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000503723996 912810609 /nfs/dbraw/zinc/81/06/09/912810609.db2.gz HQVJYAVOMHMCMS-IFMALSPDSA-N 2 0 400.611 4.166 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2C[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)cc1)C(C)C ZINC000471382653 886030701 /nfs/dbraw/zinc/03/07/01/886030701.db2.gz QVNLBEJFXDDLSX-PLQXJYEYSA-N 2 0 405.586 4.121 20 0 HIADRP CCN(CCC[NH+]1CCCC1)C(=O)NCc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000472097884 886891497 /nfs/dbraw/zinc/89/14/97/886891497.db2.gz ZWSVPFZBPRGYFC-OAQYLSRUSA-N 2 0 400.611 4.078 20 0 HIADRP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1cccc(OCc2ccccc2Cl)c1 ZINC000472143576 886940559 /nfs/dbraw/zinc/94/05/59/886940559.db2.gz FAFDBYZPIHFCCH-IBGZPJMESA-N 2 0 401.982 4.035 20 0 HIADRP CC[NH+]1CCN(c2cccc(NC(=O)NCC(C)(C)[NH2+][C@H](C)c3ccccc3)c2)CC1 ZINC000473828505 888661668 /nfs/dbraw/zinc/66/16/68/888661668.db2.gz JRSJSXUOOYKXNQ-HXUWFJFHSA-N 2 0 423.605 4.079 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)[C@@H]3C[C@H]3c3ccc(Cl)s3)cn2)CC1 ZINC000474484247 889345558 /nfs/dbraw/zinc/34/55/58/889345558.db2.gz HDARGUWOXQBFSL-BPQIPLTHSA-N 2 0 405.011 4.220 20 0 HIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000474820814 889675193 /nfs/dbraw/zinc/67/51/93/889675193.db2.gz HSDZBQKJVJGKAD-RTBURBONSA-N 2 0 400.636 4.328 20 0 HIADRP CC(C)c1nc2c([nH]1)C[C@H](C(=O)NCc1ccccc1C[N@@H+]1CCCC[C@H]1C)CC2 ZINC000474896436 889755059 /nfs/dbraw/zinc/75/50/59/889755059.db2.gz QJJWFRFWNUJGAP-RTBURBONSA-N 2 0 408.590 4.329 20 0 HIADRP CCN(C(=O)NCc1ccccc1C[NH+]1CCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475008008 889861035 /nfs/dbraw/zinc/86/10/35/889861035.db2.gz KOHVVJFVHRSKQJ-RUZDIDTESA-N 2 0 420.601 4.088 20 0 HIADRP Brc1ccccc1CN1CCC([NH2+]C2CC([NH+]3CCCCC3)C2)CC1 ZINC000475543856 890468886 /nfs/dbraw/zinc/46/88/86/890468886.db2.gz AEXKLJZGQFTOEL-UHFFFAOYSA-N 2 0 406.412 4.020 20 0 HIADRP CC[C@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479055458 894314421 /nfs/dbraw/zinc/31/44/21/894314421.db2.gz FUEFMAYTOAVOFV-GUYCJALGSA-N 2 0 422.333 4.145 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cc(F)ccc1F ZINC000479063772 894324262 /nfs/dbraw/zinc/32/42/62/894324262.db2.gz PIVLSUMINWWNMD-WMZHIEFXSA-N 2 0 415.528 4.149 20 0 HIADRP c1c2c(nn1-c1ccccc1)CCC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000479064566 894326450 /nfs/dbraw/zinc/32/64/50/894326450.db2.gz RXWNXOJDLJVUQX-RDGATRHJSA-N 2 0 400.570 4.404 20 0 HIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)cc1C(F)(F)F ZINC000479297298 894579265 /nfs/dbraw/zinc/57/92/65/894579265.db2.gz RFGOESIUDHTZFQ-DZGCQCFKSA-N 2 0 423.317 4.355 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@H](c2ccsc2)[NH+](C)C)CC1 ZINC000479447778 894765733 /nfs/dbraw/zinc/76/57/33/894765733.db2.gz CQISFPHMUMEJRV-GHTZIAJQSA-N 2 0 406.640 4.037 20 0 HIADRP C[C@H]([NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000479503157 894819810 /nfs/dbraw/zinc/81/98/10/894819810.db2.gz NOAYFSMOVZURTC-DZIBYMRMSA-N 3 0 413.528 4.083 20 0 HIADRP C[NH+]1CCN(CCC[NH2+][C@H](CCSc2ccccc2)c2ccc(F)cc2)CC1 ZINC000480169232 895557458 /nfs/dbraw/zinc/55/74/58/895557458.db2.gz WRVCYWYUXHQLQM-HSZRJFAPSA-N 2 0 401.595 4.276 20 0 HIADRP Cc1nn(Cc2ccccc2)c(C)c1C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000480432566 895825096 /nfs/dbraw/zinc/82/50/96/895825096.db2.gz ARBKULDCJZDDJM-IBGZPJMESA-N 2 0 406.574 4.339 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](C)c2cnn(-c3ccc(Cl)cc3Cl)c2C)CC1 ZINC000480600076 895963012 /nfs/dbraw/zinc/96/30/12/895963012.db2.gz HTJUNHJCJUPDIX-JKSUJKDBSA-N 2 0 424.420 4.164 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC[C@H](C)C2)[C@@H](C)C1 ZINC000480617750 895984723 /nfs/dbraw/zinc/98/47/23/895984723.db2.gz VTMFXFBRQQDEIG-HWBMXIPRSA-N 3 0 401.639 4.145 20 0 HIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@H](c1ccc(Cl)cc1)N1CCc2sccc2C1 ZINC000480618089 895986032 /nfs/dbraw/zinc/98/60/32/895986032.db2.gz OJZBYAUAYCDTDX-HBGVWJBISA-N 2 0 404.023 4.431 20 0 HIADRP CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000480623057 895990682 /nfs/dbraw/zinc/99/06/82/895990682.db2.gz HMHURLIZDAEPTL-WOJBJXKFSA-N 2 0 409.640 4.022 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480641862 896010285 /nfs/dbraw/zinc/01/02/85/896010285.db2.gz MAPAIWUMGUXGCB-QZTJIDSGSA-N 2 0 418.578 4.454 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3ccc(Br)o3)CC2)c1 ZINC000480667573 896033130 /nfs/dbraw/zinc/03/31/30/896033130.db2.gz RTGAUCPTFKWHSC-UHFFFAOYSA-N 2 0 406.368 4.043 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H](Cc3cccc(F)c3)c3cccc(F)c3)ccn2)CC1 ZINC000480711649 896072689 /nfs/dbraw/zinc/07/26/89/896072689.db2.gz QSSTZLKPUQLKEC-DEOSSOPVSA-N 2 0 422.523 4.185 20 0 HIADRP CC[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc2cc(OC)ccc2c1 ZINC000480719758 896079791 /nfs/dbraw/zinc/07/97/91/896079791.db2.gz HQUAKWBJBXIKFQ-DEOSSOPVSA-N 2 0 404.558 4.236 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H]3CCCOc4c(Cl)c(Cl)ccc43)ccn2)CC1 ZINC000480720375 896081245 /nfs/dbraw/zinc/08/12/45/896081245.db2.gz JFRFDUGAVYFWGX-SFHVURJKSA-N 2 0 421.372 4.144 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccccc1OC(F)F ZINC000480727109 896087305 /nfs/dbraw/zinc/08/73/05/896087305.db2.gz MYGHOWQLKJGZQS-IBGZPJMESA-N 2 0 404.505 4.066 20 0 HIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000480730566 896091320 /nfs/dbraw/zinc/09/13/20/896091320.db2.gz KQAOVTAURQRRJV-QFIPXVFZSA-N 2 0 406.599 4.277 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCSc4c(Cl)cccc43)cn2)CC1 ZINC000480731626 896091939 /nfs/dbraw/zinc/09/19/39/896091939.db2.gz QWNHHBJKJLHAOY-LJQANCHMSA-N 2 0 402.995 4.204 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(SCC(F)F)cc3)cn2)CC1 ZINC000480742013 896102591 /nfs/dbraw/zinc/10/25/91/896102591.db2.gz PXFJOYWMNQKSML-QGZVFWFLSA-N 2 0 420.573 4.432 20 0 HIADRP CCn1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)cn1 ZINC000480769156 896130774 /nfs/dbraw/zinc/13/07/74/896130774.db2.gz LQUXMWNWMKZQKV-NRFANRHFSA-N 2 0 403.574 4.076 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000480771387 896136063 /nfs/dbraw/zinc/13/60/63/896136063.db2.gz QYCIDMDDUNQHQT-CQSZACIVSA-N 2 0 411.434 4.402 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](C)c2cnn(-c3ccc(Cl)cc3Cl)c2C)CC1 ZINC000480777497 896142707 /nfs/dbraw/zinc/14/27/07/896142707.db2.gz VLUCHSWRDLEJOS-MRXNPFEDSA-N 2 0 424.420 4.166 20 0 HIADRP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000480904664 896259697 /nfs/dbraw/zinc/25/96/97/896259697.db2.gz BTBKWBBDNYSPLV-QGZVFWFLSA-N 2 0 400.636 4.347 20 0 HIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)c1 ZINC000480905125 896260909 /nfs/dbraw/zinc/26/09/09/896260909.db2.gz WNWZXOCFAXNVBH-SFHVURJKSA-N 2 0 403.517 4.195 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)c1 ZINC000481149733 896480437 /nfs/dbraw/zinc/48/04/37/896480437.db2.gz BTBUFFPAFNXHRX-ISKFKSNPSA-N 2 0 406.574 4.267 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@H]2CCCSc3ccc(Cl)cc32)CC1 ZINC000481241229 896591914 /nfs/dbraw/zinc/59/19/14/896591914.db2.gz JXHHMAAPXWVGFF-IBGZPJMESA-N 2 0 402.995 4.204 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCCOc3cc(Br)ccc32)c1 ZINC000481321007 896676409 /nfs/dbraw/zinc/67/64/09/896676409.db2.gz JACVEVQHSSLBRE-FQEVSTJZSA-N 2 0 419.363 4.393 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H](O)COc1cccc(Cl)c1Cl ZINC000481532486 896892993 /nfs/dbraw/zinc/89/29/93/896892993.db2.gz JQQCKNUWQMQAMI-IMFGXOCKSA-N 2 0 423.384 4.233 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)nnn1-c1ccc(F)cc1 ZINC000481541608 896899988 /nfs/dbraw/zinc/89/99/88/896899988.db2.gz HUPSZHIZXUCNMD-GOSISDBHSA-N 2 0 407.537 4.278 20 0 HIADRP COc1ccc(C2(C[NH2+][C@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C)CCOCC2)cc1 ZINC000481557086 896928868 /nfs/dbraw/zinc/92/88/68/896928868.db2.gz LCOQYFWKWPILBV-OFVILXPXSA-N 2 0 408.586 4.244 20 0 HIADRP O=C1Nc2ccccc2C12CCC([NH2+]CC1CC[NH+](Cc3cccs3)CC1)CC2 ZINC000481728088 897122057 /nfs/dbraw/zinc/12/20/57/897122057.db2.gz KANXSGUWEGHWBC-UHFFFAOYSA-N 2 0 409.599 4.382 20 0 HIADRP C[C@@H]([NH2+]C[C@H]1CCCN(Cc2cccs2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482117133 897569759 /nfs/dbraw/zinc/56/97/59/897569759.db2.gz BLVZTBVZOHWGKV-WOJBJXKFSA-N 2 0 401.620 4.251 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000482117936 897571615 /nfs/dbraw/zinc/57/16/15/897571615.db2.gz DEINLSYMXILGCZ-LJQANCHMSA-N 2 0 421.614 4.376 20 0 HIADRP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000482122498 897577928 /nfs/dbraw/zinc/57/79/28/897577928.db2.gz QLNFQKIHVGXSPQ-KRWDZBQOSA-N 2 0 401.624 4.007 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(NC(=O)c2cccnc2)cc1 ZINC000482141099 897600198 /nfs/dbraw/zinc/60/01/98/897600198.db2.gz YAOXZHJPGMCTDK-NLFFAJNJSA-N 2 0 414.553 4.334 20 0 HIADRP COC(=O)c1ccc(Cl)c(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)c1 ZINC000482247861 897729687 /nfs/dbraw/zinc/72/96/87/897729687.db2.gz VQBZWFKCFVZMLV-IRXDYDNUSA-N 2 0 416.949 4.026 20 0 HIADRP COC(=O)c1ccc(Cl)c(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)c1 ZINC000482247860 897729948 /nfs/dbraw/zinc/72/99/48/897729948.db2.gz VQBZWFKCFVZMLV-IAGOWNOFSA-N 2 0 416.949 4.026 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)C(c1ccccc1)c1ccccc1 ZINC000482252165 897733110 /nfs/dbraw/zinc/73/31/10/897733110.db2.gz JJUYRTMNJUWNQO-NRFANRHFSA-N 2 0 415.581 4.288 20 0 HIADRP Cc1nc2c(s1)[C@H]([NH2+]Cc1cccc(OCC[N@@H+](C)C3CCOCC3)c1)CCC2 ZINC000482257940 897740664 /nfs/dbraw/zinc/74/06/64/897740664.db2.gz JSHQYEHYTBDEML-OAQYLSRUSA-N 2 0 415.603 4.108 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000482332050 897837271 /nfs/dbraw/zinc/83/72/71/897837271.db2.gz KYPKWDPKSNRNOJ-HOTGVXAUSA-N 2 0 402.410 4.012 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000482359898 897876983 /nfs/dbraw/zinc/87/69/83/897876983.db2.gz RQHNTQZVQJVIHK-SFHVURJKSA-N 2 0 400.394 4.070 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000482453313 898021095 /nfs/dbraw/zinc/02/10/95/898021095.db2.gz NNBZEQOPCOTIKX-INIZCTEOSA-N 2 0 408.377 4.036 20 0 HIADRP Cc1c([C@H](C)[NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000482459889 898032779 /nfs/dbraw/zinc/03/27/79/898032779.db2.gz CGFGXTUAWGREDZ-CVEARBPZSA-N 2 0 424.420 4.022 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000482483035 898060690 /nfs/dbraw/zinc/06/06/90/898060690.db2.gz IMXABRNKNRIDJU-QAPCUYQASA-N 2 0 400.394 4.070 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](C)c2sc(-c3ccc(C)cc3)nc2C)CC1 ZINC000482496578 898077152 /nfs/dbraw/zinc/07/71/52/898077152.db2.gz QNZHVYGLKZVTMA-RTBURBONSA-N 2 0 400.636 4.351 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc(F)cc1N(C)C ZINC000482544600 898132985 /nfs/dbraw/zinc/13/29/85/898132985.db2.gz TWIHJUWWCWQNJA-IRXDYDNUSA-N 2 0 402.533 4.194 20 0 HIADRP COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c1 ZINC000482553196 898143164 /nfs/dbraw/zinc/14/31/64/898143164.db2.gz DJMXHLCCXTVDNV-IRXDYDNUSA-N 2 0 401.526 4.007 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000482557657 898148926 /nfs/dbraw/zinc/14/89/26/898148926.db2.gz PGLORSLVHPECDG-QGZVFWFLSA-N 2 0 422.598 4.321 20 0 HIADRP Cc1c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cnn1-c1ccc(F)cc1 ZINC000482557270 898149083 /nfs/dbraw/zinc/14/90/83/898149083.db2.gz KBDOJGMTFMAEAH-SFHVURJKSA-N 2 0 422.548 4.127 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccccc1OC(F)F ZINC000482560611 898152681 /nfs/dbraw/zinc/15/26/81/898152681.db2.gz ASDDIVLJKFWBJM-OAQYLSRUSA-N 2 0 404.501 4.486 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482564078 898156266 /nfs/dbraw/zinc/15/62/66/898156266.db2.gz HEGKYDCGCZZZIR-SJORKVTESA-N 2 0 424.564 4.219 20 0 HIADRP COCCOc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000482564868 898156386 /nfs/dbraw/zinc/15/63/86/898156386.db2.gz LXHJNKWRSACURB-OALUTQOASA-N 2 0 415.553 4.015 20 0 HIADRP C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000482564075 898156413 /nfs/dbraw/zinc/15/64/13/898156413.db2.gz HEGKYDCGCZZZIR-IRXDYDNUSA-N 2 0 424.564 4.219 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000482639103 898243333 /nfs/dbraw/zinc/24/33/33/898243333.db2.gz RJRALEYBGLEOAP-CRAIPNDOSA-N 2 0 405.011 4.066 20 0 HIADRP COc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)CCC3)cc1 ZINC000482866643 898479999 /nfs/dbraw/zinc/47/99/99/898479999.db2.gz FZPXUXZSEPAYMS-UYAOXDASSA-N 2 0 415.603 4.023 20 0 HIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CCCC[N@@H+]3CCC[C@H]3CO)s2)cc1 ZINC000482874105 898487086 /nfs/dbraw/zinc/48/70/86/898487086.db2.gz HITUWKBGVZEEQG-APWZRJJASA-N 2 0 403.592 4.015 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482946060 898570894 /nfs/dbraw/zinc/57/08/94/898570894.db2.gz JBISPYDTXHBAGP-IBGZPJMESA-N 2 0 415.603 4.285 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(F)c(Br)c2)[C@@H](C)C1 ZINC000483123134 898810172 /nfs/dbraw/zinc/81/01/72/898810172.db2.gz DJARNAQPDZFGSF-DOXZYTNZSA-N 2 0 401.364 4.376 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCCc2ccc(Br)cc2F)[C@H](C)C1 ZINC000483176192 898842589 /nfs/dbraw/zinc/84/25/89/898842589.db2.gz CGWGPNSNXCNBIX-UZLBHIALSA-N 2 0 415.391 4.247 20 0 HIADRP C[C@@H]([NH2+][C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000483198823 898854832 /nfs/dbraw/zinc/85/48/32/898854832.db2.gz MBMMEDKDZVYCJW-IEBWSBKVSA-N 2 0 419.516 4.158 20 0 HIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CCOC3)CC1)CCC2 ZINC000483214341 898862629 /nfs/dbraw/zinc/86/26/29/898862629.db2.gz DLOIBRGDOBYPLY-JXFKEZNVSA-N 2 0 415.578 4.417 20 0 HIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]C1CC[NH+](C[C@H]3CCOC3)CC1)CCC2 ZINC000483214345 898862692 /nfs/dbraw/zinc/86/26/92/898862692.db2.gz DLOIBRGDOBYPLY-UZLBHIALSA-N 2 0 415.578 4.417 20 0 HIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000483720660 899380963 /nfs/dbraw/zinc/38/09/63/899380963.db2.gz GKAYMDVMVAVKID-HFZDXXHNSA-N 2 0 418.585 4.307 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@H]2CCc3c2cccc3F)CC1 ZINC000483724741 899384314 /nfs/dbraw/zinc/38/43/14/899384314.db2.gz HFUXOZDYWODUQX-FQEVSTJZSA-N 2 0 407.455 4.373 20 0 HIADRP Cc1nc(C)c([C@@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)s1 ZINC000483732322 899393438 /nfs/dbraw/zinc/39/34/38/899393438.db2.gz MHNDHNSQSSEYKV-CYBMUJFWSA-N 2 0 412.525 4.381 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC(CC)(CC)[NH2+][C@H](C)c2ccccc2)C[C@H]1C ZINC000483795812 899468592 /nfs/dbraw/zinc/46/85/92/899468592.db2.gz BKXYVHSAPFJYAF-SJBKTWHCSA-N 2 0 402.627 4.410 20 0 HIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(-c2ccc(Br)cc2)s1 ZINC000484145731 899766736 /nfs/dbraw/zinc/76/67/36/899766736.db2.gz MSBFRTPIHFSXLH-CQSZACIVSA-N 2 0 409.393 4.285 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+][C@H](CCSc2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000484150879 899772452 /nfs/dbraw/zinc/77/24/52/899772452.db2.gz DWXXSARTJKCPEJ-OAQYLSRUSA-N 2 0 406.542 4.235 20 0 HIADRP COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C)C2)c1 ZINC000484509815 900002034 /nfs/dbraw/zinc/00/20/34/900002034.db2.gz UOHLPSDWOCFCCZ-MZEQIWSPSA-N 2 0 423.601 4.030 20 0 HIADRP Cc1ccc(C[NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)c(OCC(F)(F)F)c1 ZINC000484646401 900091705 /nfs/dbraw/zinc/09/17/05/900091705.db2.gz XSYOHWZEURKNKE-XLIONFOSSA-N 2 0 407.480 4.331 20 0 HIADRP CCC[NH+]1CCC([N@H+](C)C[C@H](O)CO[C@H](c2ccccc2)c2ccccc2C)CC1 ZINC000484911343 900288064 /nfs/dbraw/zinc/28/80/64/900288064.db2.gz QPUOCUHEVWAIOE-AZGAKELHSA-N 2 0 410.602 4.268 20 0 HIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCC(=O)Nc3ccc(OCc4ccccc4)cc3)CC[C@@H]21 ZINC000485337130 900624971 /nfs/dbraw/zinc/62/49/71/900624971.db2.gz MMNZHQDDJQZJHC-URXFXBBRSA-N 2 0 407.558 4.010 20 0 HIADRP CCOc1ccccc1NC(=O)CC[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000485440115 900736956 /nfs/dbraw/zinc/73/69/56/900736956.db2.gz QRNCACHAKKBCFO-AREMUKBSSA-N 2 0 421.585 4.402 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCC(=O)Nc2ccc(OCc3ccccc3)cc2)[C@@H](C)C1 ZINC000485678182 900929455 /nfs/dbraw/zinc/92/94/55/900929455.db2.gz INBOEFQCGHHXFR-RDPSFJRHSA-N 2 0 409.574 4.256 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)[C@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1 ZINC000505919634 914565733 /nfs/dbraw/zinc/56/57/33/914565733.db2.gz TXDJLMYFVZTVTH-MZYLBHOOSA-N 2 0 415.597 4.151 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+]Cc1c[nH]nc1-c1ccc(C(F)(F)F)cc1 ZINC000486982009 902002212 /nfs/dbraw/zinc/00/22/12/902002212.db2.gz ORWAKFREEDWFIC-UHFFFAOYSA-N 2 0 418.463 4.326 20 0 HIADRP Cc1ccc(SCC[NH+]2CCC(C(=O)NCCC[NH+]3CCCCC3)CC2)cc1C ZINC000487785505 902363291 /nfs/dbraw/zinc/36/32/91/902363291.db2.gz AQVFMGUNOXIVRW-UHFFFAOYSA-N 2 0 417.663 4.100 20 0 HIADRP c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c(C[NH+]2CCC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000487915694 902449024 /nfs/dbraw/zinc/44/90/24/902449024.db2.gz PTUQBMWUQWFGGJ-FATVKVNYSA-N 2 0 412.618 4.184 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000488526563 902870756 /nfs/dbraw/zinc/87/07/56/902870756.db2.gz ZTXIFKALENLOCQ-PBXXJUDPSA-N 2 0 423.576 4.065 20 0 HIADRP c1ccc(C[N@@H+]2CCCC3(CCOCC3)C2)c(C[NH+]2CCCC3(CCOCC3)C2)c1 ZINC000489287681 903310155 /nfs/dbraw/zinc/31/01/55/903310155.db2.gz GLBYCHUYKJKEFB-UHFFFAOYSA-N 2 0 412.618 4.472 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(Br)c(F)c1 ZINC000489469451 903401740 /nfs/dbraw/zinc/40/17/40/903401740.db2.gz BGUWBMYHTRNDGT-HNNXBMFYSA-N 2 0 421.354 4.396 20 0 HIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)CCCO2 ZINC000489484158 903413117 /nfs/dbraw/zinc/41/31/17/903413117.db2.gz QAIMZJKGFLKYIA-QFIPXVFZSA-N 2 0 415.622 4.240 20 0 HIADRP CC(C)CNC(=O)c1cccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1 ZINC000489647368 903513597 /nfs/dbraw/zinc/51/35/97/903513597.db2.gz JBOWLOYKCVETMN-UHFFFAOYSA-N 2 0 407.602 4.416 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCC(=O)N[C@H]2CCCc3ccccc32)CC1 ZINC000489650250 903514970 /nfs/dbraw/zinc/51/49/70/903514970.db2.gz QSEUUCQVRGZSKV-SANMLTNESA-N 2 0 419.613 4.414 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H](O)COc2cccc3ccccc32)CC1 ZINC000489680989 903539390 /nfs/dbraw/zinc/53/93/90/903539390.db2.gz DLYLBWOIUDKEHR-RUZDIDTESA-N 2 0 418.581 4.424 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CC(=O)N[C@H](c2ccccc2)C2CC2)CC1 ZINC000489679983 903539846 /nfs/dbraw/zinc/53/98/46/903539846.db2.gz RFCBWAMRTNFYLM-AREMUKBSSA-N 2 0 405.586 4.098 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000489837686 903621820 /nfs/dbraw/zinc/62/18/20/903621820.db2.gz TZRHPUCUZCCFPG-BWKNWUBXSA-N 2 0 422.617 4.238 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000489852102 903630409 /nfs/dbraw/zinc/63/04/09/903630409.db2.gz XKXUJBPEEICASA-PXDATVDWSA-N 2 0 422.617 4.190 20 0 HIADRP COc1ccc([C@H]([NH2+]C2CCN(CC[NH+](C)C)CC2)c2ccccc2Cl)cc1 ZINC000490120147 903777419 /nfs/dbraw/zinc/77/74/19/903777419.db2.gz SKAHJPKIZGTVAW-QHCPKHFHSA-N 2 0 401.982 4.054 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](c3ccccc3)c3ccc(OC)cc3)cn2)CC1 ZINC000490159783 903801552 /nfs/dbraw/zinc/80/15/52/903801552.db2.gz ZMWUADWSKDLYIZ-AREMUKBSSA-N 2 0 416.569 4.111 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@H](C)[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1)C1CC1 ZINC000490792889 904238628 /nfs/dbraw/zinc/23/86/28/904238628.db2.gz IBGZMXWAXVJRBV-HYBUGGRVSA-N 2 0 405.586 4.311 20 0 HIADRP COc1ccc([C@@H]([NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)c2ccccc2)cc1 ZINC000493202615 905048698 /nfs/dbraw/zinc/04/86/98/905048698.db2.gz HDNYEUHEUHLYEV-VWLOTQADSA-N 2 0 423.601 4.001 20 0 HIADRP C[C@H]([NH2+]CC1=Cc2cc(Br)ccc2OC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512397049 921132790 /nfs/dbraw/zinc/13/27/90/921132790.db2.gz ZJAQNQRAUMOKAY-RDJZCZTQSA-N 2 0 405.380 4.468 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@]1(C)CCC[N@@H+]1Cc1ccccc1 ZINC000494193148 905527697 /nfs/dbraw/zinc/52/76/97/905527697.db2.gz XAFXGEUIEHGOBN-VWLOTQADSA-N 2 0 405.542 4.279 20 0 HIADRP Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)c1ccc(C[NH+]2CCC(CO)CC2)cc1 ZINC000494299286 905618726 /nfs/dbraw/zinc/61/87/26/905618726.db2.gz VVPUFMYFQKIXOZ-UHFFFAOYSA-N 2 0 421.585 4.047 20 0 HIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2cnn(Cc3ccc(C(F)(F)F)cc3)c2)c1 ZINC000494550741 905830323 /nfs/dbraw/zinc/83/03/23/905830323.db2.gz WHHMHQASCUTLES-UHFFFAOYSA-N 2 0 402.464 4.302 20 0 HIADRP C[NH+](C)CCCN(Cc1ccc(Cl)c(Cl)c1)C(=O)C1CC[NH+](C2CC2)CC1 ZINC000495124477 906255841 /nfs/dbraw/zinc/25/58/41/906255841.db2.gz XWLVEGBOLGEVBZ-UHFFFAOYSA-N 2 0 412.405 4.148 20 0 HIADRP C[C@@H]1C[C@H](CCNC(=O)c2cccc(C[NH+]3CCCC3)c2)C[N@@H+]1Cc1ccccc1 ZINC000512575413 921245804 /nfs/dbraw/zinc/24/58/04/921245804.db2.gz ZCMLWFSSVFJHJP-QPPBQGQZSA-N 2 0 405.586 4.313 20 0 HIADRP O=C1CCCN1Cc1ccc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000512619261 921264279 /nfs/dbraw/zinc/26/42/79/921264279.db2.gz LPWNQTWCSODHNM-JIMJEQGWSA-N 2 0 417.597 4.199 20 0 HIADRP c1cn(Cc2cccc(C[NH2+][C@H]3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)c2)cn1 ZINC000512643109 921271526 /nfs/dbraw/zinc/27/15/26/921271526.db2.gz VRZGCOQPMLOVNB-GSDHBNRESA-N 2 0 400.570 4.322 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)NC2CC[NH+](CC3CCCC3)CC2)[C@@H]1c1cccs1 ZINC000497561645 907048895 /nfs/dbraw/zinc/04/88/95/907048895.db2.gz KTAHGOZSUBSTNB-SIKLNZKXSA-N 2 0 418.651 4.085 20 0 HIADRP C[C@H](NC(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)[C@H](c1ccccc1)[NH+](C)C ZINC000498024365 907524225 /nfs/dbraw/zinc/52/42/25/907524225.db2.gz CSUWSBGPYVUENH-HVJHZFLKSA-N 2 0 414.619 4.122 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000498499976 907973003 /nfs/dbraw/zinc/97/30/03/907973003.db2.gz QTDURNJTNDMFEZ-UHFFFAOYSA-N 2 0 405.586 4.267 20 0 HIADRP O=C(NC1CC[NH+](C2CCCCC2)CC1)N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000498588936 908041637 /nfs/dbraw/zinc/04/16/37/908041637.db2.gz QBKFQDDQNAGFPI-AREMUKBSSA-N 2 0 424.633 4.091 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CCC([NH+]3CCCCC3)CC2)c1 ZINC000498617923 908064701 /nfs/dbraw/zinc/06/47/01/908064701.db2.gz UJEPULXYHPQHCF-UHFFFAOYSA-N 2 0 405.586 4.409 20 0 HIADRP COc1cccc(N2CCC[C@@H]([NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499213873 908569978 /nfs/dbraw/zinc/56/99/78/908569978.db2.gz UUORXWHMYUAVCI-YQIMAOPZSA-N 2 0 405.586 4.449 20 0 HIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CC2(CN4CCOCC4)CCCCC2)C3)cc1 ZINC000499238807 908603932 /nfs/dbraw/zinc/60/39/32/908603932.db2.gz XDJAPVILZVAMHI-QEIWAGNOSA-N 2 0 411.634 4.054 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)c1 ZINC000500120200 909600904 /nfs/dbraw/zinc/60/09/04/909600904.db2.gz DCVWBLRABPZHGP-QFIPXVFZSA-N 2 0 412.578 4.148 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NCc2cccc(C[NH+]3CCCC3)c2)cc1 ZINC000500130928 909611562 /nfs/dbraw/zinc/61/15/62/909611562.db2.gz UXYSPXBMSAJMEE-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NCc1cccc(C[NH+]2CCCC2)c1)c1ccccc1 ZINC000500130850 909613335 /nfs/dbraw/zinc/61/33/35/909613335.db2.gz GOWBXTSSHUUXRT-DEOSSOPVSA-N 2 0 408.590 4.165 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)NCc2ccc(C[NH+](C)C)cc2)C1 ZINC000500848019 910122548 /nfs/dbraw/zinc/12/25/48/910122548.db2.gz HHHFVUKTPFQGOZ-SFTDATJTSA-N 2 0 422.617 4.226 20 0 HIADRP Brc1ccc(-n2cc(C[NH2+]CCCCC[NH+]3CCCCC3)cn2)cc1 ZINC000500914140 910179858 /nfs/dbraw/zinc/17/98/58/910179858.db2.gz DWLUVEGNZUNZGS-UHFFFAOYSA-N 2 0 405.384 4.381 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1cccs1 ZINC000501012217 910233537 /nfs/dbraw/zinc/23/35/37/910233537.db2.gz VHWHDKJRTAOJKV-MOPGFXCFSA-N 2 0 421.010 4.141 20 0 HIADRP CC[C@H](NC(=O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000501017285 910234564 /nfs/dbraw/zinc/23/45/64/910234564.db2.gz ASFCLBUBSJJPBY-QFIPXVFZSA-N 2 0 414.981 4.151 20 0 HIADRP C[C@H](C(=O)N1CCC[C@H]1c1cccs1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501019869 910239455 /nfs/dbraw/zinc/23/94/55/910239455.db2.gz AYGNYVUEBFXJLA-NQIIRXRSSA-N 2 0 412.603 4.044 20 0 HIADRP C[N@@H+](CC(=O)N(Cc1ccco1)c1ccccc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501022105 910241062 /nfs/dbraw/zinc/24/10/62/910241062.db2.gz QJFSNXSMUXZNEQ-UHFFFAOYSA-N 2 0 418.541 4.056 20 0 HIADRP CC(C)C[C@@H](NC(=O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000501043920 910257343 /nfs/dbraw/zinc/25/73/43/910257343.db2.gz DZSYJJAQPWAJTG-XMMPIXPASA-N 2 0 408.590 4.133 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1)c1ccsc1 ZINC000501090726 910290329 /nfs/dbraw/zinc/29/03/29/910290329.db2.gz GLQMYXDCDLHIEX-OAQYLSRUSA-N 2 0 418.607 4.030 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)C1CCCCC1 ZINC000501376341 910505401 /nfs/dbraw/zinc/50/54/01/910505401.db2.gz KJBPUOQOFYDDPA-JOCHJYFZSA-N 2 0 421.029 4.114 20 0 HIADRP c1ccc(CN2CC[NH+](CCCC[NH2+][C@H]3CCC[C@H](c4cccnc4)C3)CC2)cc1 ZINC000501384617 910514612 /nfs/dbraw/zinc/51/46/12/910514612.db2.gz AGCATDODERNOAG-AHWVRZQESA-N 2 0 406.618 4.295 20 0 HIADRP C[N@H+](CCCNC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)C1CCCCC1 ZINC000501575171 910681400 /nfs/dbraw/zinc/68/14/00/910681400.db2.gz KNFXIXDYXBXGOC-UHFFFAOYSA-N 2 0 421.029 4.258 20 0 HIADRP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000501793557 910845857 /nfs/dbraw/zinc/84/58/57/910845857.db2.gz AQHKSJNPYFTFLB-RTWAWAEBSA-N 2 0 412.603 4.021 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N(CCC[NH+](C)C)CCC[NH+](C)C ZINC000502585240 911590082 /nfs/dbraw/zinc/59/00/82/911590082.db2.gz NFXSAJSTMVDRJY-UHFFFAOYSA-N 2 0 423.026 4.118 20 0 HIADRP C[NH+]1CCC(Nc2ccccc2NC(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000502624076 911653434 /nfs/dbraw/zinc/65/34/34/911653434.db2.gz UQVCFSFVEVULGJ-OAQYLSRUSA-N 2 0 406.574 4.043 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000502878342 911880165 /nfs/dbraw/zinc/88/01/65/911880165.db2.gz VKAWRPYOEOZAMK-NRFANRHFSA-N 2 0 400.611 4.126 20 0 HIADRP CCC(CC)(CNC(=O)NC1CC[NH+](CC(C)C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000502926601 911912431 /nfs/dbraw/zinc/91/24/31/911912431.db2.gz SISZTOJVKJEMGK-FQEVSTJZSA-N 2 0 402.627 4.316 20 0 HIADRP CCC(CC)(CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000503037801 912008169 /nfs/dbraw/zinc/00/81/69/912008169.db2.gz IFSQFNFRAIADLO-IBGZPJMESA-N 2 0 402.627 4.458 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000503086837 912056986 /nfs/dbraw/zinc/05/69/86/912056986.db2.gz JLJKXASWARVZML-ZJSXRUAMSA-N 2 0 420.601 4.128 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)C1 ZINC000503090213 912061156 /nfs/dbraw/zinc/06/11/56/912061156.db2.gz ODSIIRJNSNSVNK-MIZPHKNDSA-N 2 0 408.590 4.251 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)NC[C@H](c2cccs2)[NH+](C)C)CCCC1)c1ccccc1 ZINC000503107381 912074421 /nfs/dbraw/zinc/07/44/21/912074421.db2.gz MEVBTLGMCXCREX-AZUAARDMSA-N 2 0 414.619 4.314 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)N[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000506311421 914899581 /nfs/dbraw/zinc/89/95/81/914899581.db2.gz SSLIWKWPUIGVLV-RBBKRZOGSA-N 2 0 424.589 4.364 20 0 HIADRP COc1ccc(-c2nn(-c3ccccc3)cc2C[NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000506875945 915666216 /nfs/dbraw/zinc/66/62/16/915666216.db2.gz PIBUEKUIWYWIPH-UHFFFAOYSA-N 2 0 404.558 4.322 20 0 HIADRP CC[N@H+](CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)[C@H](C)c1ccc(F)cc1 ZINC000507703141 916487193 /nfs/dbraw/zinc/48/71/93/916487193.db2.gz PGQSJFKLYUXSHC-HXUWFJFHSA-N 2 0 411.565 4.298 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4c3cc(Cl)cc4Cl)cn2)CC1 ZINC000507845140 916659017 /nfs/dbraw/zinc/65/90/17/916659017.db2.gz QFNLWXXUHKGECJ-FQEVSTJZSA-N 2 0 405.373 4.307 20 0 HIADRP C[C@@H]([NH2+]CCc1nc(-c2ccc(Cl)cc2)no1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703107 917464016 /nfs/dbraw/zinc/46/40/16/917464016.db2.gz XMFYZJYAYYWMPR-YLJYHZDGSA-N 2 0 410.949 4.433 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)ccc2NC1=O ZINC000508709398 917469146 /nfs/dbraw/zinc/46/91/46/917469146.db2.gz HLDOLMOYFCENEO-KQKOIIKASA-N 2 0 407.558 4.357 20 0 HIADRP COCc1ccccc1/C=C(/C)C[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000508878252 917631908 /nfs/dbraw/zinc/63/19/08/917631908.db2.gz JTYSFXPLYXYNOP-QOCHGBHMSA-N 2 0 413.650 4.364 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@@H](C)[C@@H](c1ccccc1C)[NH+](C)C ZINC000508915798 917671903 /nfs/dbraw/zinc/67/19/03/917671903.db2.gz GKQOPWIKINKVSO-RDPSFJRHSA-N 2 0 410.606 4.280 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N(C)[C@@H]1CC[NH+](CC)C[C@H]1C)c1ccc(Cl)cc1 ZINC000509031399 917787530 /nfs/dbraw/zinc/78/75/30/917787530.db2.gz KSSONCKHNJGCKK-DUXKGJEZSA-N 2 0 409.018 4.095 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N(C)[C@H](C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000509047915 917798388 /nfs/dbraw/zinc/79/83/88/917798388.db2.gz CXJBEPAGQYMNIB-DYESRHJHSA-N 2 0 409.018 4.095 20 0 HIADRP O=C(NC1CC[NH+](CCc2ccccc2)CC1)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000509441097 918096486 /nfs/dbraw/zinc/09/64/86/918096486.db2.gz VFCHLEXSAJKJBU-UHFFFAOYSA-N 2 0 405.586 4.109 20 0 HIADRP C[C@H](C[NH2+]Cc1ccc(-c2ccccc2Br)cc1)CN1CC[NH+](C)CC1 ZINC000509464769 918114095 /nfs/dbraw/zinc/11/40/95/918114095.db2.gz PEMIUHUIILQCGG-GOSISDBHSA-N 2 0 416.407 4.089 20 0 HIADRP C[C@@H]1C[C@@H](CCNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)C[N@@H+]1Cc1ccccc1 ZINC000509569328 918219293 /nfs/dbraw/zinc/21/92/93/918219293.db2.gz CMAVPXZVTPSGRR-YMPZKCBVSA-N 2 0 424.589 4.016 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCCN2CCN(c3ccccc3)CC2)CC1 ZINC000509658269 918293421 /nfs/dbraw/zinc/29/34/21/918293421.db2.gz NLKAJVJUCOWTIG-UHFFFAOYSA-N 2 0 420.645 4.043 20 0 HIADRP COc1cccc([C@@H](CNC(=O)c2oc3ccccc3c2C[NH+](C)C)[NH+]2CCCC2)c1 ZINC000510332539 918837714 /nfs/dbraw/zinc/83/77/14/918837714.db2.gz KASPUZGKYLLCAF-JOCHJYFZSA-N 2 0 421.541 4.070 20 0 HIADRP C[C@@H](NC(=O)NCc1ccccc1C[NH+]1CCCCC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000510512647 918959453 /nfs/dbraw/zinc/95/94/53/918959453.db2.gz PPUWRXVKYRDWJV-IRLDBZIGSA-N 2 0 412.622 4.125 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]C3CC(c4ccccc4Cl)C3)c2)C1 ZINC000510954081 919487352 /nfs/dbraw/zinc/48/73/52/919487352.db2.gz SNAXWHQSFJRPSG-QNGMFEMESA-N 2 0 411.977 4.073 20 0 HIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)cc1 ZINC000511394039 920004136 /nfs/dbraw/zinc/00/41/36/920004136.db2.gz AOSVCRNGUMVCNC-DNQXCXABSA-N 2 0 416.009 4.343 20 0 HIADRP Cc1ccc(C[N@@H+](CC(=O)NC2CC[NH+](C(C)C)CC2)[C@H]2CCc3ccccc32)cc1 ZINC000511634405 920299166 /nfs/dbraw/zinc/29/91/66/920299166.db2.gz MKEYMGZELMKYMR-SANMLTNESA-N 2 0 419.613 4.474 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)CC1(C)C ZINC000512124414 920875300 /nfs/dbraw/zinc/87/53/00/920875300.db2.gz ULHHRZCVVGRXFA-JTHBVZDNSA-N 2 0 414.638 4.241 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)N[C@@H]2CC[NH+](Cc3ccccc3)CC2(C)C)C1 ZINC000512137931 920884147 /nfs/dbraw/zinc/88/41/47/920884147.db2.gz JPNYTCVVNFELKW-FYYLOGMGSA-N 2 0 414.638 4.098 20 0 HIADRP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3cn(C)nc3-c3ccccc3Cl)CC2)C[C@H](C)O1 ZINC000512176832 920916068 /nfs/dbraw/zinc/91/60/68/920916068.db2.gz DZJACBMFZORFKO-HDICACEKSA-N 2 0 416.997 4.062 20 0 HIADRP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+](CCCc4nc(-c5ccccc5)no4)C3)C2)cc1 ZINC000512270994 921027315 /nfs/dbraw/zinc/02/73/15/921027315.db2.gz REWNBPUMYXJDOI-VWLOTQADSA-N 2 0 402.542 4.267 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512323557 921074372 /nfs/dbraw/zinc/07/43/72/921074372.db2.gz NOXQHMGBKYVGMR-IXDOHACOSA-N 2 0 422.411 4.409 20 0 HIADRP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(-c4ccc(Cl)c(Cl)c4)o3)C2)CC1 ZINC000513466707 921828885 /nfs/dbraw/zinc/82/88/85/921828885.db2.gz JPGXOVAFLIYYOT-QGZVFWFLSA-N 2 0 408.373 4.465 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+][C@H](Cc2ccccn2)c2cccnc2)C[C@@H](C)O1 ZINC000513498529 921848231 /nfs/dbraw/zinc/84/82/31/921848231.db2.gz AMTIQPGAEIPMCR-IPVFLDMMSA-N 2 0 416.569 4.159 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccccc2CN2CCCC2=O)CC1 ZINC000513713104 922032329 /nfs/dbraw/zinc/03/23/29/922032329.db2.gz KIMICAPPTBJAIQ-UHFFFAOYSA-N 2 0 405.586 4.342 20 0 HIADRP CCCN(C(=O)NCc1cccc(C[NH+](C)C)c1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000514064148 922388934 /nfs/dbraw/zinc/38/89/34/922388934.db2.gz QILQQEKPOUVVPM-RUZDIDTESA-N 2 0 422.617 4.334 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)C1 ZINC000514108323 922436715 /nfs/dbraw/zinc/43/67/15/922436715.db2.gz YABIVCXQLPZCMJ-QFIPXVFZSA-N 2 0 414.638 4.374 20 0 HIADRP CC(C)(C)c1nn(-c2ccccc2)cc1C[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000514233623 922570477 /nfs/dbraw/zinc/57/04/77/922570477.db2.gz CKHITTDGMZDIDB-XMMPIXPASA-N 2 0 418.585 4.026 20 0 HIADRP COc1ccccc1-c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000514242872 922584426 /nfs/dbraw/zinc/58/44/26/922584426.db2.gz PKJFEEUZQDQHEE-DEOSSOPVSA-N 2 0 402.538 4.219 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH+]2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1 ZINC000515068267 922893391 /nfs/dbraw/zinc/89/33/91/922893391.db2.gz KRLOOZNFUKBGJA-UHFFFAOYSA-N 2 0 413.528 4.181 20 0 HIADRP Cc1ccccc1CCNC(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000515518809 923148743 /nfs/dbraw/zinc/14/87/43/923148743.db2.gz OIUOWHQOHVPDHF-FGZHOGPDSA-N 2 0 407.602 4.206 20 0 HIADRP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2ccc(-c3ccc(F)cc3)s2)C(C)C)CC1 ZINC000516312017 923658400 /nfs/dbraw/zinc/65/84/00/923658400.db2.gz CUTOFKOMLLBJJS-UHFFFAOYSA-N 2 0 417.594 4.365 20 0 HIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000518265867 927122450 /nfs/dbraw/zinc/12/24/50/927122450.db2.gz BXGSUUOTZAQQPN-INIZCTEOSA-N 2 0 411.384 4.212 20 0 HIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2c(Br)cncc2Br)C1 ZINC000518268790 927126520 /nfs/dbraw/zinc/12/65/20/927126520.db2.gz YAHOICONCNJPFL-ZDUSSCGKSA-N 2 0 419.205 4.208 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+]Cc2ccc(OCc3c(F)cccc3Cl)cc2)CC1 ZINC000518269384 927126811 /nfs/dbraw/zinc/12/68/11/927126811.db2.gz CLFROPYFEOITGB-UHFFFAOYSA-N 2 0 419.972 4.174 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1)c1ccsc1 ZINC000518406853 927247018 /nfs/dbraw/zinc/24/70/18/927247018.db2.gz IIPOHVXPLKJFSS-STZQEDGTSA-N 2 0 414.619 4.266 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cnn(Cc3ccccc3)c2)CC1 ZINC000518774644 927486656 /nfs/dbraw/zinc/48/66/56/927486656.db2.gz YHOVFCFFCSXKTC-FQEVSTJZSA-N 2 0 421.564 4.063 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc(F)cc1F ZINC000518807792 927504730 /nfs/dbraw/zinc/50/47/30/927504730.db2.gz MMTKSZWDJRLRAI-JOCHJYFZSA-N 2 0 401.501 4.031 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(=O)N(C)Cc1cccc(F)c1 ZINC000518842293 927544552 /nfs/dbraw/zinc/54/45/52/927544552.db2.gz QJOWXLSWFCEGSU-WOJBJXKFSA-N 2 0 411.565 4.337 20 0 HIADRP CC(C)Oc1cccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000519655422 928036709 /nfs/dbraw/zinc/03/67/09/928036709.db2.gz SPYKXMOGGCYOBQ-DEOSSOPVSA-N 2 0 408.586 4.492 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000519912661 928145822 /nfs/dbraw/zinc/14/58/22/928145822.db2.gz SRQIUWOUHGGJHP-QFIPXVFZSA-N 2 0 409.574 4.258 20 0 HIADRP O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)N1CCC(C[NH+]2CCCC2)CC1 ZINC000520296748 928458852 /nfs/dbraw/zinc/45/88/52/928458852.db2.gz KBIJUBJMWNXYCO-UHFFFAOYSA-N 2 0 412.622 4.080 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCC[C@H]2C[NH+]2CCCCC2)cc1 ZINC000520613261 928672895 /nfs/dbraw/zinc/67/28/95/928672895.db2.gz YMBOHFVKQZDQRT-QPPBQGQZSA-N 2 0 412.622 4.221 20 0 HIADRP Cc1ccc(COc2ccc(C[NH2+]Cc3cccnc3N3CC[NH+](C)CC3)cc2)cc1 ZINC000520962440 928892195 /nfs/dbraw/zinc/89/21/95/928892195.db2.gz CRNWPXUSIIUZNW-UHFFFAOYSA-N 2 0 416.569 4.011 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1NC[C@@H]1C[NH+](Cc2ccccc2)CCCO1 ZINC000521282896 929099318 /nfs/dbraw/zinc/09/93/18/929099318.db2.gz VJVWNVYUHYTLOS-CLJLJLNGSA-N 2 0 421.629 4.168 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 ZINC000521430341 929218066 /nfs/dbraw/zinc/21/80/66/929218066.db2.gz ZEHJHTWVLCFUFL-INIZCTEOSA-N 2 0 415.500 4.356 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000524886878 929873361 /nfs/dbraw/zinc/87/33/61/929873361.db2.gz SHVXMIVWGCIDPE-RCZVLFRGSA-N 2 0 420.601 4.130 20 0 HIADRP O=C(C[N@H+](Cc1ccoc1)C1CCCCC1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000525638203 930376782 /nfs/dbraw/zinc/37/67/82/930376782.db2.gz XIXCXOCSNJZODZ-UHFFFAOYSA-N 2 0 409.574 4.327 20 0 HIADRP C[C@H]1C[N@H+](CCOc2ccc(CC[NH2+][C@@H](c3ncc[nH]3)c3ccccc3)cc2)C[C@H]1C ZINC000525869314 930472990 /nfs/dbraw/zinc/47/29/90/930472990.db2.gz WBQVMQUJOZZCAU-TYBLODHISA-N 2 0 418.585 4.298 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cc(OC)c(OC)cc2C)CC1 ZINC000531438280 931057475 /nfs/dbraw/zinc/05/74/75/931057475.db2.gz AYWBWKOKRIXBFM-SFHVURJKSA-N 2 0 415.553 4.144 20 0 HIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1 ZINC000531687510 931152786 /nfs/dbraw/zinc/15/27/86/931152786.db2.gz DDJKDYKYRGKUSF-FQEVSTJZSA-N 2 0 416.569 4.360 20 0 HIADRP CC[C@@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000531710475 931168961 /nfs/dbraw/zinc/16/89/61/931168961.db2.gz OEELYYAOIXBRIG-YADHBBJMSA-N 2 0 403.517 4.317 20 0 HIADRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2ccc(-c3cccc(Br)c3)o2)CC1 ZINC000531863810 931226579 /nfs/dbraw/zinc/22/65/79/931226579.db2.gz YXSUFNVVSZBGIM-UHFFFAOYSA-N 2 0 407.352 4.034 20 0 HIADRP CN(c1ccccc1C[NH2+]CCOc1ncc(Cl)cc1Cl)C1CC[NH+](C)CC1 ZINC000531883857 931234524 /nfs/dbraw/zinc/23/45/24/931234524.db2.gz VDUWPXPGZIYWEO-UHFFFAOYSA-N 2 0 423.388 4.087 20 0 HIADRP CC(C)(C)[NH+]1CCC(NCc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)CC1 ZINC000531937483 931253701 /nfs/dbraw/zinc/25/37/01/931253701.db2.gz CSGRFIWPHVOOQA-UHFFFAOYSA-N 2 0 420.645 4.361 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@H](C)CC(=O)Nc3ccccc3C)CC2)c1 ZINC000531944988 931257746 /nfs/dbraw/zinc/25/77/46/931257746.db2.gz RQRUTRBRIBYZCL-HSZRJFAPSA-N 2 0 422.617 4.213 20 0 HIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)C1 ZINC000531958625 931264547 /nfs/dbraw/zinc/26/45/47/931264547.db2.gz QRUFTPQHSHRQFI-HZPDHXFCSA-N 2 0 401.473 4.012 20 0 HIADRP C[NH+]1CCN(C[C@@H]([NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)c2ccccc2)CC1 ZINC000531965290 931268257 /nfs/dbraw/zinc/26/82/57/931268257.db2.gz PZIFBRVZTMQHRD-FGZHOGPDSA-N 2 0 419.491 4.151 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000531990150 931278755 /nfs/dbraw/zinc/27/87/55/931278755.db2.gz ZVHHJPYGHFOPSH-OAHLLOKOSA-N 2 0 404.352 4.018 20 0 HIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]C[C@@H](c1cccs1)N1CCN(C)CC1 ZINC000532188623 931341139 /nfs/dbraw/zinc/34/11/39/931341139.db2.gz UQWFBUFGBVNQOC-AOIWGVFYSA-N 2 0 414.644 4.428 20 0 HIADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000532214316 931356107 /nfs/dbraw/zinc/35/61/07/931356107.db2.gz IMZZQJGCGUGPQQ-SANMLTNESA-N 2 0 424.585 4.352 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(Br)cc1 ZINC000532215709 931357268 /nfs/dbraw/zinc/35/72/68/931357268.db2.gz ODSLONNVOYQSSU-MRXNPFEDSA-N 2 0 403.364 4.257 20 0 HIADRP CO[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1cccc(Cl)c1 ZINC000532358500 931407539 /nfs/dbraw/zinc/40/75/39/931407539.db2.gz JWNPLHYVDRKXCS-QHCPKHFHSA-N 2 0 401.982 4.348 20 0 HIADRP CN(C)[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccccc1Cl ZINC000532361350 931409527 /nfs/dbraw/zinc/40/95/27/931409527.db2.gz OCIUALGJXVPYNL-XMMPIXPASA-N 2 0 415.025 4.263 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](c2ccccc2Cl)N2CCCC2)[C@H](C)C1 ZINC000532461228 931445519 /nfs/dbraw/zinc/44/55/19/931445519.db2.gz BRAGNURPVUJDAB-OIBXWCBGSA-N 2 0 408.030 4.204 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](c2ccccc2Cl)N2CCCC2)[C@@H](C)C1 ZINC000532461221 931445645 /nfs/dbraw/zinc/44/56/45/931445645.db2.gz BRAGNURPVUJDAB-AJSBUHFISA-N 2 0 408.030 4.204 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCCN2CCOCC2)c1)c1ccccc1C(F)(F)F ZINC000532461654 931445684 /nfs/dbraw/zinc/44/56/84/931445684.db2.gz LHHOQHJIKXOFHF-QGZVFWFLSA-N 2 0 408.464 4.267 20 0 HIADRP CN1CC[NH+](CCCC[NH2+]Cc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 ZINC000532805217 931634385 /nfs/dbraw/zinc/63/43/85/931634385.db2.gz SFRUWZPLZFRSDM-UHFFFAOYSA-N 2 0 413.418 4.234 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000533255772 931820314 /nfs/dbraw/zinc/82/03/14/931820314.db2.gz COQVYDZNQZDEDX-UHFFFAOYSA-N 2 0 411.434 4.232 20 0 HIADRP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000533435488 931867652 /nfs/dbraw/zinc/86/76/52/931867652.db2.gz FDKRURJTLLULCF-ZFGGDYGUSA-N 2 0 405.586 4.034 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NCc2ccc(C[NH+](C)C)c(F)c2)CC1 ZINC000534259269 932369179 /nfs/dbraw/zinc/36/91/79/932369179.db2.gz SECHQZZTFDPILX-IBGZPJMESA-N 2 0 418.601 4.073 20 0 HIADRP Cc1cc(C[NH+](C)C)cc(NC(=O)CCCC(=O)Nc2cc(C)cc(C[NH+](C)C)c2)c1 ZINC000534710682 932680291 /nfs/dbraw/zinc/68/02/91/932680291.db2.gz ZLQKPXKQPSTUSC-UHFFFAOYSA-N 2 0 424.589 4.174 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCc3c2c(Br)ccc3F)(N2CCCCC2)CC1 ZINC000535508458 933202076 /nfs/dbraw/zinc/20/20/76/933202076.db2.gz SQNMKHNMCGAJAI-LJQANCHMSA-N 2 0 424.402 4.115 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CCCSCc3ccccc3)CC2)CC1 ZINC000535585000 933255867 /nfs/dbraw/zinc/25/58/67/933255867.db2.gz FSUXHTSYBOGAGR-UHFFFAOYSA-N 2 0 403.680 4.438 20 0 HIADRP Cc1nn(-c2ccc(F)cc2F)c(C)c1C[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000535687661 933341491 /nfs/dbraw/zinc/34/14/91/933341491.db2.gz CJGUXTHJEGKXJB-UHFFFAOYSA-N 2 0 402.464 4.258 20 0 HIADRP C(CCN1CC[NH+](CC2CCCCC2)CC1)CN1CC[NH+](CC2CCCCC2)CC1 ZINC000535723078 933368159 /nfs/dbraw/zinc/36/81/59/933368159.db2.gz YIKZGNKFKLLYHO-UHFFFAOYSA-N 2 0 418.714 4.162 20 0 HIADRP Cc1ccc(NCc2ccccc2N(C)C2CC[NH+](C)CC2)c(OCC[NH+](C)C)c1 ZINC000536100437 933653686 /nfs/dbraw/zinc/65/36/86/933653686.db2.gz WOYDJOLZINSJHL-UHFFFAOYSA-N 2 0 410.606 4.078 20 0 HIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cc(F)cc(Br)c1 ZINC000537306400 933708006 /nfs/dbraw/zinc/70/80/06/933708006.db2.gz GUIUMSRLNRYFCT-XUVXKRRUSA-N 2 0 413.375 4.397 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1cccc(F)c1F ZINC000537345029 933727528 /nfs/dbraw/zinc/72/75/28/933727528.db2.gz UYPWSVNYYKIQGS-KRWDZBQOSA-N 2 0 404.501 4.305 20 0 HIADRP Cc1cc([C@@H]([NH2+]CCCC[NH+]2CCN(C)CC2)c2ccccc2Cl)ccc1F ZINC000537607016 938332398 /nfs/dbraw/zinc/33/23/98/938332398.db2.gz CRALIDSMGBOYBX-HSZRJFAPSA-N 2 0 403.973 4.494 20 0 HIADRP COc1ccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)c2ccccc12 ZINC000537622534 938337160 /nfs/dbraw/zinc/33/71/60/938337160.db2.gz BOOQZYGAFGOLFH-UHFFFAOYSA-N 2 0 409.618 4.477 20 0 HIADRP C[NH+](C)CCOc1ccccc1N1CC[NH+](Cc2cccc(-c3ccncc3)c2)CC1 ZINC000537630882 938340427 /nfs/dbraw/zinc/34/04/27/938340427.db2.gz BSYJOBCYBCZVRL-UHFFFAOYSA-N 2 0 416.569 4.011 20 0 HIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(-c4nc5ccccc5s4)o3)C2)CC1 ZINC000537658736 938348600 /nfs/dbraw/zinc/34/86/00/938348600.db2.gz CFICVNYCUPNWHE-GOSISDBHSA-N 2 0 410.587 4.157 20 0 HIADRP Cc1ccc([C@@H](C)NC(=O)C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1C ZINC000537840992 938387373 /nfs/dbraw/zinc/38/73/73/938387373.db2.gz ILFXFDRPSHWDGN-OAQYLSRUSA-N 2 0 408.590 4.114 20 0 HIADRP C[C@H](C(=O)Nc1ccc(Cl)cc1)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537844265 938388258 /nfs/dbraw/zinc/38/82/58/938388258.db2.gz XFGFJYYLLHRNEZ-QGZVFWFLSA-N 2 0 400.954 4.301 20 0 HIADRP Cn1ccnc1COc1ccc(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000537845249 938388510 /nfs/dbraw/zinc/38/85/10/938388510.db2.gz RWBKAZUSJCQVAD-UHFFFAOYSA-N 2 0 419.573 4.133 20 0 HIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000537939522 938424518 /nfs/dbraw/zinc/42/45/18/938424518.db2.gz SRGXKDMWPOOVOW-SVFBPWRDSA-N 2 0 415.603 4.009 20 0 HIADRP Cc1cc(C[C@@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)n(-c2ccccc2)n1 ZINC000537948512 938428391 /nfs/dbraw/zinc/42/83/91/938428391.db2.gz PWKOBVOIIOCPAN-CTNGQTDRSA-N 2 0 406.574 4.403 20 0 HIADRP CSc1ccc([C@@H](C)[NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)cc1F ZINC000537968917 938439750 /nfs/dbraw/zinc/43/97/50/938439750.db2.gz DMMRNUHMFCAVON-QGZVFWFLSA-N 2 0 415.578 4.224 20 0 HIADRP Fc1ccccc1[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)C1CCCC1 ZINC000538101075 938502470 /nfs/dbraw/zinc/50/24/70/938502470.db2.gz OLVBMRZIFTZTGN-HSZRJFAPSA-N 2 0 411.569 4.039 20 0 HIADRP CC(C)Oc1ccccc1[C@@H](C)[NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000538122488 938509636 /nfs/dbraw/zinc/50/96/36/938509636.db2.gz DQVWSPCFJOJFLW-HXUWFJFHSA-N 2 0 409.574 4.037 20 0 HIADRP CC[C@H](C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2ccccc2C1 ZINC000538268916 938579870 /nfs/dbraw/zinc/57/98/70/938579870.db2.gz QLTGNLKPBDRMKK-NOZRDPDXSA-N 2 0 419.613 4.401 20 0 HIADRP CC(C)[C@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)CCO1 ZINC000538507687 938637935 /nfs/dbraw/zinc/63/79/35/938637935.db2.gz YCWAFTGDQTWYTK-AOYPEHQESA-N 2 0 407.602 4.302 20 0 HIADRP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3cccc(OCc4ccc(F)cc4)c3)C2)CC1 ZINC000538764237 938705173 /nfs/dbraw/zinc/70/51/73/938705173.db2.gz VSQAAAGQJOFPRF-DEOSSOPVSA-N 2 0 411.565 4.005 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000538944102 938743672 /nfs/dbraw/zinc/74/36/72/938743672.db2.gz UUWHGDXZWHJBAS-UHFFFAOYSA-N 2 0 420.479 4.277 20 0 HIADRP C[C@H](C(=O)N1CCSc2ccccc21)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538945623 938744008 /nfs/dbraw/zinc/74/40/08/938744008.db2.gz RFFPOOWJQMSHTB-LJQANCHMSA-N 2 0 424.614 4.147 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000539044068 938780127 /nfs/dbraw/zinc/78/01/27/938780127.db2.gz IKYILMVSHVQYDF-PBNUPURSSA-N 2 0 403.517 4.001 20 0 HIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000539061132 938787911 /nfs/dbraw/zinc/78/79/11/938787911.db2.gz LKNRPEHEIXKGRU-WXFUMESZSA-N 2 0 400.513 4.216 20 0 HIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CCN(C(=O)NC3CCCCC3)CC2)CC1 ZINC000539078788 938796830 /nfs/dbraw/zinc/79/68/30/938796830.db2.gz CAJWTGASNMNVIY-AUSIDOKSSA-N 2 0 404.643 4.126 20 0 HIADRP CC[N@H+](CCC1CC[NH+](CC(=O)N2CCc3[nH]c4ccccc4c3C2)CC1)CC(C)C ZINC000539098763 938802783 /nfs/dbraw/zinc/80/27/83/938802783.db2.gz VBOLQCOAHMACSA-UHFFFAOYSA-N 2 0 424.633 4.133 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H](c3ccc(Cl)cc3)C3CC3)c2)C1 ZINC000539201394 938818695 /nfs/dbraw/zinc/81/86/95/938818695.db2.gz YOBHRNNNROEBJP-FYYLOGMGSA-N 2 0 411.977 4.278 20 0 HIADRP C[C@H]([NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)c1cccc(N2CCCC2=O)c1 ZINC000539361946 938848690 /nfs/dbraw/zinc/84/86/90/938848690.db2.gz MELFTMLOQISNAW-CVDCTZTESA-N 2 0 419.569 4.452 20 0 HIADRP COc1cccc(N2CC[C@H](C[NH2+][C@@H]3CC4(CC[NH+](C)CC4)Oc4ccccc43)C2)c1 ZINC000539363709 938849171 /nfs/dbraw/zinc/84/91/71/938849171.db2.gz QSWZXPDSKAJQRK-HYBUGGRVSA-N 2 0 421.585 4.099 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H](NCCC[N@@H+]1CCc3ccccc3C1)c1ccccc1O2 ZINC000539368474 938849849 /nfs/dbraw/zinc/84/98/49/938849849.db2.gz ADCWIOYMZHGAFN-XMMPIXPASA-N 2 0 405.586 4.013 20 0 HIADRP c1cc(C[NH+]2CCC[C@H]2C2CCOCC2)cc(C[N@@H+]2CCC[C@H]2C2CCOCC2)c1 ZINC000539727758 938914492 /nfs/dbraw/zinc/91/44/92/938914492.db2.gz QZMPOTLNXFIBOR-UIOOFZCWSA-N 2 0 412.618 4.469 20 0 HIADRP CC1CC[NH+](CCc2cccc(NC(=O)NC[C@@H](c3cccs3)[NH+](C)C)c2)CC1 ZINC000539872142 938962706 /nfs/dbraw/zinc/96/27/06/938962706.db2.gz VOXUJQNDZMJSAR-NRFANRHFSA-N 2 0 414.619 4.447 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1cccc(C(F)(F)F)c1 ZINC000540261172 939176411 /nfs/dbraw/zinc/17/64/11/939176411.db2.gz UKVMLPRAKNIASV-OAQYLSRUSA-N 2 0 406.496 4.339 20 0 HIADRP CC[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1nccn1C ZINC000540404636 939236450 /nfs/dbraw/zinc/23/64/50/939236450.db2.gz SQNDSWHQWRZKET-HXUWFJFHSA-N 2 0 423.527 4.082 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2c(C)nn(-c3ccccc3)c2C)CC1 ZINC000540514021 939283540 /nfs/dbraw/zinc/28/35/40/939283540.db2.gz PQTRQMVTTHFBFP-UHFFFAOYSA-N 2 0 417.601 4.311 20 0 HIADRP CSC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(C(F)(F)F)cc1 ZINC000540988630 939425903 /nfs/dbraw/zinc/42/59/03/939425903.db2.gz HWCJNEMCFOHHKD-IBGZPJMESA-N 2 0 424.536 4.046 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]C2CC(c3cccc(Cl)c3)C2)cc1 ZINC000541207654 939485703 /nfs/dbraw/zinc/48/57/03/939485703.db2.gz QKBPXRIKFWUFQI-UHFFFAOYSA-N 2 0 411.977 4.201 20 0 HIADRP CC(=O)Nc1ccc([C@H](C)[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000541914143 939652151 /nfs/dbraw/zinc/65/21/51/939652151.db2.gz KYAGMJDFZQAUGX-FQEVSTJZSA-N 2 0 409.574 4.367 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cc(F)cc(Br)c1 ZINC000541915116 939652776 /nfs/dbraw/zinc/65/27/76/939652776.db2.gz YFCMTTLYIHLFMZ-SFTDATJTSA-N 2 0 421.354 4.396 20 0 HIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCCc2nc(-c3ccc(F)cc3)no2)CC1 ZINC000542483600 939831218 /nfs/dbraw/zinc/83/12/18/939831218.db2.gz QSEAAGXLYMPENH-LAUBAEHRSA-N 2 0 400.542 4.441 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](CCOc3ccc(Oc4ccccc4)cc3)CC2)CC1 ZINC000542592146 939847128 /nfs/dbraw/zinc/84/71/28/939847128.db2.gz XPUCBKOYVLCHEB-UHFFFAOYSA-N 2 0 423.601 4.207 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCc2ccc(OC(F)(F)F)cc21 ZINC000542851058 939862967 /nfs/dbraw/zinc/86/29/67/939862967.db2.gz FSMYKFHGDYPHCK-KNQAVFIVSA-N 2 0 420.475 4.319 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2csc(-c3ccc(C(N)=O)cc3)n2)CC1 ZINC000542946045 939883709 /nfs/dbraw/zinc/88/37/09/939883709.db2.gz CIDGDBAYOYDSDS-UHFFFAOYSA-N 2 0 414.619 4.243 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000543324182 940030988 /nfs/dbraw/zinc/03/09/88/940030988.db2.gz NVNXOTAHUXKVCM-AHWVRZQESA-N 2 0 417.597 4.408 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000543324196 940031057 /nfs/dbraw/zinc/03/10/57/940031057.db2.gz NVNXOTAHUXKVCM-RSXGOPAZSA-N 2 0 417.597 4.408 20 0 HIADRP COC1CCC([NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000543398408 940051644 /nfs/dbraw/zinc/05/16/44/940051644.db2.gz LWKOBTWEZDRLAA-UHFFFAOYSA-N 2 0 413.528 4.155 20 0 HIADRP CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000543405323 940054483 /nfs/dbraw/zinc/05/44/83/940054483.db2.gz XBYQTBGVHZPENE-UQBPGWFLSA-N 2 0 406.549 4.079 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000543408217 940055478 /nfs/dbraw/zinc/05/54/78/940055478.db2.gz AHEFAPUYOAMNOB-VQTJNVASSA-N 2 0 410.558 4.464 20 0 HIADRP COc1ccc(Oc2ccc(C[NH+]3CCC(C)(C[NH+]4CCN(C)CC4)CC3)cc2)cc1 ZINC000543618722 940135031 /nfs/dbraw/zinc/13/50/31/940135031.db2.gz VCLORVGMPPNAIG-UHFFFAOYSA-N 2 0 423.601 4.337 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000543776957 940183668 /nfs/dbraw/zinc/18/36/68/940183668.db2.gz RASMRMSTQAPQQA-JXFKEZNVSA-N 2 0 408.464 4.045 20 0 HIADRP Fc1ccc([C@@H]([NH2+]CCCN2CC[NH+](Cc3ccccc3)CC2)c2ccccn2)cc1 ZINC000544361664 940401587 /nfs/dbraw/zinc/40/15/87/940401587.db2.gz VXAVEFFREVIVLX-AREMUKBSSA-N 2 0 418.560 4.108 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H](c1ccc(F)cc1)c1cnc2ccccc2c1)N1CC[NH+](C)CC1 ZINC000544366708 940403285 /nfs/dbraw/zinc/40/32/85/940403285.db2.gz TYOUQQNSJIXEFA-IZZNHLLZSA-N 2 0 420.576 4.325 20 0 HIADRP Cc1ccc(-c2noc(CCC[NH2+][C@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)n2)cc1F ZINC000544421238 940420626 /nfs/dbraw/zinc/42/06/26/940420626.db2.gz KDOREKWDHMLNQR-IEBWSBKVSA-N 2 0 400.542 4.359 20 0 HIADRP C[NH+](C)CCOc1cccc(-c2noc([C@@H]3CCC[N@H+](Cc4ccccc4)C3)n2)c1 ZINC000544780432 940513204 /nfs/dbraw/zinc/51/32/04/940513204.db2.gz OUUYNEDWXXKFKS-OAQYLSRUSA-N 2 0 406.530 4.057 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)CC1 ZINC000563933984 945328719 /nfs/dbraw/zinc/32/87/19/945328719.db2.gz AUPAVUUKHQXCTR-DEOSSOPVSA-N 2 0 404.533 4.046 20 0 HIADRP CCC1(C[NH2+][C@@H](Cc2ccc(Cl)cc2)C(N)=O)CC[NH+](Cc2ccccc2)CC1 ZINC000546886669 940901942 /nfs/dbraw/zinc/90/19/42/940901942.db2.gz AYVTZIRCOHQAKT-QFIPXVFZSA-N 2 0 413.993 4.018 20 0 HIADRP C[C@H]([NH2+]C1(CN[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCOCC1)c1ccccc1 ZINC000547503073 941066068 /nfs/dbraw/zinc/06/60/68/941066068.db2.gz CADBTYNOXCSKBC-FXSPECFOSA-N 2 0 421.629 4.387 20 0 HIADRP C[C@H]([NH2+]C[C@@H](CO)Cc1ccc(C(F)(F)F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548154134 941089324 /nfs/dbraw/zinc/08/93/24/941089324.db2.gz FDLVCFMFHADPDV-YUXAGFNASA-N 2 0 420.519 4.357 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548483449 941107744 /nfs/dbraw/zinc/10/77/44/941107744.db2.gz MEIFUGFPOAAPHP-YKSBVNFPSA-N 2 0 414.553 4.334 20 0 HIADRP c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+][C@H]3CCC34CCOCC4)CC2)cc1 ZINC000548794468 941124291 /nfs/dbraw/zinc/12/42/91/941124291.db2.gz GHZDRIGUVOESRP-VWLOTQADSA-N 2 0 405.586 4.058 20 0 HIADRP O=C(c1ccccc1)N1CC[C@H](C[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)C1 ZINC000548919265 941129034 /nfs/dbraw/zinc/12/90/34/941129034.db2.gz OQDXBKYHWLTXCX-SHQCIBLASA-N 2 0 417.597 4.137 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)c1ccc(C[NH+]2CCCC2)cc1)c1cccc(C(F)(F)F)c1 ZINC000549035692 941146653 /nfs/dbraw/zinc/14/66/53/941146653.db2.gz HMZNZGQKOHKOCZ-OAQYLSRUSA-N 2 0 419.491 4.334 20 0 HIADRP COc1ccccc1[C@@H](CNC(=O)c1ccc(C[NH+]2CCCC2)cc1)[NH+]1CCCCC1 ZINC000549414296 941187575 /nfs/dbraw/zinc/18/75/75/941187575.db2.gz CNBFRCZGLVYKNL-XMMPIXPASA-N 2 0 421.585 4.248 20 0 HIADRP C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000549582957 941200362 /nfs/dbraw/zinc/20/03/62/941200362.db2.gz MNOJTYQLVYINOK-NRFANRHFSA-N 2 0 421.585 4.434 20 0 HIADRP Cc1cc(NC[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c2ccccc2[nH+]1 ZINC000549617287 941201474 /nfs/dbraw/zinc/20/14/74/941201474.db2.gz IORUSCCGZDOYEV-JOCHJYFZSA-N 2 0 401.554 4.306 20 0 HIADRP Cc1ccc2[nH+]ccc(NC[C@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)c2c1 ZINC000549617223 941201548 /nfs/dbraw/zinc/20/15/48/941201548.db2.gz QHPBKNQBLSYDMI-QFIPXVFZSA-N 2 0 401.554 4.306 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCC[C@@H]([C@@H]4CCOC4)C3)C3(C2)CCOCC3)cc1 ZINC000549876424 941223612 /nfs/dbraw/zinc/22/36/12/941223612.db2.gz KITHQYWRSDAOPS-ZKGSSEMHSA-N 2 0 412.618 4.100 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCC[C@@H]([C@H]4CCOC4)C3)C3(C2)CCOCC3)cc1 ZINC000549876423 941223733 /nfs/dbraw/zinc/22/37/33/941223733.db2.gz KITHQYWRSDAOPS-WSOYEBOPSA-N 2 0 412.618 4.100 20 0 HIADRP COc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1Cl ZINC000549877816 941223979 /nfs/dbraw/zinc/22/39/79/941223979.db2.gz WNGBUTOHIAWNEE-NRFANRHFSA-N 2 0 414.977 4.367 20 0 HIADRP O=C(c1ccccc1)N1CC[C@@H](C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC000550122764 941286936 /nfs/dbraw/zinc/28/69/36/941286936.db2.gz NFTNIYDCDUTLAL-DEOSSOPVSA-N 2 0 417.597 4.137 20 0 HIADRP COc1cc([C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)ccc1F ZINC000550883434 941378454 /nfs/dbraw/zinc/37/84/54/941378454.db2.gz ZNWSFCMCFZUQKN-SIKLNZKXSA-N 2 0 412.549 4.414 20 0 HIADRP CC(C)CO[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1(C)C ZINC000550882009 941378566 /nfs/dbraw/zinc/37/85/66/941378566.db2.gz HFBFDQYOVLQXKH-WXFUMESZSA-N 2 0 414.634 4.345 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1OC ZINC000550881853 941378701 /nfs/dbraw/zinc/37/87/01/941378701.db2.gz DVFXXDGWUBVTNB-NFBKMPQASA-N 2 0 424.585 4.283 20 0 HIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551265289 941439272 /nfs/dbraw/zinc/43/92/72/941439272.db2.gz SGHSPRGOSPXOBP-ZJSXRUAMSA-N 2 0 424.560 4.340 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC[C@H]1C[NH+](Cc2ccccc2)CCCO1 ZINC000551397030 941469434 /nfs/dbraw/zinc/46/94/34/941469434.db2.gz YHHLXHGYSIICCN-AYFYORAVSA-N 2 0 421.629 4.024 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CCN(c3cc[nH+]c4ccccc43)CC2)cc1)C(C)C ZINC000552007984 941567752 /nfs/dbraw/zinc/56/77/52/941567752.db2.gz ZUGQSSBWCGHONW-UHFFFAOYSA-N 2 0 416.569 4.428 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]C4CCN(Cc5ccncc5)CC4)[C@@H]3C2)cc1 ZINC000552040910 941571763 /nfs/dbraw/zinc/57/17/63/941571763.db2.gz KFOUHMNKVSQYNS-WYMJOSIYSA-N 2 0 418.629 4.326 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccccc2C[NH+]2CCC[C@@H]2CO)CC1 ZINC000552280269 941621429 /nfs/dbraw/zinc/62/14/29/941621429.db2.gz AXQNLYUIVCJJPZ-WZDPVOGJSA-N 3 0 421.629 4.176 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NCc2ccc(OC3CC[NH+](C)CC3)cc2)cc1)C1CC1 ZINC000552433700 941669988 /nfs/dbraw/zinc/66/99/88/941669988.db2.gz XTZKGGJNIXGFFW-UHFFFAOYSA-N 2 0 421.585 4.074 20 0 HIADRP COCCC[NH+]1CCC([NH2+][C@H]2c3cc(Br)ccc3SC[C@H]2C)CC1 ZINC000553293923 941862404 /nfs/dbraw/zinc/86/24/04/941862404.db2.gz QCROPVWMJZSKCW-AUUYWEPGSA-N 2 0 413.425 4.323 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)COc1c(Cl)cccc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000554537827 942165436 /nfs/dbraw/zinc/16/54/36/942165436.db2.gz QEKQCYMCAGZHRB-WDSOQIARSA-N 2 0 423.384 4.233 20 0 HIADRP FC(F)Oc1cccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000555612583 942669634 /nfs/dbraw/zinc/66/96/34/942669634.db2.gz UWGFHPSWAHTIAH-NRFANRHFSA-N 2 0 416.512 4.306 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+]Cc3cccc4cccnc43)C3(C2)CCOCC3)cc1 ZINC000555619120 942673180 /nfs/dbraw/zinc/67/31/80/942673180.db2.gz ZSUFKWPUGFRGQH-XMMPIXPASA-N 2 0 401.554 4.253 20 0 HIADRP CN1CC[C@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000556057913 942797954 /nfs/dbraw/zinc/79/79/54/942797954.db2.gz YMWNGEZPXVDLCB-AZGAKELHSA-N 3 0 406.618 4.014 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCCC[C@H]3[C@@H]3CCOC3)C3(C2)CCOCC3)cc1 ZINC000556229404 942822410 /nfs/dbraw/zinc/82/24/10/942822410.db2.gz HNSFCHIDGWZVIK-WSOYEBOPSA-N 2 0 412.618 4.100 20 0 HIADRP O=C(C[NH2+]C1(c2ccc(Cl)cc2)CC1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000557540866 943200159 /nfs/dbraw/zinc/20/01/59/943200159.db2.gz JHMMBMMZVWUMHK-UHFFFAOYSA-N 2 0 415.990 4.106 20 0 HIADRP Cc1cc(C)c(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c(OCc2ccccc2)n1 ZINC000558099053 943379380 /nfs/dbraw/zinc/37/93/80/943379380.db2.gz XMBVMJDVSHCNCF-UHFFFAOYSA-N 2 0 423.601 4.354 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000558167129 943405569 /nfs/dbraw/zinc/40/55/69/943405569.db2.gz XTPPFNKEUSOURF-UXHICEINSA-N 2 0 407.480 4.467 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000558167132 943405653 /nfs/dbraw/zinc/40/56/53/943405653.db2.gz XTPPFNKEUSOURF-VQTJNVASSA-N 2 0 407.480 4.467 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1cccc(-n2ccnn2)c1 ZINC000558242055 943455525 /nfs/dbraw/zinc/45/55/25/943455525.db2.gz YFHXCMISOATPMU-IBGZPJMESA-N 2 0 401.514 4.343 20 0 HIADRP O=C([C@H]1CC[N@@H+](C2CCCCC2)C1)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000558304213 943494753 /nfs/dbraw/zinc/49/47/53/943494753.db2.gz SLZNLQPQGYUYNY-QHCPKHFHSA-N 2 0 409.618 4.156 20 0 HIADRP CCN(CC[NH+]1CCCCCC1)C(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000558321344 943506361 /nfs/dbraw/zinc/50/63/61/943506361.db2.gz CZFOMWDQRLRFCG-UHFFFAOYSA-N 2 0 418.651 4.008 20 0 HIADRP CSC1(C[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc(C)o2)CC[NH+](C)CC1 ZINC000558493800 943574538 /nfs/dbraw/zinc/57/45/38/943574538.db2.gz LCFFGEJDDCQFOD-UHFFFAOYSA-N 2 0 410.587 4.358 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1cc(Br)ccc1F)C1CC[NH+](C)CC1 ZINC000559324603 943896428 /nfs/dbraw/zinc/89/64/28/943896428.db2.gz ZZZUCPJOBIUDNN-UHFFFAOYSA-N 2 0 420.370 4.408 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccnc(OC3CCOCC3)c2)CC1 ZINC000559893019 944077116 /nfs/dbraw/zinc/07/71/16/944077116.db2.gz IIVIXYRKFXDKQQ-UHFFFAOYSA-N 2 0 409.574 4.172 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccccc3OCc3cccnc3)cc2)CC1 ZINC000560067010 944147645 /nfs/dbraw/zinc/14/76/45/944147645.db2.gz MWXKBBKJFFBGPA-UHFFFAOYSA-N 2 0 417.553 4.423 20 0 HIADRP Cc1c(Br)cc(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1Br ZINC000560073360 944149075 /nfs/dbraw/zinc/14/90/75/944149075.db2.gz UWAZCPHOWZGVRD-GFCCVEGCSA-N 2 0 402.174 4.094 20 0 HIADRP COc1cc(F)c([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc1OC ZINC000560885648 944364447 /nfs/dbraw/zinc/36/44/47/944364447.db2.gz ZJDLAFCTVNLDDO-LJQANCHMSA-N 2 0 415.553 4.096 20 0 HIADRP CCOc1ccc([C@H](CC)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1OCC ZINC000560921733 944370460 /nfs/dbraw/zinc/37/04/60/944370460.db2.gz ZGSWFPDRSPPLAX-FKBYEOEOSA-N 2 0 404.595 4.293 20 0 HIADRP CC[C@H]([NH2+]Cc1ccncc1OCCC[NH+](C)C)c1ccc(Br)cc1 ZINC000564149492 945401043 /nfs/dbraw/zinc/40/10/43/945401043.db2.gz WEWIECWPCMOGCB-IBGZPJMESA-N 2 0 406.368 4.416 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](C)c3ccc(C(F)(F)F)cc3)cn2)CC1 ZINC000564298445 945505440 /nfs/dbraw/zinc/50/54/40/945505440.db2.gz JCRUJTIRFJYFOA-QGZVFWFLSA-N 2 0 406.496 4.136 20 0 HIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1 ZINC000564419842 945571764 /nfs/dbraw/zinc/57/17/64/945571764.db2.gz RCMPKIKOWCAUJI-KKUQBAQOSA-N 2 0 408.586 4.337 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NC[C@H]2CCCC[NH+](Cc3ccccc3)C2)CC1 ZINC000564658751 945719541 /nfs/dbraw/zinc/71/95/41/945719541.db2.gz QHWNVTAFOBSLOS-XMMPIXPASA-N 2 0 414.638 4.051 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(NC(=O)c2oc3ccccc3c2C[NH+](C)C)c1 ZINC000565486366 945836794 /nfs/dbraw/zinc/83/67/94/945836794.db2.gz JROODFOXFIGDLF-UHFFFAOYSA-N 2 0 422.529 4.027 20 0 HIADRP C[C@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000566996640 946207810 /nfs/dbraw/zinc/20/78/10/946207810.db2.gz JNPCZUGJKNAMIY-GJZGRUSLSA-N 2 0 412.361 4.274 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H]1CCc2c1cc(Cl)cc2Br ZINC000566996874 946208998 /nfs/dbraw/zinc/20/89/98/946208998.db2.gz NURMZJHKXQHXOC-SFHVURJKSA-N 2 0 424.770 4.215 20 0 HIADRP CCO[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C12CCCC2 ZINC000567128946 946246900 /nfs/dbraw/zinc/24/69/00/946246900.db2.gz NQXXYWSRDZHULS-WXFUMESZSA-N 2 0 412.618 4.243 20 0 HIADRP COCC(=O)Nc1cccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000567495544 946351267 /nfs/dbraw/zinc/35/12/67/946351267.db2.gz LHIQKXZWBBLHMC-ZKMPZPQNSA-N 2 0 421.585 4.052 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+]CCC(=O)Nc2ccccn2)c2ccc(F)cc2)CC1 ZINC000568930761 946765619 /nfs/dbraw/zinc/76/56/19/946765619.db2.gz SUUFGNPDADTSHV-QFIPXVFZSA-N 2 0 412.553 4.392 20 0 HIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000569158487 946827651 /nfs/dbraw/zinc/82/76/51/946827651.db2.gz MULMCENKEZAAAB-JHNUBAFKSA-N 2 0 415.528 4.270 20 0 HIADRP C(CC[NH+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1)CC[N@@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000569746375 946971361 /nfs/dbraw/zinc/97/13/61/946971361.db2.gz LGUHIPURUAEXLH-BJESRGMDSA-N 2 0 402.623 4.224 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000570061529 947081033 /nfs/dbraw/zinc/08/10/33/947081033.db2.gz VNMMYIOTSJLUMB-LJQANCHMSA-N 2 0 403.574 4.406 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)NC[C@H](C2CCCCC2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000571007170 947431628 /nfs/dbraw/zinc/43/16/28/947431628.db2.gz AIBRIACIAWCREW-AGILITTLSA-N 2 0 414.638 4.191 20 0 HIADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[NH+](Cc4ccccc4)C[C@H]3C2)c(-c2cnn(C)c2)c1 ZINC000571098204 947495098 /nfs/dbraw/zinc/49/50/98/947495098.db2.gz LDFKYZOCMWPTQW-DHLKQENFSA-N 2 0 400.570 4.349 20 0 HIADRP CC[NH+](CC)CCOc1ccc(-c2noc([C@]3(F)CC[N@@H+](C(C)(C)C)C3)n2)cc1 ZINC000571249348 947568647 /nfs/dbraw/zinc/56/86/47/947568647.db2.gz ICCDFCPJIZJQRX-QFIPXVFZSA-N 2 0 404.530 4.126 20 0 HIADRP C[C@@H](C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000572079798 947841543 /nfs/dbraw/zinc/84/15/43/947841543.db2.gz RMVCKSKNYALBFZ-AVRDEDQJSA-N 2 0 405.508 4.387 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H]2CCC[C@H](c3ccnn3C)C2)CC1 ZINC000572330909 947886722 /nfs/dbraw/zinc/88/67/22/947886722.db2.gz ICRVIAKTPKZHGX-IRFCIJBXSA-N 2 0 413.585 4.078 20 0 HIADRP CN1CC[NH+](CC2CC[NH+](Cc3cccc(OCCCc4ccccc4)c3)CC2)CC1 ZINC000572388102 947892141 /nfs/dbraw/zinc/89/21/41/947892141.db2.gz KVDAAORREJEXKD-UHFFFAOYSA-N 2 0 421.629 4.158 20 0 HIADRP C[C@@H]1C[N@@H+](CCC2CC[NH+](Cc3ccc(OCc4cccnc4)cc3)CC2)C[C@H](C)O1 ZINC000574062461 948355166 /nfs/dbraw/zinc/35/51/66/948355166.db2.gz UTRPOZFGOSCYSJ-SZPZYZBQSA-N 2 0 423.601 4.372 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H]1CCCCc2cc(Br)ccc21 ZINC000574672013 948501145 /nfs/dbraw/zinc/50/11/45/948501145.db2.gz SGBSKXASJPOADS-FQEVSTJZSA-N 2 0 418.379 4.342 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@@H]1CCCCc2cc(Br)ccc21 ZINC000574672014 948501315 /nfs/dbraw/zinc/50/13/15/948501315.db2.gz SGBSKXASJPOADS-HXUWFJFHSA-N 2 0 418.379 4.342 20 0 HIADRP c1csc(-c2noc(CCC[N@H+]3C[C@@H]4C[NH+](Cc5ccccc5)CC[C@@H]4C3)n2)c1 ZINC000575840379 948736449 /nfs/dbraw/zinc/73/64/49/948736449.db2.gz QRRNJNNXSAUQEJ-WOJBJXKFSA-N 2 0 408.571 4.185 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(Br)cn3)CC2)cc1 ZINC000575850224 948741822 /nfs/dbraw/zinc/74/18/22/948741822.db2.gz HHWUOEPXWJRJQA-INIZCTEOSA-N 2 0 418.379 4.416 20 0 HIADRP Cc1cccc([C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C(=O)NC[C@@H]2CC[N@@H+](C(C)C)C2)c1 ZINC000575886509 948748318 /nfs/dbraw/zinc/74/83/18/948748318.db2.gz WRIIXWDFISHATF-DMDYGQEQSA-N 2 0 419.613 4.057 20 0 HIADRP FC(F)(c1cnc(Cl)c(C2=CC[NH2+]CC2)c1)N1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001164418837 718893718 /nfs/dbraw/zinc/89/37/18/718893718.db2.gz FHHXHXATFIEXHG-LJQANCHMSA-N 2 0 410.940 4.015 20 0 HIADRP Cc1nc(C[N@@H+]2CCCC23CCN(c2ncccc2C[NH+]2CCCC2)CC3)cs1 ZINC001164700256 719816570 /nfs/dbraw/zinc/81/65/70/719816570.db2.gz KQXQVHRSHNXFQU-UHFFFAOYSA-N 2 0 411.619 4.077 20 0 HIADRP COC[C@@H]1CC2(C[N@@H+]1Cc1ccccn1)CCN(c1[nH+]c(C)cc3ccccc31)CC2 ZINC001164713608 720127906 /nfs/dbraw/zinc/12/79/06/720127906.db2.gz STJGAKQUBKWEFV-QHCPKHFHSA-N 2 0 416.569 4.446 20 0 HIADRP COc1ccc2c(cc[nH+]c2N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)c1 ZINC001165023340 721805754 /nfs/dbraw/zinc/80/57/54/721805754.db2.gz JNWHBTPEMDRGQT-WDJPJFJCSA-N 2 0 402.542 4.375 20 0 HIADRP Cc1cc2ccccc2c(N2CCC3(CC2)COCC[N@H+](Cc2ccncc2)C3)[nH+]1 ZINC001164963389 722057893 /nfs/dbraw/zinc/05/78/93/722057893.db2.gz YDQZOXUDPGERPJ-UHFFFAOYSA-N 2 0 402.542 4.057 20 0 HIADRP CC[NH+]1CCN(c2ccc(NC(=O)C[NH2+][C@@H](C)c3cccc4ccccc43)cc2)CC1 ZINC000007242974 845294872 /nfs/dbraw/zinc/29/48/72/845294872.db2.gz MUWASTWKHKDCOO-FQEVSTJZSA-N 2 0 416.569 4.271 20 0 HIADRP O=C([C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1)N1CCCCC1 ZINC000436281189 861590454 /nfs/dbraw/zinc/59/04/54/861590454.db2.gz FXTZHIXROSYBIG-ABZQKAAASA-N 2 0 409.618 4.058 20 0 HIADRP CC1CC[NH+](C2CCC([NH2+]C3CCC(N4C(=O)c5ccccc5C4=O)CC3)CC2)CC1 ZINC000436401926 861747826 /nfs/dbraw/zinc/74/78/26/861747826.db2.gz SAUIDXOPNKWYIR-UHFFFAOYSA-N 2 0 423.601 4.227 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)NC[C@H](c3cccs3)[NH+](C)C)cc2)CC1 ZINC000026381450 847137773 /nfs/dbraw/zinc/13/77/73/847137773.db2.gz QHUYFVVASVJJKD-OAQYLSRUSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)N2CCC[N@@H+](C(C)(C)C)CC2)C1 ZINC000060545623 851141225 /nfs/dbraw/zinc/14/12/25/851141225.db2.gz KUYLZZJUXDZIHA-SFTDATJTSA-N 2 0 414.638 4.180 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)c3cccc(C[NH+]4CCCC4)c3)cc2)C1 ZINC000060581921 851155551 /nfs/dbraw/zinc/15/55/51/851155551.db2.gz RZQSADHUNLPZEX-OAQYLSRUSA-N 2 0 405.586 4.444 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)cc1 ZINC000061112548 851296200 /nfs/dbraw/zinc/29/62/00/851296200.db2.gz KAKPRMCCHMIDTJ-NQIIRXRSSA-N 2 0 414.619 4.225 20 0 HIADRP C[C@H](OC[C@@H](O)C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)c1ccc(Cl)cc1 ZINC000061735391 851433270 /nfs/dbraw/zinc/43/32/70/851433270.db2.gz MVVVNVVJLYKVHY-CVDCTZTESA-N 2 0 409.014 4.367 20 0 HIADRP CCCc1cc[n+](C(C(=O)c2ccc(CC)cc2)C(=S)NC2CC[NH+](C)CC2)cc1 ZINC000063441528 851690897 /nfs/dbraw/zinc/69/08/97/851690897.db2.gz VZOMVCFTMMRKHP-UHFFFAOYSA-O 2 0 424.634 4.112 20 0 HIADRP C[C@@H](CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)[NH+]1CCC(C)CC1 ZINC000065476988 852150322 /nfs/dbraw/zinc/15/03/22/852150322.db2.gz IKBSJFYXHPSKRD-NRFANRHFSA-N 2 0 422.617 4.335 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)cc1 ZINC000065521786 852167073 /nfs/dbraw/zinc/16/70/73/852167073.db2.gz LBFHSEZUJFOKAG-RDPSFJRHSA-N 2 0 408.590 4.163 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)CC1 ZINC000071922969 852431234 /nfs/dbraw/zinc/43/12/34/852431234.db2.gz IAIOOLSKXXPUAJ-HSZRJFAPSA-N 2 0 424.589 4.079 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000079308934 852541871 /nfs/dbraw/zinc/54/18/71/852541871.db2.gz ISENMGIQMFXNTK-UHFFFAOYSA-N 2 0 409.555 4.296 20 0 HIADRP CC(C)c1ncc(C[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)s1 ZINC000236623749 853903646 /nfs/dbraw/zinc/90/36/46/853903646.db2.gz VFSDTCQGBOMVEB-UHFFFAOYSA-N 2 0 403.592 4.046 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]C[C@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000236814002 853926015 /nfs/dbraw/zinc/92/60/15/853926015.db2.gz KYCYWTLEHUTGJH-RSXGOPAZSA-N 2 0 407.602 4.476 20 0 HIADRP CC[NH+]1CCC(CC[NH2+]Cc2cn(Cc3ccccc3)nc2-c2cccnc2)CC1 ZINC000236830952 853927865 /nfs/dbraw/zinc/92/78/65/853927865.db2.gz UMSMMQDBNSHWGC-UHFFFAOYSA-N 2 0 403.574 4.205 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cc3ccccc3[nH]c2=O)CC1 ZINC000236850940 853929201 /nfs/dbraw/zinc/92/92/01/853929201.db2.gz DOVNOHRDVBTMJK-QGZVFWFLSA-N 2 0 408.521 4.072 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+]Cc2c(Cl)n(-c3ccccc3)nc2C(C)C)CC1 ZINC000236940618 853940560 /nfs/dbraw/zinc/94/05/60/853940560.db2.gz RFEKMAQWFZKBAI-UHFFFAOYSA-N 2 0 418.029 4.156 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+]Cc2ccc(-c3ccc(Br)cc3)s2)CC1 ZINC000236944623 853941376 /nfs/dbraw/zinc/94/13/76/853941376.db2.gz TTZVQDRAFQLDSR-UHFFFAOYSA-N 2 0 422.436 4.295 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+]Cc2ccc(-c3cccc(Br)c3)s2)CC1 ZINC000236945006 853941596 /nfs/dbraw/zinc/94/15/96/853941596.db2.gz XFCBCNZVJLKDFH-UHFFFAOYSA-N 2 0 422.436 4.295 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(CSC(F)F)o3)cc2)CC1 ZINC000236961727 853943632 /nfs/dbraw/zinc/94/36/32/853943632.db2.gz HRQIUEHBRWVPEZ-UHFFFAOYSA-N 2 0 409.546 4.163 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000236981189 853946373 /nfs/dbraw/zinc/94/63/73/853946373.db2.gz VROGLOPDAXKFHX-OAHLLOKOSA-N 2 0 420.916 4.380 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+]Cc2cc3ccccc3o2)CC1 ZINC000237100418 853964114 /nfs/dbraw/zinc/96/41/14/853964114.db2.gz ZYBDWZSGTWLTKW-UHFFFAOYSA-N 2 0 403.448 4.493 20 0 HIADRP COc1ccc(OCc2ccccn2)c(C[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c1 ZINC000237438060 854033940 /nfs/dbraw/zinc/03/39/40/854033940.db2.gz DORQHIDSWWJQRU-UHFFFAOYSA-N 2 0 409.505 4.160 20 0 HIADRP Cc1ncsc1C[NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000237661945 854070784 /nfs/dbraw/zinc/07/07/84/854070784.db2.gz YAJCBKSUKLYQOE-UHFFFAOYSA-N 2 0 412.525 4.162 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000237978017 854128725 /nfs/dbraw/zinc/12/87/25/854128725.db2.gz PEHRNFKEZULBRP-GOSISDBHSA-N 2 0 413.509 4.155 20 0 HIADRP O=C(CC[NH+]1CCC(C[NH+]2CCCC2)CC1)N[C@H](c1cccs1)c1ccccc1 ZINC000261456186 854269494 /nfs/dbraw/zinc/26/94/94/854269494.db2.gz ZLPXWYXBRQAHOW-DEOSSOPVSA-N 2 0 411.615 4.152 20 0 HIADRP Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000303152168 854787595 /nfs/dbraw/zinc/78/75/95/854787595.db2.gz FOLRURBWZVHRPO-FGZHOGPDSA-N 2 0 407.602 4.405 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NC[C@H](c1cccc(OC)c1)[NH+]1CCCC1)c1ccccc1 ZINC000303306581 854863178 /nfs/dbraw/zinc/86/31/78/854863178.db2.gz ZVNQNCDUNPJWOL-RPWUZVMVSA-N 2 0 409.574 4.031 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)C(=O)N(C)Cc2nc3ccccc3s2)CC1 ZINC000303564513 855042867 /nfs/dbraw/zinc/04/28/67/855042867.db2.gz LTSRRKWKBLNHSD-SFHVURJKSA-N 2 0 416.635 4.087 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000303689608 855135005 /nfs/dbraw/zinc/13/50/05/855135005.db2.gz MGQIXLLWXMHNDH-XUZZJYLKSA-N 2 0 405.586 4.240 20 0 HIADRP CC(C)(C)OC(=O)N1CCC[C@H]([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000309689655 855362915 /nfs/dbraw/zinc/36/29/15/855362915.db2.gz CNGZEEIKEJVHPZ-YADHBBJMSA-N 2 0 401.595 4.278 20 0 HIADRP C[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(Br)s1 ZINC000397633820 855473063 /nfs/dbraw/zinc/47/30/63/855473063.db2.gz OSDVTGOVMCKOJU-HNNXBMFYSA-N 2 0 409.393 4.188 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)N(CC[NH+](C)C)Cc3ccccc3)cc2)C1 ZINC000410353176 855944738 /nfs/dbraw/zinc/94/47/38/855944738.db2.gz KXEYKGGXFGZMQT-JOCHJYFZSA-N 2 0 422.617 4.192 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)ccn1 ZINC000426025860 856054622 /nfs/dbraw/zinc/05/46/22/856054622.db2.gz WVWOFYUMBYJCLH-JOCHJYFZSA-N 2 0 410.949 4.144 20 0 HIADRP Cc1ccc2cc([C@H](C)[NH2+]Cc3ccc(C(=O)NCC[NH+]4CCCC4)cc3)oc2c1 ZINC000426060341 856079638 /nfs/dbraw/zinc/07/96/38/856079638.db2.gz HCSWKSISYRDXLT-IBGZPJMESA-N 2 0 405.542 4.418 20 0 HIADRP COc1cc(Br)ccc1C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000427860420 856984726 /nfs/dbraw/zinc/98/47/26/856984726.db2.gz ZWDFFZXFVHDAAI-HNNXBMFYSA-N 2 0 407.352 4.249 20 0 HIADRP COc1cc(Br)ccc1C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000427866608 856987093 /nfs/dbraw/zinc/98/70/93/856987093.db2.gz RVEVNOBUUQLBMQ-HNNXBMFYSA-N 2 0 407.352 4.249 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)NCc2ccccc2C[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000428110194 857075347 /nfs/dbraw/zinc/07/53/47/857075347.db2.gz GAEJNLZKCGHPFH-OFVILXPXSA-N 2 0 420.601 4.135 20 0 HIADRP CC(=O)Nc1ccc(CC[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000428229363 857120192 /nfs/dbraw/zinc/12/01/92/857120192.db2.gz OPEJBCOQARVWNK-AYRHNUGRSA-N 2 0 405.586 4.468 20 0 HIADRP C[C@@H]([NH2+]CCC[NH2+][C@@H](C)[C@@H]1OCCc2sccc21)[C@H]1OCCc2sccc21 ZINC000429119979 857518643 /nfs/dbraw/zinc/51/86/43/857518643.db2.gz BFVOZXFLXQDLHZ-RWFYYTQISA-N 2 0 406.617 4.084 20 0 HIADRP Cc1oc(-c2ccsc2)nc1C[N@@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430943890 858377777 /nfs/dbraw/zinc/37/77/77/858377777.db2.gz QRTIOMRNBNQZIX-UHFFFAOYSA-N 2 0 416.635 4.340 20 0 HIADRP C[C@@H](CCN1CC[NH+](C2CCC(C)CC2)CC1)N1CC[NH+](C2CCC(C)CC2)CC1 ZINC000431599301 858682079 /nfs/dbraw/zinc/68/20/79/858682079.db2.gz ZOULAILSZYPGLA-MSZXXECISA-N 2 0 418.714 4.158 20 0 HIADRP CC(C)CC[NH+]1CCC(CNC(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CC1 ZINC000431626616 858698028 /nfs/dbraw/zinc/69/80/28/858698028.db2.gz WMQRYSLVPFDGMA-IRLDBZIGSA-N 2 0 420.667 4.188 20 0 HIADRP CC(C)c1nccn1Cc1cccc(NC(=O)N2CC[N@@H+](C3CCC3)C[C@H](C)C2)c1 ZINC000432676782 859286852 /nfs/dbraw/zinc/28/68/52/859286852.db2.gz IBKPEANGJOBMIN-IBGZPJMESA-N 2 0 409.578 4.393 20 0 HIADRP COc1ccc(-c2noc(CN3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)n2)cc1 ZINC000433165473 859549315 /nfs/dbraw/zinc/54/93/15/859549315.db2.gz CFLLNVKFZHSJHX-UHFFFAOYSA-N 2 0 418.541 4.233 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@@H]1CCCN(c2ccccc2)C1)C1CC[NH+](C)CC1 ZINC000433198480 859562767 /nfs/dbraw/zinc/56/27/67/859562767.db2.gz GEWGEERDTYMDDD-QFIPXVFZSA-N 2 0 406.618 4.223 20 0 HIADRP CC1CC[NH+](C2CCC([NH2+][C@@H](c3ccc(Cl)cc3)[C@@H]3CN(C)CCO3)CC2)CC1 ZINC000467734920 881537466 /nfs/dbraw/zinc/53/74/66/881537466.db2.gz KGKGKDMXSMXMLW-MXXWWZHRSA-N 2 0 420.041 4.344 20 0 HIADRP CN1CCO[C@@H]([C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c2ccc(Cl)cc2)C1 ZINC000467736042 881538527 /nfs/dbraw/zinc/53/85/27/881538527.db2.gz TWXGKSZDXZWXCS-RPWUZVMVSA-N 2 0 413.993 4.097 20 0 HIADRP C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000434897599 860542247 /nfs/dbraw/zinc/54/22/47/860542247.db2.gz XAFHRNJJXBRJNR-XXBNENTESA-N 2 0 409.599 4.052 20 0 HIADRP C[C@@H](Cc1ccccc1F)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000438206541 863638101 /nfs/dbraw/zinc/63/81/01/863638101.db2.gz NYEFULDDOBMMIM-IBGZPJMESA-N 2 0 400.538 4.036 20 0 HIADRP CC(C)Oc1c(Cl)cccc1NC(=O)NCC1([NH+]2CCCCC2)CCN(C)CC1 ZINC000438511833 863936369 /nfs/dbraw/zinc/93/63/69/863936369.db2.gz LHGATFOJVWLILY-UHFFFAOYSA-N 2 0 423.001 4.199 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H](c2ccc(Br)s2)C2CC2)C[C@@H](C)O1 ZINC000439139674 864572145 /nfs/dbraw/zinc/57/21/45/864572145.db2.gz YOEWFJPVUNXZLC-HBUWYVDXSA-N 2 0 401.414 4.441 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)NC2(C[NH+](C)C)CCC2)cc1)C[C@H]1CCCCO1 ZINC000439373081 864806968 /nfs/dbraw/zinc/80/69/68/864806968.db2.gz SJQRFCFFTBPBFE-JOCHJYFZSA-N 2 0 416.610 4.072 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)Nc1ccc(F)cc1F ZINC000439608725 864930624 /nfs/dbraw/zinc/93/06/24/864930624.db2.gz BMEASFVYLNZTRP-INIZCTEOSA-N 2 0 413.468 4.307 20 0 HIADRP CC(C)C[C@@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000468016081 881853978 /nfs/dbraw/zinc/85/39/78/881853978.db2.gz HRAQGPCXKHRPSR-UGKGYDQZSA-N 2 0 402.627 4.314 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc3cc(Br)ccc3[nH]2)[C@@H](C)C1 ZINC000468049642 881875244 /nfs/dbraw/zinc/87/52/44/881875244.db2.gz OSNOLZISIKFKBI-HNAYVOBHSA-N 2 0 408.384 4.157 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000440537013 865809269 /nfs/dbraw/zinc/80/92/69/865809269.db2.gz OYXVTDWEACKLFP-XMMPIXPASA-N 2 0 405.586 4.267 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@H](c2ccccc2)c2ccc(C)cc2)[C@@H](C)C1 ZINC000440689182 865866545 /nfs/dbraw/zinc/86/65/45/865866545.db2.gz HSNQBEWIEXPGDD-CPPMQADQSA-N 2 0 410.602 4.124 20 0 HIADRP Cc1ccc([C@H](OC[C@H](O)C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)c2ccccc2)cc1 ZINC000441365455 866434338 /nfs/dbraw/zinc/43/43/38/866434338.db2.gz PZLFIQCCZDJUHU-JIMJEQGWSA-N 2 0 410.602 4.268 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442779269 867672276 /nfs/dbraw/zinc/67/22/76/867672276.db2.gz LSZNELKVUVEXSB-NQIIRXRSSA-N 2 0 418.507 4.278 20 0 HIADRP C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000443634155 868212970 /nfs/dbraw/zinc/21/29/70/868212970.db2.gz UTQIAUAJSYCECP-KRWDZBQOSA-N 2 0 403.954 4.490 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(CNc2cc[nH+]c3cc(C(F)(F)F)ccc23)c1 ZINC000443667634 868274131 /nfs/dbraw/zinc/27/41/31/868274131.db2.gz QECDZPVDWNENFP-UHFFFAOYSA-N 2 0 416.447 4.157 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3cnc(C(F)(F)F)s3)CC2)c1 ZINC000443961759 868494911 /nfs/dbraw/zinc/49/49/11/868494911.db2.gz QDPKUCYAIVNEBC-UHFFFAOYSA-N 2 0 412.525 4.162 20 0 HIADRP O=C(CC[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1)N[C@@H](c1cccs1)c1ccccc1 ZINC000444214558 868670528 /nfs/dbraw/zinc/67/05/28/868670528.db2.gz RRQHTFDCQNIQCQ-GBXCKJPGSA-N 2 0 411.615 4.152 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(OC(C)C)cc1Cl ZINC000445046819 869191096 /nfs/dbraw/zinc/19/10/96/869191096.db2.gz GOPDRKGMEIXKAU-QGZVFWFLSA-N 2 0 410.990 4.007 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]1c1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000446005472 869970515 /nfs/dbraw/zinc/97/05/15/869970515.db2.gz YGMZXKIFAVPKHL-BUUDZMLXSA-N 2 0 405.586 4.082 20 0 HIADRP C[C@@H]1C[C@@H](CCNC(=O)Nc2ccccc2CC[NH+](C)C)C[N@@H+]1Cc1ccccc1 ZINC000446576666 870487986 /nfs/dbraw/zinc/48/79/86/870487986.db2.gz HNGGQRXWDUQICR-IFMALSPDSA-N 2 0 408.590 4.213 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)Nc2ccccc2CC[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000446595979 870502916 /nfs/dbraw/zinc/50/29/16/870502916.db2.gz XSTYAIHLIAWTGZ-NFBKMPQASA-N 2 0 408.590 4.308 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000446756274 870667739 /nfs/dbraw/zinc/66/77/39/870667739.db2.gz GKHDNOGEHIKTKU-AUUYWEPGSA-N 2 0 414.819 4.169 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(Oc4cccc(F)c4)cc3)CC2)CC1 ZINC000446764381 870678213 /nfs/dbraw/zinc/67/82/13/870678213.db2.gz GUWORYCKSWUCIT-UHFFFAOYSA-N 2 0 411.565 4.468 20 0 HIADRP OC[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1c(F)cccc1Cl ZINC000447545295 871412014 /nfs/dbraw/zinc/41/20/14/871412014.db2.gz QUQQFQSFPGSVBT-BURNTYAHSA-N 2 0 416.968 4.415 20 0 HIADRP Brc1cccc([C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)C2CCOCC2)c1 ZINC000447567578 871463729 /nfs/dbraw/zinc/46/37/29/871463729.db2.gz CLRDBJMRXNKXJR-NRFANRHFSA-N 2 0 407.396 4.381 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)cc1 ZINC000447585976 871492637 /nfs/dbraw/zinc/49/26/37/871492637.db2.gz MAELJSRVBZWPEQ-RUZDIDTESA-N 2 0 419.544 4.191 20 0 HIADRP C[NH+](C)[C@H]1CCOc2c(NC(=O)[C@@H]3CCC[N@H+](Cc4cccc(F)c4)C3)cccc21 ZINC000447728758 871675998 /nfs/dbraw/zinc/67/59/98/871675998.db2.gz MIQZPMXJHDOIEG-GCJKJVERSA-N 2 0 411.521 4.062 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000448212822 872113439 /nfs/dbraw/zinc/11/34/39/872113439.db2.gz MAYJSLSHJLKBNP-NOZRDPDXSA-N 2 0 424.633 4.221 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000448212823 872114163 /nfs/dbraw/zinc/11/41/63/872114163.db2.gz MAYJSLSHJLKBNP-UKILVPOCSA-N 2 0 424.633 4.221 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(C)[C@H]1CC[N@H+](CC)C[C@H]1C)c1ccccc1Cl ZINC000448462322 872420874 /nfs/dbraw/zinc/42/08/74/872420874.db2.gz SGYGCGMOEQBDGW-JRGCBEDISA-N 2 0 409.018 4.095 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)[C@@H](C)C1 ZINC000448524018 872515014 /nfs/dbraw/zinc/51/50/14/872515014.db2.gz CYFBAVYLVKSKMZ-VWPQPMDRSA-N 2 0 400.611 4.022 20 0 HIADRP Cc1ccc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c(-n2cc(Cl)cn2)n1 ZINC000468808788 882870516 /nfs/dbraw/zinc/87/05/16/882870516.db2.gz DJVPXFOKTMFNTL-KRWDZBQOSA-N 2 0 413.953 4.020 20 0 HIADRP CC1CC[NH+](CCC[C@@H]([NH2+]C2CCN(C(=O)C3CC3)CC2)c2ccc(F)cc2)CC1 ZINC000462883765 875910742 /nfs/dbraw/zinc/91/07/42/875910742.db2.gz NLTWKRNRWNLBOF-XMMPIXPASA-N 2 0 415.597 4.370 20 0 HIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CCN(CC[NH+]2[C@@H](C)CC[C@@H]2C)CC1 ZINC000463072611 876103795 /nfs/dbraw/zinc/10/37/95/876103795.db2.gz QSIJTEIDQLWAQZ-VXKWHMMOSA-N 2 0 411.638 4.005 20 0 HIADRP C[C@H]1C[C@@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)CCN1Cc1ccccc1 ZINC000463074208 876106361 /nfs/dbraw/zinc/10/63/61/876106361.db2.gz AWIDDDGQLFGCAO-AHWVRZQESA-N 2 0 420.645 4.232 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)[C@H](C)C1 ZINC000463126307 876170798 /nfs/dbraw/zinc/17/07/98/876170798.db2.gz TUIQIDWHECCWSU-AUSIDOKSSA-N 2 0 408.030 4.031 20 0 HIADRP C[N@@H+](Cc1nc2ccc(Br)cc2o1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000463159048 876212401 /nfs/dbraw/zinc/21/24/01/876212401.db2.gz FQJZRTZJQFJLCK-UHFFFAOYSA-N 2 0 415.335 4.334 20 0 HIADRP Cc1ccc(C(=O)N2CCC([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)CC2)cc1 ZINC000463292388 876352356 /nfs/dbraw/zinc/35/23/56/876352356.db2.gz TXGAVRKDWZMURV-NXMIGULDSA-N 2 0 417.597 4.385 20 0 HIADRP COc1ccc(Cn2nc(C)c(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)c2C)cc1 ZINC000463743129 876865086 /nfs/dbraw/zinc/86/50/86/876865086.db2.gz BRJFOGIXPKVAAQ-UHFFFAOYSA-N 2 0 418.585 4.442 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH+]2CCC(c3ccc(Br)cc3)CC2)CC1 ZINC000503350588 912326361 /nfs/dbraw/zinc/32/63/61/912326361.db2.gz VUQKQSXBBZSBND-UHFFFAOYSA-N 2 0 408.428 4.045 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000465428207 878860118 /nfs/dbraw/zinc/86/01/18/878860118.db2.gz ZHODTKCVGHXTEU-UKILVPOCSA-N 2 0 422.617 4.233 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C)c1ccccc1Cl ZINC000465434996 878866300 /nfs/dbraw/zinc/86/63/00/878866300.db2.gz SCNPPIGORMGWOT-DXIQSLLYSA-N 2 0 421.029 4.380 20 0 HIADRP C[C@H]1CCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC[N@@H+]1Cc1ccccc1 ZINC000465525049 878978386 /nfs/dbraw/zinc/97/83/86/878978386.db2.gz RQBIBILBRBGSJB-QFIPXVFZSA-N 2 0 420.601 4.088 20 0 HIADRP CC(C)[C@@H](CNC(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)[NH+]1CCC(C)CC1 ZINC000465547851 879011263 /nfs/dbraw/zinc/01/12/63/879011263.db2.gz QKYUICIXSJGYQK-TUNNFDKTSA-N 2 0 420.667 4.187 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N(C)CC[C@H]2CCCC[NH+]2C)cc1 ZINC000465557857 879026708 /nfs/dbraw/zinc/02/67/08/879026708.db2.gz KDLIOMVNAYQEMC-NFBKMPQASA-N 2 0 400.611 4.077 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)NCc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000465574894 879050624 /nfs/dbraw/zinc/05/06/24/879050624.db2.gz SNAJYJXLKRWQOL-JOCHJYFZSA-N 2 0 422.617 4.289 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)NC[C@H]2CCC[NH+](C)[C@H]2c2cccs2)C1 ZINC000465594701 879080511 /nfs/dbraw/zinc/08/05/11/879080511.db2.gz IMXPGVPLGLVEBV-XAPVIXHLSA-N 2 0 420.667 4.188 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCc1cccc(C[NH+](C)CC)c1 ZINC000465821494 879450693 /nfs/dbraw/zinc/45/06/93/879450693.db2.gz YEDKJLXBBNTOHC-RUZDIDTESA-N 2 0 422.617 4.192 20 0 HIADRP C[NH+](C)CCN(CC1CCCCC1)C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000466075972 879784976 /nfs/dbraw/zinc/78/49/76/879784976.db2.gz HXYJIXBNFWKGNS-RBBKRZOGSA-N 2 0 420.667 4.285 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)N2CC[NH+](CC3CCCCC3)CC2)[C@H]1c1cccs1 ZINC000466077480 879788835 /nfs/dbraw/zinc/78/88/35/879788835.db2.gz MAWZYKSWXCDPAT-UNMCSNQZSA-N 2 0 418.651 4.039 20 0 HIADRP CC1CC[NH+](Cc2ccccc2CNC(=O)NCc2ccc(CC[NH+](C)C)cc2)CC1 ZINC000466973730 880775541 /nfs/dbraw/zinc/77/55/41/880775541.db2.gz OWTIUNGNEMMFNN-UHFFFAOYSA-N 2 0 422.617 4.022 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NCc2ccc(CC[NH+](C)C)cc2)C1 ZINC000466976248 880778691 /nfs/dbraw/zinc/77/86/91/880778691.db2.gz UEGZXJOXGAGLFQ-OAQYLSRUSA-N 2 0 422.617 4.022 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@H](c2cncc(F)c2)C2CC2)CC1 ZINC000467337866 881089748 /nfs/dbraw/zinc/08/97/48/881089748.db2.gz GFLPNELUBAPEKX-NRFANRHFSA-N 2 0 422.470 4.232 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H]2CCc3cc(F)c(OC)cc32)CC1 ZINC000467349719 881104853 /nfs/dbraw/zinc/10/48/53/881104853.db2.gz YJRVLGLPEWIGGE-AOMKIAJQSA-N 2 0 415.528 4.453 20 0 HIADRP COc1cc2c(cc1F)CC[C@H]2[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000467354486 881115796 /nfs/dbraw/zinc/11/57/96/881115796.db2.gz GSATVKJMYOLBHI-XMMPIXPASA-N 2 0 412.549 4.483 20 0 HIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000467365560 881135712 /nfs/dbraw/zinc/13/57/12/881135712.db2.gz QMBCATLFSXKBLQ-QGZVFWFLSA-N 2 0 406.492 4.383 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CC[C@@H](Oc3ccncc3)C2)c1 ZINC000469136038 883230894 /nfs/dbraw/zinc/23/08/94/883230894.db2.gz VOGDPXKKCMZADU-XMMPIXPASA-N 2 0 401.510 4.007 20 0 HIADRP C[C@@H](CCCOc1ccccc1C(N)=O)[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000469263658 883360979 /nfs/dbraw/zinc/36/09/79/883360979.db2.gz NPSDKLLCWHMCMU-UGCAPWQASA-N 2 0 423.601 4.079 20 0 HIADRP C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)NC[C@H]1CCC[NH+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000469538989 883806328 /nfs/dbraw/zinc/80/63/28/883806328.db2.gz AVLKCVZNCINSRY-VWFIUDSGSA-N 2 0 411.512 4.077 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1NC(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000469742109 883897441 /nfs/dbraw/zinc/89/74/41/883897441.db2.gz NNLPTEGQQNUBJZ-SFTDATJTSA-N 2 0 405.586 4.169 20 0 HIADRP CCS[C@@H]1CCCC[C@@H]1[NH2+]CC1(C[NH2+][C@H]2CCCC[C@@H]2SCC)COC1 ZINC000469775993 883952010 /nfs/dbraw/zinc/95/20/10/883952010.db2.gz PCVJNZYUPCOGEF-LWYYNNOASA-N 2 0 400.698 4.311 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N(C)[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000470746458 885211434 /nfs/dbraw/zinc/21/14/34/885211434.db2.gz TVMJXDUOYYMEMS-VWLOTQADSA-N 2 0 422.617 4.334 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N(C)[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC000470749273 885212360 /nfs/dbraw/zinc/21/23/60/885212360.db2.gz LWOFUXONRMSUJS-AOHZBQACSA-N 2 0 414.638 4.051 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@@H](C[NH+]2CCCC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000470893975 885391654 /nfs/dbraw/zinc/39/16/54/885391654.db2.gz AGUGJYQZSAQYEF-SFTDATJTSA-N 2 0 400.611 4.023 20 0 HIADRP O=C(C[N@H+]1CCCCC[C@@H]1c1ccc(C(F)(F)F)cc1)NC1CC[NH+](C2CC2)CC1 ZINC000470999230 885501118 /nfs/dbraw/zinc/50/11/18/885501118.db2.gz TVPMKTOUUXWRTJ-OAQYLSRUSA-N 2 0 423.523 4.366 20 0 HIADRP CC[C@@H](c1ccc(F)cc1)[NH+]1CCC(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1 ZINC000471220342 885793414 /nfs/dbraw/zinc/79/34/14/885793414.db2.gz NIOUYFQAAVBFCC-DEOSSOPVSA-N 2 0 411.565 4.237 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+]([C@@H]2CCCc3ccccc32)CC1)Cc1ccccc1 ZINC000471231127 885804686 /nfs/dbraw/zinc/80/46/86/885804686.db2.gz YQDFQCISTTZNPP-RUZDIDTESA-N 2 0 405.586 4.024 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000471601255 886314592 /nfs/dbraw/zinc/31/45/92/886314592.db2.gz HQNCMGVPRGMBAS-KGLIPLIRSA-N 2 0 411.434 4.401 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@@H](C)CCN1CC[NH+](C)CC1 ZINC000471607335 886322994 /nfs/dbraw/zinc/32/29/94/886322994.db2.gz YOLBQPDTVQZFDQ-HOTGVXAUSA-N 2 0 407.027 4.449 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NCc2cccc(C[NH+](C)C)c2)c2cccs2)CC1 ZINC000504202628 913085013 /nfs/dbraw/zinc/08/50/13/913085013.db2.gz DGBMGBWPYSMEMG-NRFANRHFSA-N 2 0 414.619 4.082 20 0 HIADRP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000472125774 886914435 /nfs/dbraw/zinc/91/44/35/886914435.db2.gz IANDIRVEURWRTE-UHFFFAOYSA-N 2 0 403.517 4.263 20 0 HIADRP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1 ZINC000472138341 886931114 /nfs/dbraw/zinc/93/11/14/886931114.db2.gz LYQSRZULQWADDT-UPVQGACJSA-N 2 0 405.586 4.168 20 0 HIADRP COc1ccsc1[C@H](C)[NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000472161799 886961046 /nfs/dbraw/zinc/96/10/46/886961046.db2.gz TWKSFJVJAFBQQI-AWEZNQCLSA-N 2 0 413.509 4.378 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1NC(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000473276244 888033638 /nfs/dbraw/zinc/03/36/38/888033638.db2.gz KATDYQKTLKDQCG-SFTDATJTSA-N 2 0 405.586 4.169 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)N2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)c1 ZINC000473617864 888358132 /nfs/dbraw/zinc/35/81/32/888358132.db2.gz MLABGQMIWXQNRM-RUZDIDTESA-N 2 0 406.574 4.268 20 0 HIADRP CC[N@H+](C)Cc1cccc(CNC(=O)NC2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000474005140 888863957 /nfs/dbraw/zinc/86/39/57/888863957.db2.gz CDXMIVJRUDPNOX-SFTDATJTSA-N 2 0 422.617 4.094 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CCCC[C@H]3[C@H]3CCOC3)CC2)cc1 ZINC000474056760 888893152 /nfs/dbraw/zinc/89/31/52/888893152.db2.gz MCODGCBTMOTLNB-ZKMPZPQNSA-N 2 0 400.607 4.243 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CCCC[C@@H]3[C@@H]3CCOC3)CC2)cc1 ZINC000474056756 888893414 /nfs/dbraw/zinc/89/34/14/888893414.db2.gz MCODGCBTMOTLNB-QLBJFCOMSA-N 2 0 400.607 4.243 20 0 HIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(Cl)cc2-n2cncn2)CC1)CC1CC1 ZINC000474465040 889329391 /nfs/dbraw/zinc/32/93/91/889329391.db2.gz BFSNPRPXODNFMY-UHFFFAOYSA-N 2 0 401.986 4.255 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)NC2CC([NH+]3CCCCC3)C2)c1 ZINC000474496758 889358347 /nfs/dbraw/zinc/35/83/47/889358347.db2.gz MGHJOXMYBMKBLI-UHFFFAOYSA-N 2 0 400.611 4.125 20 0 HIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000474820811 889674752 /nfs/dbraw/zinc/67/47/52/889674752.db2.gz HSDZBQKJVJGKAD-MOPGFXCFSA-N 2 0 400.636 4.328 20 0 HIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2ccc(Cl)cc2-n2cncn2)C[N@@H+]1Cc1ccccc1 ZINC000474874317 889727296 /nfs/dbraw/zinc/72/72/96/889727296.db2.gz AASYCWRUNTWPHX-UYAOXDASSA-N 2 0 409.965 4.311 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)C[NH2+][C@@H](Cc1ccccc1)c1cccs1)c1ccccc1 ZINC000475142525 890008907 /nfs/dbraw/zinc/00/89/07/890008907.db2.gz ZGEVXTYVYKNBGG-VXKWHMMOSA-N 2 0 407.583 4.041 20 0 HIADRP C[C@H](CCc1ccc(I)cc1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475567092 890497381 /nfs/dbraw/zinc/49/73/81/890497381.db2.gz QOFVMTSXFJNOIG-VNCLNFNDSA-N 2 0 412.359 4.219 20 0 HIADRP CC(C)[NH2+]C1CCN(C(=O)NCc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000476194628 891126402 /nfs/dbraw/zinc/12/64/02/891126402.db2.gz FQOJRSQMAAXMFB-UHFFFAOYSA-N 2 0 400.611 4.123 20 0 HIADRP C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000476990647 891916467 /nfs/dbraw/zinc/91/64/67/891916467.db2.gz ADEHUUFJASEDBK-RTWAWAEBSA-N 2 0 424.633 4.192 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H]2CC(C)(C)c3ccc(Br)cc32)CC1 ZINC000479072164 894335612 /nfs/dbraw/zinc/33/56/12/894335612.db2.gz UTYLRGDSXVYVPH-JXFKEZNVSA-N 2 0 408.428 4.035 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(Br)cc1C(F)(F)F ZINC000479273605 894548758 /nfs/dbraw/zinc/54/87/58/894548758.db2.gz FJTQNXPMCUBPND-KGLIPLIRSA-N 2 0 422.333 4.145 20 0 HIADRP C[C@H](Cc1ccc(Br)cc1)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000479280740 894558246 /nfs/dbraw/zinc/55/82/46/894558246.db2.gz HBWQXLVAAASCFX-QGZVFWFLSA-N 2 0 417.391 4.127 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCCc3cc(Br)ccc32)CC1 ZINC000479383593 894684119 /nfs/dbraw/zinc/68/41/19/894684119.db2.gz CWEUYENKTWQGRR-PCCBWWKXSA-N 2 0 407.396 4.184 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NCc2ccc(Cn3ccnc3)cc2)CC1 ZINC000479424271 894736792 /nfs/dbraw/zinc/73/67/92/894736792.db2.gz MXKYUAXFZUDTFY-OAQYLSRUSA-N 2 0 423.605 4.118 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC2CC[NH+](C3CCCC3)CC2)CC1 ZINC000479562479 894859983 /nfs/dbraw/zinc/85/99/83/894859983.db2.gz IWVVTBACASBMAA-HXUWFJFHSA-N 2 0 404.643 4.080 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cnn(Cc2ccccc2)c1 ZINC000480236639 895645631 /nfs/dbraw/zinc/64/56/31/895645631.db2.gz VQCRYCWIAPSFIP-BDTNDASRSA-N 2 0 418.585 4.391 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000480241039 895650586 /nfs/dbraw/zinc/65/05/86/895650586.db2.gz MZHVRYSYWDDQRF-CEXWTWQISA-N 2 0 421.585 4.376 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC000480449692 895837815 /nfs/dbraw/zinc/83/78/15/895837815.db2.gz SKGZYRGSZYIRQG-IBGZPJMESA-N 2 0 415.603 4.285 20 0 HIADRP CC(C)(C)C(=O)N1CCC(C[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)CC1 ZINC000480535595 895897906 /nfs/dbraw/zinc/89/79/06/895897906.db2.gz JLZALZCQDYIDRH-AREMUKBSSA-N 2 0 411.634 4.259 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 ZINC000480537449 895901149 /nfs/dbraw/zinc/90/11/49/895901149.db2.gz PPLJPPAHVKMSFK-LJQANCHMSA-N 2 0 419.038 4.457 20 0 HIADRP CC(C)[C@H](C[NH2+][C@@H](Cc1cccc(F)c1)c1cccc(F)c1)N1CC[NH+](C)CC1 ZINC000480539202 895902686 /nfs/dbraw/zinc/90/26/86/895902686.db2.gz JVOKSZFHPIJCNC-ZEQRLZLVSA-N 2 0 401.545 4.110 20 0 HIADRP Cc1c([C@@H](C)[NH2+]C2CCN(CC[NH+](C)C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000480546463 895907177 /nfs/dbraw/zinc/90/71/77/895907177.db2.gz GMPXWKTUDWTBDA-OAHLLOKOSA-N 2 0 424.420 4.164 20 0 HIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480603285 895968036 /nfs/dbraw/zinc/96/80/36/895968036.db2.gz DYLALQFQOPOLPH-LEWJYISDSA-N 2 0 421.651 4.166 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1ccc(NS(C)(=O)=O)cc1 ZINC000480615732 895981882 /nfs/dbraw/zinc/98/18/82/895981882.db2.gz UQLVENUWUIBCGA-RTBURBONSA-N 2 0 415.603 4.283 20 0 HIADRP CSc1ccc([C@H](C[NH2+][C@@H]2CC[N@H+](C)C[C@H]2C)N2CCc3sccc3C2)cc1 ZINC000480615798 895982548 /nfs/dbraw/zinc/98/25/48/895982548.db2.gz SZRVLPUZNJXELL-YHYVQYDKSA-N 2 0 415.672 4.499 20 0 HIADRP FC(F)(F)COc1ccc(CC[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)cn1 ZINC000480668542 896033002 /nfs/dbraw/zinc/03/30/02/896033002.db2.gz SXYMEVBUONYIBB-QHAWAJNXSA-N 2 0 419.491 4.065 20 0 HIADRP Cc1ccccc1CN1CCC([NH2+][C@H](C)[C@@H](c2ccccc2)N2CCOCC2)CC1 ZINC000480687285 896049664 /nfs/dbraw/zinc/04/96/64/896049664.db2.gz PWAGSTYISOKRTL-GJZUVCINSA-N 2 0 407.602 4.011 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(OCC(F)(F)F)cc3)cn2)CC1 ZINC000480729950 896090638 /nfs/dbraw/zinc/09/06/38/896090638.db2.gz TXXIGBFPYOJMDZ-QGZVFWFLSA-N 2 0 422.495 4.015 20 0 HIADRP Cc1ccccc1OCCCC(=O)Nc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000480737738 896098469 /nfs/dbraw/zinc/09/84/69/896098469.db2.gz DTOOFWOWAVFEKN-NZQKXSOJSA-N 2 0 409.574 4.223 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)[C@H](C)C1 ZINC000480739816 896100193 /nfs/dbraw/zinc/10/01/93/896100193.db2.gz KCMUBYOGAAKFGZ-DXIQSLLYSA-N 2 0 404.599 4.004 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cccc(OC(F)F)c2)CC1 ZINC000480744517 896108165 /nfs/dbraw/zinc/10/81/65/896108165.db2.gz YJHXJDDEQGVQEA-GOSISDBHSA-N 2 0 403.517 4.276 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000480769094 896130794 /nfs/dbraw/zinc/13/07/94/896130794.db2.gz LGCSSKAJSJVFAW-HXUWFJFHSA-N 2 0 416.610 4.334 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2sc(-c3ccccc3F)nc2C)CC1 ZINC000480769019 896130946 /nfs/dbraw/zinc/13/09/46/896130946.db2.gz HUGIROROLDOFTQ-KRWDZBQOSA-N 2 0 404.599 4.326 20 0 HIADRP CC[C@@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1cnn(C)c1 ZINC000480781522 896146608 /nfs/dbraw/zinc/14/66/08/896146608.db2.gz UTEFUFHAOXKNQZ-OAQYLSRUSA-N 2 0 423.527 4.082 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccc(OC(F)(F)F)c1 ZINC000480885714 896241795 /nfs/dbraw/zinc/24/17/95/896241795.db2.gz WNKXFFDOWWQVAQ-QGZVFWFLSA-N 2 0 407.480 4.183 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1ccc(Br)s1 ZINC000480904422 896259848 /nfs/dbraw/zinc/25/98/48/896259848.db2.gz XWTYHIGJVZHERE-HNNXBMFYSA-N 2 0 408.409 4.109 20 0 HIADRP COc1ccc2cc([C@@H](C)[NH2+]Cc3ccc(CN4CC[NH+](C)CC4)cc3)ccc2c1 ZINC000480920751 896278346 /nfs/dbraw/zinc/27/83/46/896278346.db2.gz MWBXZOQDZYOGFC-HXUWFJFHSA-N 2 0 403.570 4.447 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCc3c2cc(Br)cc3F)cc1 ZINC000481315116 896664588 /nfs/dbraw/zinc/66/45/88/896664588.db2.gz YHRMULWDAALASI-FQEVSTJZSA-N 2 0 407.327 4.306 20 0 HIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1OCC(=O)N(C)C ZINC000481547316 896912327 /nfs/dbraw/zinc/91/23/27/896912327.db2.gz ROQOVDZPRZNUHH-XMMPIXPASA-N 2 0 423.601 4.107 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(-n4cccn4)cc3)CC2)cc1 ZINC000481719148 897113863 /nfs/dbraw/zinc/11/38/63/897113863.db2.gz PMNNOUHXELYZFH-FQEVSTJZSA-N 2 0 404.558 4.444 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000481721619 897116243 /nfs/dbraw/zinc/11/62/43/897116243.db2.gz XYEZOGKJJUQZHM-LJQANCHMSA-N 3 0 401.620 4.251 20 0 HIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1NC(C)=O ZINC000481731673 897124917 /nfs/dbraw/zinc/12/49/17/897124917.db2.gz WAHARGITIJDZKU-INIZCTEOSA-N 2 0 401.576 4.278 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Cn3cnc4ccccc43)cc2)[C@@H](C)C1 ZINC000481733153 897126851 /nfs/dbraw/zinc/12/68/51/897126851.db2.gz GUVNHFHQHAOVIF-URXFXBBRSA-N 2 0 420.601 4.311 20 0 HIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000481919061 897303242 /nfs/dbraw/zinc/30/32/42/897303242.db2.gz HTQBKTCQFTTYPN-KRWDZBQOSA-N 2 0 406.492 4.383 20 0 HIADRP C[C@H](C[NH2+][C@@H]1CCC(C)(C)c2ccc(Br)cc21)CN1CC[NH+](C)CC1 ZINC000481925936 897309498 /nfs/dbraw/zinc/30/94/98/897309498.db2.gz NKDDQRRYSXQVLI-OXQOHEQNSA-N 2 0 408.428 4.035 20 0 HIADRP COc1ccc(-c2ccncc2)cc1C[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000482007920 897404414 /nfs/dbraw/zinc/40/44/14/897404414.db2.gz QJICPIWKUHQOJW-BGYRXZFFSA-N 2 0 409.574 4.078 20 0 HIADRP COCC[N@H+](C)CCOc1cccc(C[NH2+][C@H]2CCSc3ccc(F)cc32)c1 ZINC000482267680 897752645 /nfs/dbraw/zinc/75/26/45/897752645.db2.gz QGLKHIYOWHUDNK-NRFANRHFSA-N 2 0 404.551 4.109 20 0 HIADRP CC(C)NC(=O)Nc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000482444662 898006239 /nfs/dbraw/zinc/00/62/39/898006239.db2.gz IINGLDYJJODHBJ-IFMALSPDSA-N 2 0 408.590 4.432 20 0 HIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(OCc2nccn2C)cc1 ZINC000482445360 898009217 /nfs/dbraw/zinc/00/92/17/898009217.db2.gz JGJGQKXGRQTZLF-GGAORHGYSA-N 2 0 418.585 4.214 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](C)c2ccc(SCC(F)(F)F)cc2)CC1 ZINC000482511138 898095477 /nfs/dbraw/zinc/09/54/77/898095477.db2.gz PFRZLHZMDQUNCM-SJORKVTESA-N 2 0 403.558 4.265 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCCOc4ccc(Cl)cc43)cc2)CC1 ZINC000482549594 898138678 /nfs/dbraw/zinc/13/86/78/898138678.db2.gz OPCUSGFIWOVWBB-QFIPXVFZSA-N 2 0 400.950 4.300 20 0 HIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@H]3CCN(Cc4ccccn4)C[C@H]3C)c2)CC1 ZINC000482553634 898145715 /nfs/dbraw/zinc/14/57/15/898145715.db2.gz JQMPSOBYAVQVOH-GJZUVCINSA-N 2 0 406.618 4.314 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cnn1-c1ccc(F)cc1 ZINC000482557268 898149297 /nfs/dbraw/zinc/14/92/97/898149297.db2.gz KBDOJGMTFMAEAH-GOSISDBHSA-N 2 0 422.548 4.127 20 0 HIADRP CC(C)COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000482627444 898229562 /nfs/dbraw/zinc/22/95/62/898229562.db2.gz HJLCZWMWNXFMDP-YKSBVNFPSA-N 2 0 423.601 4.270 20 0 HIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+]C2CCN(Cc3cccnc3)CC2)CC1 ZINC000482636113 898240646 /nfs/dbraw/zinc/24/06/46/898240646.db2.gz YQWNYQYTXDFQBC-UHFFFAOYSA-N 2 0 413.009 4.201 20 0 HIADRP CC(C)c1nn(-c2ccc(Br)cc2)cc1C[NH2+]CC1CC[NH+](C)CC1 ZINC000482659238 898262974 /nfs/dbraw/zinc/26/29/74/898262974.db2.gz BUNPGCDYLNAXTQ-UHFFFAOYSA-N 2 0 405.384 4.190 20 0 HIADRP CC1(C(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000482944036 898568232 /nfs/dbraw/zinc/56/82/32/898568232.db2.gz FBEGIVBZFJPQDX-DEOSSOPVSA-N 2 0 411.634 4.403 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482946062 898571861 /nfs/dbraw/zinc/57/18/61/898571861.db2.gz JBISPYDTXHBAGP-LJQANCHMSA-N 2 0 415.603 4.285 20 0 HIADRP CC1(C(=O)NC[C@@H]2CCC[N@@H+]2Cc2ccccc2)CC[NH+](Cc2ccccc2)CC1 ZINC000483054244 898727314 /nfs/dbraw/zinc/72/73/14/898727314.db2.gz KBMABEGKNZKHON-DEOSSOPVSA-N 2 0 405.586 4.070 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000483151973 898826821 /nfs/dbraw/zinc/82/68/21/898826821.db2.gz QZHPKYZOTOJIQW-KRWDZBQOSA-N 2 0 418.578 4.454 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000483151976 898827257 /nfs/dbraw/zinc/82/72/57/898827257.db2.gz QZHPKYZOTOJIQW-QGZVFWFLSA-N 2 0 418.578 4.454 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(CCO)CC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000483155274 898828839 /nfs/dbraw/zinc/82/88/39/898828839.db2.gz LGZQPBXWULOMHX-GOSISDBHSA-N 2 0 422.038 4.109 20 0 HIADRP C[C@H]1C[C@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C[N@@H+]1Cc1ccccc1 ZINC000483167287 898836876 /nfs/dbraw/zinc/83/68/76/898836876.db2.gz IGPXOAIAFLKQQV-URXFXBBRSA-N 2 0 405.586 4.068 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)C[N@@H+]1Cc1ccccc1 ZINC000483167288 898837079 /nfs/dbraw/zinc/83/70/79/898837079.db2.gz IGPXOAIAFLKQQV-XUZZJYLKSA-N 2 0 405.586 4.068 20 0 HIADRP CC[NH+](CC)CCOc1cc(NC(=O)[C@H]2CC[N@@H+](C3CCCCC3)C2)ccc1OC ZINC000483198299 898853332 /nfs/dbraw/zinc/85/33/32/898853332.db2.gz LJQOZEHHPCKQFX-IBGZPJMESA-N 2 0 417.594 4.009 20 0 HIADRP C[C@@H]1[C@H]([NH+]2CCCC2)CCN1C(=O)NCc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000483301658 898932804 /nfs/dbraw/zinc/93/28/04/898932804.db2.gz UPVHOJDFXAPNST-HYBUGGRVSA-N 2 0 412.622 4.219 20 0 HIADRP C[C@H](NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000483375828 899010713 /nfs/dbraw/zinc/01/07/13/899010713.db2.gz JACXYBOJKMLWCE-DHLKQENFSA-N 2 0 419.613 4.316 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(C)[C@H]1CC[N@H+](CC)[C@H](C)C1)c1ccccc1Cl ZINC000483521497 899183735 /nfs/dbraw/zinc/18/37/35/899183735.db2.gz YJCMXOYVCIDHTG-LQWHRVPQSA-N 2 0 409.018 4.237 20 0 HIADRP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000483598040 899249165 /nfs/dbraw/zinc/24/91/65/899249165.db2.gz YEYUUFNIUAAQKX-CLJLJLNGSA-N 2 0 417.597 4.409 20 0 HIADRP O=C([C@@H]1CC[N@@H+](C2CCCCC2)C1)N1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000483603886 899254345 /nfs/dbraw/zinc/25/43/45/899254345.db2.gz FVLSTDWREIBWLZ-VDKIKQQVSA-N 2 0 409.618 4.154 20 0 HIADRP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000483635734 899289663 /nfs/dbraw/zinc/28/96/63/899289663.db2.gz LFYVJMWCTQGDQV-OXJNMPFZSA-N 2 0 411.512 4.077 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)cc1 ZINC000483713311 899370377 /nfs/dbraw/zinc/37/03/77/899370377.db2.gz RWHCJBSTEUZVHI-MOPGFXCFSA-N 2 0 403.592 4.009 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@@H]2CCCOc3ccccc32)CC1 ZINC000483724976 899384394 /nfs/dbraw/zinc/38/43/94/899384394.db2.gz CZDSQXQRTYNTSE-HXUWFJFHSA-N 2 0 419.491 4.461 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC(CC)(CC)[NH2+][C@@H](C)c2ccccc2)C[C@H]1C ZINC000483795813 899467703 /nfs/dbraw/zinc/46/77/03/899467703.db2.gz BKXYVHSAPFJYAF-URVUXULASA-N 2 0 402.627 4.410 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccccc2C[NH+]2CCCCCC2)C[C@@H]1C ZINC000483811739 899490473 /nfs/dbraw/zinc/49/04/73/899490473.db2.gz AHXJDEYJZFVXLZ-NZQKXSOJSA-N 2 0 400.611 4.077 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000483946365 899600183 /nfs/dbraw/zinc/60/01/83/899600183.db2.gz UKGCDUQXKHATSZ-QPPBQGQZSA-N 2 0 422.617 4.238 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000483946368 899600255 /nfs/dbraw/zinc/60/02/55/899600255.db2.gz UKGCDUQXKHATSZ-ZJSXRUAMSA-N 2 0 422.617 4.238 20 0 HIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H]1CCCc2nc(-c3ccc(OC)cc3)sc21 ZINC000484283102 899850824 /nfs/dbraw/zinc/85/08/24/899850824.db2.gz PMHUXSNPIYDSME-RTBURBONSA-N 2 0 403.592 4.143 20 0 HIADRP CCOc1ccc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cc1OCC ZINC000484481607 899973439 /nfs/dbraw/zinc/97/34/39/899973439.db2.gz WKPVKPHEVNZXCL-IBGZPJMESA-N 2 0 412.574 4.292 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000484490232 899981447 /nfs/dbraw/zinc/98/14/47/899981447.db2.gz XHTIPJSYAPULFK-PXNSSMCTSA-N 2 0 415.965 4.177 20 0 HIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCC(=O)Nc3ccc(OCc4ccccc4)cc3)CC[C@H]21 ZINC000485337132 900625048 /nfs/dbraw/zinc/62/50/48/900625048.db2.gz MMNZHQDDJQZJHC-ZJSXRUAMSA-N 2 0 407.558 4.010 20 0 HIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCC(=O)Nc3ccc(OCc4ccccc4)cc3)CC[C@H]21 ZINC000485337131 900625178 /nfs/dbraw/zinc/62/51/78/900625178.db2.gz MMNZHQDDJQZJHC-XUZZJYLKSA-N 2 0 407.558 4.010 20 0 HIADRP Cc1cccc(C)c1NC(=O)CCC[NH+]1CCC(CC[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000485410310 900707912 /nfs/dbraw/zinc/70/79/12/900707912.db2.gz UPVFLRJYSMVTTA-VXKWHMMOSA-N 2 0 415.622 4.233 20 0 HIADRP C[C@H](NC(=O)c1ccc(C[NH+]2CCCCC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487296037 902140122 /nfs/dbraw/zinc/14/01/22/902140122.db2.gz GSBGCHGFXVNNOA-SQJMNOBHSA-N 2 0 405.586 4.313 20 0 HIADRP O=C(C[NH+]1CCC(C[NH+]2CCCC2)CC1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000488344027 902777949 /nfs/dbraw/zinc/77/79/49/902777949.db2.gz KUQMVTHOYHYSCG-OAQYLSRUSA-N 2 0 424.416 4.465 20 0 HIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C(=O)Nc2cccc(OC)c2)c2ccccc2)CC1 ZINC000488434305 902824758 /nfs/dbraw/zinc/82/47/58/902824758.db2.gz LPEDJVTXSLBTAV-XMMPIXPASA-N 2 0 409.574 4.429 20 0 HIADRP COc1ccc(-c2nc(C[NH+]3CCC(CCC[NH+]4CCOCC4)CC3)cs2)cc1 ZINC000506022522 914702017 /nfs/dbraw/zinc/70/20/17/914702017.db2.gz NFQNXSYCRGQTGY-UHFFFAOYSA-N 2 0 415.603 4.143 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489294470 903314910 /nfs/dbraw/zinc/31/49/10/903314910.db2.gz PFGMRKBTKSBESP-URXFXBBRSA-N 2 0 420.601 4.128 20 0 HIADRP Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506028528 914709737 /nfs/dbraw/zinc/70/97/37/914709737.db2.gz VETMOBLGSQPGKG-OAQYLSRUSA-N 2 0 415.622 4.270 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCOc4ccc(C(C)C)cc43)cn2)CC1 ZINC000489596078 903486503 /nfs/dbraw/zinc/48/65/03/903486503.db2.gz BNEMUKBTPCDUFH-QHCPKHFHSA-N 2 0 408.590 4.350 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000489852099 903631328 /nfs/dbraw/zinc/63/13/28/903631328.db2.gz XKXUJBPEEICASA-OFVILXPXSA-N 2 0 422.617 4.190 20 0 HIADRP CCC(CC)[C@@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[NH+]1CCCC1 ZINC000489880976 903649610 /nfs/dbraw/zinc/64/96/10/903649610.db2.gz FLDJGFAIZCRBFL-XMMPIXPASA-N 2 0 414.638 4.193 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)CC(C)C ZINC000489922168 903677465 /nfs/dbraw/zinc/67/74/65/903677465.db2.gz LFOTUPJRLARBIJ-QHCPKHFHSA-N 2 0 402.627 4.049 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000490118510 903775529 /nfs/dbraw/zinc/77/55/29/903775529.db2.gz KVFNKGDHPMAYPQ-JOCHJYFZSA-N 2 0 416.407 4.156 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H](c1cccc(F)c1)c1cccc(Cl)c1)N1CC[NH+](C)CC1 ZINC000490164736 903804955 /nfs/dbraw/zinc/80/49/55/903804955.db2.gz PTOQWJUKFHTUHO-GOTSBHOMSA-N 2 0 403.973 4.430 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3cnnn3Cc3ccccc3)cc2)C1 ZINC000490572957 904109812 /nfs/dbraw/zinc/10/98/12/904109812.db2.gz TVTHDLFIJWPIER-SFTDATJTSA-N 2 0 403.574 4.094 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000491026076 904377587 /nfs/dbraw/zinc/37/75/87/904377587.db2.gz XYQNOXOEFUNOJO-QFIPXVFZSA-N 2 0 416.407 4.156 20 0 HIADRP CSc1cccc([C@H]([NH2+]CCCN2CC[NH+](C)CC2)c2cc(F)ccc2F)c1 ZINC000491343588 904546095 /nfs/dbraw/zinc/54/60/95/904546095.db2.gz PHMSSBBGHAETLE-QFIPXVFZSA-N 2 0 405.558 4.003 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000506157949 914827533 /nfs/dbraw/zinc/82/75/33/914827533.db2.gz LPRHUKUPELZAKN-OAQYLSRUSA-N 2 0 418.651 4.183 20 0 HIADRP CC[NH+]1CCN(c2ccccc2C[N@H+](C)Cc2ccc(OC)c(OC(F)F)c2)CC1 ZINC000506231374 914854234 /nfs/dbraw/zinc/85/42/34/914854234.db2.gz GVVLJTNHDUIDNF-UHFFFAOYSA-N 2 0 419.516 4.071 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1)C1CC[NH+](C)CC1 ZINC000506247060 914861851 /nfs/dbraw/zinc/86/18/51/914861851.db2.gz RPEASTDMSNXOPE-JOCHJYFZSA-N 2 0 420.601 4.068 20 0 HIADRP COC[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(Cl)cc1 ZINC000493738517 905208239 /nfs/dbraw/zinc/20/82/39/905208239.db2.gz PQDODLKAAQOQGC-IEGUWTFLSA-N 2 0 402.966 4.427 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cc(Br)cs2)CC1 ZINC000493966782 905316538 /nfs/dbraw/zinc/31/65/38/905316538.db2.gz CNDXAGCQVGSWDX-INIZCTEOSA-N 2 0 422.436 4.499 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@@]1(C)CCC[N@@H+]1Cc1ccccc1 ZINC000494193147 905527147 /nfs/dbraw/zinc/52/71/47/905527147.db2.gz XAFXGEUIEHGOBN-RUZDIDTESA-N 2 0 405.542 4.279 20 0 HIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000512434174 921158964 /nfs/dbraw/zinc/15/89/64/921158964.db2.gz VAAZJCWQGDODAB-UHFFFAOYSA-N 2 0 416.997 4.077 20 0 HIADRP C[C@H]([NH2+]C1CCN(CCc2ccc(F)cc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495416397 906437479 /nfs/dbraw/zinc/43/74/79/906437479.db2.gz ZMYQNNAQNZJLLK-URXFXBBRSA-N 2 0 409.593 4.333 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000495420540 906441691 /nfs/dbraw/zinc/44/16/91/906441691.db2.gz JBPWCIVBSLYBKH-CNNODRBYSA-N 2 0 415.603 4.009 20 0 HIADRP O=C1CCCN1Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000512642218 921271355 /nfs/dbraw/zinc/27/13/55/921271355.db2.gz NGXHIGRSEOHBJQ-KKUQBAQOSA-N 2 0 417.597 4.199 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N[C@H]2C[NH+](C)C[C@@H]2c2ccccc2)c1 ZINC000497398371 906879139 /nfs/dbraw/zinc/87/91/39/906879139.db2.gz BVPYRONQJNDXPG-FTJBHMTQSA-N 2 0 413.565 4.146 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N(Cc2ccncc2)C[C@@H]2CCC[N@@H+]2CC)cc1 ZINC000512708047 921293186 /nfs/dbraw/zinc/29/31/86/921293186.db2.gz MGCUTAPMKRIRFS-DEOSSOPVSA-N 2 0 408.590 4.050 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H]2C)CC1 ZINC000497631816 907114172 /nfs/dbraw/zinc/11/41/72/907114172.db2.gz DUVZYIABHNHUSW-TYBLODHISA-N 2 0 420.601 4.174 20 0 HIADRP C[C@H]1CCc2nc(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)sc2C1 ZINC000498358665 907856533 /nfs/dbraw/zinc/85/65/33/907856533.db2.gz HCCPXIQNKUXLCX-IBGZPJMESA-N 2 0 413.631 4.429 20 0 HIADRP O=C(NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)Nc1ccccc1-c1ccccc1 ZINC000498840184 908246192 /nfs/dbraw/zinc/24/61/92/908246192.db2.gz SSXSFOXCJMSKKJ-UHFFFAOYSA-N 2 0 415.541 4.082 20 0 HIADRP O=C(NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)Nc1ccccc1-c1cccs1 ZINC000498838953 908246332 /nfs/dbraw/zinc/24/63/32/908246332.db2.gz WBPKYZADMKKDRM-UHFFFAOYSA-N 2 0 421.570 4.144 20 0 HIADRP FC(F)(F)c1ccc(OCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)nc1 ZINC000499212721 908567412 /nfs/dbraw/zinc/56/74/12/908567412.db2.gz QPNZNLNUMPFZHC-ACDBMABISA-N 2 0 405.464 4.264 20 0 HIADRP O=C(NC1CCCCC1)N1CCC([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499219089 908575812 /nfs/dbraw/zinc/57/58/12/908575812.db2.gz OILJHTFXYZCWHG-MPIKPJSNSA-N 2 0 424.633 4.278 20 0 HIADRP CSc1ccc([C@H](C)[NH2+]CC(=O)N2CCC[N@H+](Cc3ccccc3C)CC2)cc1 ZINC000500246546 909734409 /nfs/dbraw/zinc/73/44/09/909734409.db2.gz RHRBUIXXBBUUOC-FQEVSTJZSA-N 2 0 411.615 4.102 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1 ZINC000501021800 910239361 /nfs/dbraw/zinc/23/93/61/910239361.db2.gz HGNQPHPQYLJHOT-OAQYLSRUSA-N 2 0 408.590 4.006 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1ccccc1 ZINC000501023033 910241313 /nfs/dbraw/zinc/24/13/13/910241313.db2.gz LTSFZAAVJNLJDQ-FGZHOGPDSA-N 2 0 414.981 4.079 20 0 HIADRP Cc1sc2nc([C@@H](C)[N@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)[nH]c(=O)c2c1C ZINC000501043791 910256637 /nfs/dbraw/zinc/25/66/37/910256637.db2.gz GKVGAYDWUKSOSW-OAHLLOKOSA-N 2 0 411.575 4.318 20 0 HIADRP Brc1csc(C[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)c1 ZINC000513115275 921561610 /nfs/dbraw/zinc/56/16/10/921561610.db2.gz NWSWYIRJJRISNH-UHFFFAOYSA-N 2 0 408.409 4.203 20 0 HIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CCCN3CC[NH+](C(C)C)CC3)s2)cc1 ZINC000501059208 910269305 /nfs/dbraw/zinc/26/93/05/910269305.db2.gz MLSXAEDUDMFOSY-GOSISDBHSA-N 2 0 416.635 4.194 20 0 HIADRP COc1ccc(-c2noc([C@H](C)[N@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)n2)cc1 ZINC000501080130 910281841 /nfs/dbraw/zinc/28/18/41/910281841.db2.gz MROJZWMLRIAIRU-KRWDZBQOSA-N 2 0 407.518 4.050 20 0 HIADRP C[C@@H]1CCN(C(=O)C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c2ccccc2S1 ZINC000501083940 910283820 /nfs/dbraw/zinc/28/38/20/910283820.db2.gz WKGHOJMQMGBKCC-LJQANCHMSA-N 2 0 424.614 4.147 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N(C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000501097490 910294357 /nfs/dbraw/zinc/29/43/57/910294357.db2.gz ZEHBIDYXNVZFPZ-FQEVSTJZSA-N 2 0 423.605 4.069 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)c1ccsc1 ZINC000501124696 910307031 /nfs/dbraw/zinc/30/70/31/910307031.db2.gz GGUXPDIHFHQAPF-FGZHOGPDSA-N 2 0 414.619 4.267 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NCc1ccccc1C[NH+]1CCCC1)c1ccsc1 ZINC000501140668 910320733 /nfs/dbraw/zinc/32/07/33/910320733.db2.gz HHDGTCKPGYGSHE-JOCHJYFZSA-N 2 0 414.619 4.226 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)C(=O)Nc2cc(Cl)ccc2C)CC1 ZINC000501810686 910861609 /nfs/dbraw/zinc/86/16/09/910861609.db2.gz BGQBELCFACMYIO-GOSISDBHSA-N 2 0 410.002 4.046 20 0 HIADRP CC(C)[NH+]1CCN(CCC[NH+]2CCC(F)(c3ccccc3C(F)(F)F)CC2)CC1 ZINC000501877431 910900758 /nfs/dbraw/zinc/90/07/58/910900758.db2.gz RQWCDGTXVDGFPC-UHFFFAOYSA-N 2 0 415.519 4.382 20 0 HIADRP Cc1cc([C@@H]2CCC[N@H+]2CCCN2CC[NH+](C(C)C)CC2)ccc1Br ZINC000501883611 910902686 /nfs/dbraw/zinc/90/26/86/910902686.db2.gz AUKHECMACNIUOX-NRFANRHFSA-N 2 0 408.428 4.311 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000502861285 911869284 /nfs/dbraw/zinc/86/92/84/911869284.db2.gz KKYCEEQGHOTAFV-SZPZYZBQSA-N 2 0 414.638 4.230 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000502948866 911934700 /nfs/dbraw/zinc/93/47/00/911934700.db2.gz DYRAFKUJNFAPHU-UHFFFAOYSA-N 2 0 422.617 4.334 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)c1ccccc1 ZINC000503140912 912102168 /nfs/dbraw/zinc/10/21/68/912102168.db2.gz NFYHCPYIBRWOHP-NFBKMPQASA-N 2 0 408.590 4.252 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000506913730 915711082 /nfs/dbraw/zinc/71/10/82/915711082.db2.gz BVICHYAIJXCALY-NJDAHSKKSA-N 2 0 418.651 4.181 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)C1 ZINC000506919380 915719592 /nfs/dbraw/zinc/71/95/92/915719592.db2.gz SSGHZGQCHLEZOT-CQOQZXRMSA-N 2 0 412.622 4.120 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000506940283 915745612 /nfs/dbraw/zinc/74/56/12/915745612.db2.gz NZBWQECCDOGFRO-FCHUYYIVSA-N 2 0 414.638 4.324 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCC2)cc1)c1ccc(C[NH+]2CCSCC2)cc1 ZINC000513436023 921803650 /nfs/dbraw/zinc/80/36/50/921803650.db2.gz ZDOFKMHPLWABSA-UHFFFAOYSA-N 2 0 423.626 4.151 20 0 HIADRP COc1ccc(Cc2nc(C)c([C@H](C)[NH2+]CC3(C)CC[NH+](C)CC3)s2)cc1OC ZINC000507419401 916188892 /nfs/dbraw/zinc/18/88/92/916188892.db2.gz HOCQFDDIGQXUAT-INIZCTEOSA-N 2 0 417.619 4.442 20 0 HIADRP Cc1ccc(C(=O)N2CCC([NH2+][C@@H]3CC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)CC2)cc1 ZINC000507504126 916269544 /nfs/dbraw/zinc/26/95/44/916269544.db2.gz AVQBVFLTBPOXQZ-SKBVVQJISA-N 2 0 417.597 4.100 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)c1 ZINC000507811831 916603205 /nfs/dbraw/zinc/60/32/05/916603205.db2.gz YQROLEUXCBESDV-FQEVSTJZSA-N 2 0 406.357 4.062 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508703058 917463866 /nfs/dbraw/zinc/46/38/66/917463866.db2.gz XHQDFFLKBJVNGK-BWKNWUBXSA-N 2 0 405.586 4.313 20 0 HIADRP C[C@@H]([NH2+]CC1CCN(C(=O)c2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508712955 917473702 /nfs/dbraw/zinc/47/37/02/917473702.db2.gz DYBUWQCEGUWQOQ-BWKNWUBXSA-N 2 0 405.586 4.039 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(NC(=O)c2ccccn2)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508721150 917483144 /nfs/dbraw/zinc/48/31/44/917483144.db2.gz TWVRQIQNBYAOSY-NZQKXSOJSA-N 2 0 414.553 4.334 20 0 HIADRP Cc1cc(Cl)cc(C[NH+]2CCC(C(=O)NCC[N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000508742385 917501843 /nfs/dbraw/zinc/50/18/43/917501843.db2.gz BYPGRZNWTRUUJA-UHFFFAOYSA-N 2 0 413.993 4.109 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccccc2N2CC[NH+](CC)CC2)cc1)C1CC1 ZINC000508778246 917533294 /nfs/dbraw/zinc/53/32/94/917533294.db2.gz LTLYBAMNTSJUGQ-UHFFFAOYSA-N 2 0 406.574 4.065 20 0 HIADRP C[C@H](NC(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[C@H](c1ccccc1)[NH+](C)C ZINC000508855096 917608290 /nfs/dbraw/zinc/60/82/90/917608290.db2.gz UJGOKWDKWZBPMH-KXTAGPOFSA-N 2 0 422.617 4.372 20 0 HIADRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2ccc(-c3ccccc3Br)cc2)CC1 ZINC000509461188 918111060 /nfs/dbraw/zinc/11/10/60/918111060.db2.gz BTNNYYOZADIPOX-UHFFFAOYSA-N 2 0 417.391 4.441 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)c1ccco1 ZINC000509576712 918226831 /nfs/dbraw/zinc/22/68/31/918226831.db2.gz HOAZLIAEMCOBNV-UGKGYDQZSA-N 2 0 412.578 4.015 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCc2ccccc2C[N@@H+](C)C(C)C)[NH+]2CCCC2)o1 ZINC000510457400 918911914 /nfs/dbraw/zinc/91/19/14/918911914.db2.gz DRMSNZSSOGTKKQ-QFIPXVFZSA-N 2 0 412.578 4.065 20 0 HIADRP C[C@@H](NC(=O)NCc1ccccc1C[NH+]1CCCCC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000510512645 918959381 /nfs/dbraw/zinc/95/93/81/918959381.db2.gz PPUWRXVKYRDWJV-IFMALSPDSA-N 2 0 412.622 4.125 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N2CCCC23CC[NH+](C)CC3)c1 ZINC000510946175 919474559 /nfs/dbraw/zinc/47/45/59/919474559.db2.gz BXCAEOWAXGUQTP-UHFFFAOYSA-N 2 0 400.611 4.078 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2ccc(Br)cc2)c1 ZINC000511031032 919607639 /nfs/dbraw/zinc/60/76/39/919607639.db2.gz SRHWUWUASKGUMZ-INIZCTEOSA-N 2 0 418.379 4.408 20 0 HIADRP CCC(CC)(CNC(=O)N1CCCC12CC[NH+](C)CC2)[NH2+][C@@H](C)c1ccccc1 ZINC000511037085 919620217 /nfs/dbraw/zinc/62/02/17/919620217.db2.gz XIFFKWJFIYZKMA-FQEVSTJZSA-N 2 0 400.611 4.166 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511294371 919890143 /nfs/dbraw/zinc/89/01/43/919890143.db2.gz QUYXOVQDSMEQOF-WOJBJXKFSA-N 2 0 416.610 4.182 20 0 HIADRP FC(F)(F)c1cccc(N2CC[NH+](CCCC[NH2+][C@H]3CCCSC3)CC2)c1 ZINC000511368004 919958502 /nfs/dbraw/zinc/95/85/02/919958502.db2.gz WJVVBXOJOHKFJZ-SFHVURJKSA-N 2 0 401.542 4.093 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N2CCC[NH+](Cc3ccc(OC)cc3)CC2)cc1 ZINC000511406980 920020405 /nfs/dbraw/zinc/02/04/05/920020405.db2.gz NCVULRXXJSARPX-UHFFFAOYSA-N 2 0 423.601 4.275 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2c(Cl)oc3ccccc32)CC1 ZINC000511646235 920312271 /nfs/dbraw/zinc/31/22/71/920312271.db2.gz IZPLEHPEIATLNL-UHFFFAOYSA-N 2 0 405.970 4.002 20 0 HIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)sc1Br ZINC000511926036 920673663 /nfs/dbraw/zinc/67/36/63/920673663.db2.gz JNPUOXPUJJVIFD-PBHICJAKSA-N 2 0 409.393 4.236 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)N[C@H]1CC[NH+](Cc2ccccc2)CC1(C)C ZINC000512124413 920875266 /nfs/dbraw/zinc/87/52/66/920875266.db2.gz ULHHRZCVVGRXFA-GMAHTHKFSA-N 2 0 414.638 4.241 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000512132463 920880151 /nfs/dbraw/zinc/88/01/51/920880151.db2.gz SCMKJTCGFBUVGB-SNPRPXQTSA-N 2 0 403.876 4.292 20 0 HIADRP Cc1cc([C@H](C)[NH2+]CCCN2CCN(c3cc[nH+]cc3)CC2)sc1Br ZINC000512135558 920882486 /nfs/dbraw/zinc/88/24/86/920882486.db2.gz LYORWMOINQWIKU-INIZCTEOSA-N 2 0 423.424 4.077 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512318876 921069572 /nfs/dbraw/zinc/06/95/72/921069572.db2.gz UHFIJCIBLIXRMX-GGPKGHCWSA-N 2 0 406.014 4.320 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512323558 921073860 /nfs/dbraw/zinc/07/38/60/921073860.db2.gz NOXQHMGBKYVGMR-ZACQAIPSSA-N 2 0 422.411 4.409 20 0 HIADRP CCc1cc(N2CCC[C@H]([NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)C2)ncn1 ZINC000513717985 922038394 /nfs/dbraw/zinc/03/83/94/922038394.db2.gz UWCBMELNAOZIKE-WLXPTCNVSA-N 2 0 407.606 4.041 20 0 HIADRP CCCN(C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000513883831 922213074 /nfs/dbraw/zinc/21/30/74/922213074.db2.gz LJUAWWARHSRMMO-QFIPXVFZSA-N 2 0 414.638 4.382 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000514059001 922382239 /nfs/dbraw/zinc/38/22/39/922382239.db2.gz GNEKFIWKNLJJJY-UHFFFAOYSA-N 2 0 411.512 4.064 20 0 HIADRP CN(C)C(=O)c1cccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000514092168 922415121 /nfs/dbraw/zinc/41/51/21/922415121.db2.gz CHONJANRPRGXPU-ISJGIBHGSA-N 2 0 405.586 4.169 20 0 HIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(NC(=O)CCCOc3ccccc3)cc2)[C@H]2CCC[C@@H]21 ZINC000514094648 922419154 /nfs/dbraw/zinc/41/91/54/922419154.db2.gz NSEUPSXHXVSNHZ-DSITVLBTSA-N 2 0 421.585 4.447 20 0 HIADRP Cc1ccc(COc2ccc(C[NH2+]Cc3ccccc3C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000514238264 922575896 /nfs/dbraw/zinc/57/58/96/922575896.db2.gz RAKSEWPTBYDTMQ-SANMLTNESA-N 2 0 416.565 4.430 20 0 HIADRP COc1cccc(OC)c1OCCCC[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000514689057 922757180 /nfs/dbraw/zinc/75/71/80/922757180.db2.gz SWJMZJAYAMVSSQ-RTWAWAEBSA-N 2 0 404.595 4.449 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)c1ccccc1Cl ZINC000515817823 923370771 /nfs/dbraw/zinc/37/07/71/923370771.db2.gz CZANJMHZMBKMTL-HXUWFJFHSA-N 2 0 409.018 4.285 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)NC3CC[NH+](C(C)(C)C)CC3)cc2)C1 ZINC000515820261 923373141 /nfs/dbraw/zinc/37/31/41/923373141.db2.gz FUXXTPJTCMFASX-WOJBJXKFSA-N 2 0 414.638 4.227 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)N[C@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)CC1 ZINC000516579886 923800976 /nfs/dbraw/zinc/80/09/76/923800976.db2.gz ZVOWGYPHOBBMDM-BWKNWUBXSA-N 2 0 420.601 4.094 20 0 HIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000517782536 926833592 /nfs/dbraw/zinc/83/35/92/926833592.db2.gz QAHNKAYVJLEADD-NRFANRHFSA-N 2 0 400.998 4.365 20 0 HIADRP COc1ccc(C2(C[NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CCOCC2)cc1 ZINC000518007660 926948577 /nfs/dbraw/zinc/94/85/77/926948577.db2.gz MSIVWPSSECTOHE-GGAORHGYSA-N 2 0 408.586 4.244 20 0 HIADRP CCSc1cccc(F)c1NC(=O)NCC1([NH+]2CCCCC2)CCN(C)CC1 ZINC000518015971 926954652 /nfs/dbraw/zinc/95/46/52/926954652.db2.gz VYVGTAMIQJECKA-UHFFFAOYSA-N 2 0 408.587 4.010 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2csc(-c3ccccc3)n2)[C@H](c2ccccc2)C1 ZINC000518269470 927126227 /nfs/dbraw/zinc/12/62/27/927126227.db2.gz BLMCOQBEOIIEKQ-QHCPKHFHSA-N 2 0 406.599 4.279 20 0 HIADRP COc1cc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)cc(OC)c1O ZINC000518836638 927535258 /nfs/dbraw/zinc/53/52/58/927535258.db2.gz KCWZBGSMGWBDJS-UHFFFAOYSA-N 2 0 404.938 4.065 20 0 HIADRP Fc1cncc([C@@H]([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C2CC2)c1 ZINC000519192132 927819562 /nfs/dbraw/zinc/81/95/62/927819562.db2.gz ARQICTZXQUPAAP-UPVQGACJSA-N 2 0 409.549 4.190 20 0 HIADRP CC[NH+](CC)CCOc1ccccc1NC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000519912660 928146306 /nfs/dbraw/zinc/14/63/06/928146306.db2.gz SRQIUWOUHGGJHP-JOCHJYFZSA-N 2 0 409.574 4.258 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000520112701 928319115 /nfs/dbraw/zinc/31/91/15/928319115.db2.gz MNDNMIDHGHHYGG-HSZRJFAPSA-N 2 0 411.565 4.194 20 0 HIADRP O=C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000520782641 928815918 /nfs/dbraw/zinc/81/59/18/928815918.db2.gz ZHBGTHMWHIREHN-FCHUYYIVSA-N 2 0 419.013 4.137 20 0 HIADRP CCOc1cc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc(Br)c1OC ZINC000520949780 928885830 /nfs/dbraw/zinc/88/58/30/928885830.db2.gz QRRQCPVLLBBHCQ-INIZCTEOSA-N 2 0 413.400 4.458 20 0 HIADRP C[NH+](C)CCN1CCC([NH2+]Cc2ccc(-c3ccc(Br)cc3)s2)CC1 ZINC000521819310 929475953 /nfs/dbraw/zinc/47/59/53/929475953.db2.gz ZRUWYWBDNVOGKO-UHFFFAOYSA-N 2 0 422.436 4.293 20 0 HIADRP COc1cc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(SC)cc1OC ZINC000521889163 929537820 /nfs/dbraw/zinc/53/78/20/929537820.db2.gz GKUZPNKRSUYEHQ-UHFFFAOYSA-N 2 0 416.587 4.189 20 0 HIADRP Cc1cccc(CN(CC[NH+](C)C)C(=O)NCc2ccccc2C[N@@H+](C)C(C)C)c1 ZINC000524499421 929646866 /nfs/dbraw/zinc/64/68/66/929646866.db2.gz WVJOVCKBPXFZIY-UHFFFAOYSA-N 2 0 410.606 4.109 20 0 HIADRP Cc1ccccc1[C@H]1C[C@H](C)[N@@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000524593616 929703840 /nfs/dbraw/zinc/70/38/40/929703840.db2.gz JDGLRIXJVYLEHU-URXFXBBRSA-N 2 0 405.586 4.085 20 0 HIADRP C[NH+](C)CCn1ccc2ccc(NC(=O)c3ccc(C[NH+]4CCSCC4)cc3)cc21 ZINC000524835311 929851797 /nfs/dbraw/zinc/85/17/97/929851797.db2.gz WFISWQIRTKMGAM-UHFFFAOYSA-N 2 0 422.598 4.004 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CCC[NH+](Cc3ccccc3)C[C@H]2C)cc1)C1CC1 ZINC000524868565 929865825 /nfs/dbraw/zinc/86/58/25/929865825.db2.gz KFHZYJNLZGWSEC-OAQYLSRUSA-N 2 0 405.586 4.408 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc(OC)c(Cl)c2)CC1 ZINC000525695019 930407240 /nfs/dbraw/zinc/40/72/40/930407240.db2.gz HMOFDYHEXWGRHN-MRXNPFEDSA-N 2 0 405.945 4.480 20 0 HIADRP Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000527376871 930651681 /nfs/dbraw/zinc/65/16/81/930651681.db2.gz DAPRKBLTVCWLHG-HXUWFJFHSA-N 2 0 412.578 4.092 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Cl)cc1 ZINC000530599571 930765582 /nfs/dbraw/zinc/76/55/82/930765582.db2.gz ZNSCFGSHRATVRA-QFIPXVFZSA-N 2 0 414.981 4.038 20 0 HIADRP O=C(NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1)NC1CC[NH+](C2CCCC2)CC1 ZINC000531136981 930938414 /nfs/dbraw/zinc/93/84/14/930938414.db2.gz WXDDZWXFGYWXQM-QFIPXVFZSA-N 2 0 419.013 4.183 20 0 HIADRP O=C(NC[C@H](c1ccccc1Cl)[NH+]1CCCC1)NC1CC[NH+](C2CCCC2)CC1 ZINC000531136979 930939709 /nfs/dbraw/zinc/93/97/09/930939709.db2.gz WXDDZWXFGYWXQM-JOCHJYFZSA-N 2 0 419.013 4.183 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+]Cc2ccc(-c3ccccc3Br)s2)CC1 ZINC000531142260 930944031 /nfs/dbraw/zinc/94/40/31/930944031.db2.gz KTFKXBFUHGUCLK-UHFFFAOYSA-N 2 0 422.436 4.293 20 0 HIADRP CC[C@H](C(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1)[NH+](CC)CC ZINC000531300496 931007033 /nfs/dbraw/zinc/00/70/33/931007033.db2.gz WZDUTCQANIYDQX-MISYRCLQSA-N 2 0 413.528 4.325 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)CC1 ZINC000531442265 931058569 /nfs/dbraw/zinc/05/85/69/931058569.db2.gz COSRVKOQQYQRSN-FQEVSTJZSA-N 2 0 420.601 4.155 20 0 HIADRP CO[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccc(Cl)cc1 ZINC000531594411 931113306 /nfs/dbraw/zinc/11/33/06/931113306.db2.gz GQBZXUZIYJJYCJ-QHCPKHFHSA-N 2 0 401.982 4.348 20 0 HIADRP C[C@H](c1ccccc1)N1CC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000531785711 931196702 /nfs/dbraw/zinc/19/67/02/931196702.db2.gz YREUVADLRMJCCK-BVAGGSTKSA-N 2 0 421.629 4.483 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000531947121 931258740 /nfs/dbraw/zinc/25/87/40/931258740.db2.gz FKOMFWDWDNBSRY-KDURUIRLSA-N 2 0 406.014 4.292 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1ccc(S(C)(=O)=O)cc1 ZINC000531946363 931258988 /nfs/dbraw/zinc/25/89/88/931258988.db2.gz FDAWRMVBRYPDRB-OALUTQOASA-N 2 0 400.588 4.315 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(Oc2ccccc2)cc1 ZINC000531989388 931278362 /nfs/dbraw/zinc/27/83/62/931278362.db2.gz USEAZALVJGXPOP-FQEVSTJZSA-N 2 0 402.542 4.477 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1ccc(Br)s1)C1CC[NH+](C)CC1 ZINC000532108414 931315395 /nfs/dbraw/zinc/31/53/95/931315395.db2.gz UKSSXWXZXOYZFH-UHFFFAOYSA-N 2 0 408.409 4.331 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc4c(c3)CCC(=O)N4)CC2)cc1 ZINC000532205507 931350085 /nfs/dbraw/zinc/35/00/85/931350085.db2.gz ASXDSWPLDJJSCS-GOSISDBHSA-N 2 0 407.558 4.143 20 0 HIADRP Cc1nc(-c2cc([C@H](C)[NH2+]Cc3ccc(N4CC[NH+](C)CC4)nc3)cs2)cs1 ZINC000532451522 931439654 /nfs/dbraw/zinc/43/96/54/931439654.db2.gz BKYSIOAMRRDMDF-HNNXBMFYSA-N 2 0 413.616 4.178 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(SCC(F)F)cc1 ZINC000532452164 931440483 /nfs/dbraw/zinc/44/04/83/931440483.db2.gz YBQFWIDMGXKVAE-MRXNPFEDSA-N 2 0 406.546 4.041 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000532459322 931444625 /nfs/dbraw/zinc/44/46/25/931444625.db2.gz OVMDDAYSPSLPIJ-KSZLIROESA-N 2 0 410.002 4.413 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000532459323 931444880 /nfs/dbraw/zinc/44/48/80/931444880.db2.gz OVMDDAYSPSLPIJ-KURKYZTESA-N 2 0 410.002 4.413 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]C3CCC(c4ccccc4)CC3)c2)C1 ZINC000532514918 931470756 /nfs/dbraw/zinc/47/07/56/931470756.db2.gz WQQUEWMLBCXBAT-BQCMWAFGSA-N 2 0 405.586 4.200 20 0 HIADRP CN(c1ccccc1CNc1cccc(C[NH+]2CCSCC2)c1)C1CC[NH+](C)CC1 ZINC000532728013 931613615 /nfs/dbraw/zinc/61/36/15/931613615.db2.gz FDWYIWKIGVJWBW-UHFFFAOYSA-N 2 0 424.658 4.378 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NC1CCC(C[NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000532754655 931623185 /nfs/dbraw/zinc/62/31/85/931623185.db2.gz LOZHFQNFFLCPJT-GQOXECLESA-N 2 0 413.528 4.325 20 0 HIADRP COc1ccc(NC(=O)CC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)cc1 ZINC000533025088 931744328 /nfs/dbraw/zinc/74/43/28/931744328.db2.gz YNSUHCFOXBHQHP-URXFXBBRSA-N 2 0 407.558 4.010 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1 ZINC000533090534 931768662 /nfs/dbraw/zinc/76/86/62/931768662.db2.gz SVTQEPZHFOVMTF-QHAWAJNXSA-N 2 0 411.590 4.228 20 0 HIADRP C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1C[C@@H](c2ccc(F)cc2)C[C@H]1C ZINC000533300022 931833171 /nfs/dbraw/zinc/83/31/71/931833171.db2.gz XBQSNYDSEKWLFU-QTEQDKRBSA-N 2 0 423.576 4.173 20 0 HIADRP C[N@@H+]1CC[C@@H](CNC(=O)NCCC[NH2+]C2CCCCC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000534250511 932365191 /nfs/dbraw/zinc/36/51/91/932365191.db2.gz IBXOWMQPBWQFBO-UWJYYQICSA-N 2 0 424.992 4.084 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)[C@H](c2ccccc2)C1 ZINC000534352017 932389425 /nfs/dbraw/zinc/38/94/25/932389425.db2.gz IHAVVLAGXFBEEA-DFCKQENNSA-N 2 0 407.602 4.123 20 0 HIADRP CC(=O)c1ccc(NC(=O)CC[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000534968691 932867375 /nfs/dbraw/zinc/86/73/75/932867375.db2.gz UWLJZEUPKBBGAI-UHFFFAOYSA-N 2 0 419.569 4.206 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000535088128 932902962 /nfs/dbraw/zinc/90/29/62/932902962.db2.gz LKMDICAXOAVKIA-BKMJKUGQSA-N 2 0 407.602 4.082 20 0 HIADRP CN(c1ccccc1C[NH2+][C@@H]1CCCN(c2ccccc2F)C1)C1CC[NH+](C)CC1 ZINC000535691233 933346588 /nfs/dbraw/zinc/34/65/88/933346588.db2.gz WKYUROWMJNBKDU-OAQYLSRUSA-N 2 0 410.581 4.115 20 0 HIADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(OCc3ccccc3)c(Br)c2)CC1 ZINC000537344746 933726938 /nfs/dbraw/zinc/72/69/38/933726938.db2.gz RXGARSSCELTGBM-UHFFFAOYSA-N 2 0 401.348 4.380 20 0 HIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cn(Cc3ccccc3)nc2-c2cccnc2)[C@H](C)C1 ZINC000537615073 938333001 /nfs/dbraw/zinc/33/30/01/938333001.db2.gz KSFYPAPDKRVVKF-HYBUGGRVSA-N 2 0 403.574 4.156 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cn(Cc3ccccc3)nc2-c2cccnc2)[C@H](C)C1 ZINC000537615111 938333445 /nfs/dbraw/zinc/33/34/45/938333445.db2.gz KSFYPAPDKRVVKF-YKSBVNFPSA-N 2 0 403.574 4.156 20 0 HIADRP COc1cc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)ccc1OCc1ccccc1 ZINC000537621010 938336258 /nfs/dbraw/zinc/33/62/58/938336258.db2.gz PVNJCPAUUFPGIH-UHFFFAOYSA-N 2 0 424.585 4.351 20 0 HIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]C[C@@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000537737120 938366109 /nfs/dbraw/zinc/36/61/09/938366109.db2.gz QPDUMBZWLGVKPI-GBXCKJPGSA-N 2 0 413.993 4.349 20 0 HIADRP CCCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)cc1OCCC ZINC000537957916 938433413 /nfs/dbraw/zinc/43/34/13/938433413.db2.gz YNCYNNLGOPGDBC-YUXAGFNASA-N 2 0 404.595 4.293 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000537959213 938434898 /nfs/dbraw/zinc/43/48/98/938434898.db2.gz YDMRKLRLZNRMIG-HLAWJBBLSA-N 2 0 415.578 4.294 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000563314348 945175498 /nfs/dbraw/zinc/17/54/98/945175498.db2.gz IXNHOWFOEUZFSX-PZJWPPBQSA-N 2 0 415.603 4.011 20 0 HIADRP C[NH+]1CCN(C[C@H]([NH2+][C@H]2CCc3c2cccc3Br)c2ccccc2)CC1 ZINC000538100526 938502488 /nfs/dbraw/zinc/50/24/88/938502488.db2.gz PHGVAYSJCQRXCF-VXKWHMMOSA-N 2 0 414.391 4.015 20 0 HIADRP CC(C)Oc1ccccc1[C@H](C)[NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000538122487 938509119 /nfs/dbraw/zinc/50/91/19/938509119.db2.gz DQVWSPCFJOJFLW-FQEVSTJZSA-N 2 0 409.574 4.037 20 0 HIADRP C[C@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1C(F)(F)F ZINC000538258559 938576686 /nfs/dbraw/zinc/57/66/86/938576686.db2.gz VZFQPZVLXMKVAX-KRWDZBQOSA-N 2 0 419.491 4.268 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@H]1CCCN(c3cccc(F)c3)C1)c1ccccc1O2 ZINC000538293662 938585172 /nfs/dbraw/zinc/58/51/72/938585172.db2.gz LUQANYUTIXJULD-NZQKXSOJSA-N 2 0 409.549 4.372 20 0 HIADRP Cc1ccccc1[C@@H]([NH2+][C@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)C1CC1 ZINC000538390468 938609577 /nfs/dbraw/zinc/60/95/77/938609577.db2.gz ALIZXOIYSFMFPR-NLFFAJNJSA-N 2 0 405.586 4.205 20 0 HIADRP CCOc1cccc2cc([C@H](C)[NH2+]CCCN3CCN(c4cc[nH+]cc4)CC3)oc21 ZINC000538393934 938610146 /nfs/dbraw/zinc/61/01/46/938610146.db2.gz WUNMVBWTYUKLFE-IBGZPJMESA-N 2 0 408.546 4.089 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3ccc(OC(F)F)c(F)c3)CC2)CC1 ZINC000538723181 938691808 /nfs/dbraw/zinc/69/18/08/938691808.db2.gz NTDXAJBVTJDNSU-UHFFFAOYSA-N 2 0 413.528 4.055 20 0 HIADRP FC(F)(F)c1ccn(-c2ccc(C[N@@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)cc2)n1 ZINC000538795422 938714239 /nfs/dbraw/zinc/71/42/39/938714239.db2.gz AGRXDSFIVWPTDL-PXNSSMCTSA-N 2 0 404.480 4.340 20 0 HIADRP COCCc1nc(C)c([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)s1 ZINC000538867698 938728268 /nfs/dbraw/zinc/72/82/68/938728268.db2.gz PFXTXNFIXDWDED-FGTMMUONSA-N 2 0 417.619 4.100 20 0 HIADRP CC(C[NH+]1CCC(Cc2cccnc2)CC1)C[NH+]1CCC(Cc2cccnc2)CC1 ZINC000538943251 938742865 /nfs/dbraw/zinc/74/28/65/938742865.db2.gz PGIZMODKRKSZQE-UHFFFAOYSA-N 2 0 406.618 4.322 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3cn(C)nc3-c3ccccc3)CC2)c1 ZINC000538970168 938754805 /nfs/dbraw/zinc/75/48/05/938754805.db2.gz UVNYBSLUCGRVLQ-UHFFFAOYSA-N 2 0 417.601 4.088 20 0 HIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000539043543 938780385 /nfs/dbraw/zinc/78/03/85/938780385.db2.gz VLVXWZOUEUACCY-ZJOUEHCJSA-N 2 0 415.603 4.009 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)ccn1 ZINC000539046855 938781537 /nfs/dbraw/zinc/78/15/37/938781537.db2.gz HLQZPZVZIDWDSJ-QGZVFWFLSA-N 2 0 410.345 4.332 20 0 HIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C2CC[NH+]([C@H]4CCC[C@@H]4O)CC2)CCC3)cc1 ZINC000539059621 938786885 /nfs/dbraw/zinc/78/68/85/938786885.db2.gz KIKSCJHJJSDHLO-HJNYFJLDSA-N 2 0 411.615 4.463 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1N[C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000539394759 938853997 /nfs/dbraw/zinc/85/39/97/938853997.db2.gz ZDWDHAXQGIAQNM-SDUSCBPUSA-N 2 0 419.613 4.475 20 0 HIADRP CC(C)[NH+]1CCN(c2cccc(N[C@@H](C)[C@H](c3ccccc3)[NH+]3CCOCC3)c2)CC1 ZINC000539645257 938893047 /nfs/dbraw/zinc/89/30/47/938893047.db2.gz MHNZBKFVEFWSOG-BKMJKUGQSA-N 2 0 422.617 4.091 20 0 HIADRP Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH+]1CCC(OCC[NH+]2CCCC2)CC1 ZINC000539821126 938944221 /nfs/dbraw/zinc/94/42/21/938944221.db2.gz ZTZOUGNVMFPRFS-UHFFFAOYSA-N 2 0 416.997 4.219 20 0 HIADRP COc1ccc([C@H]2CCCC[C@H]2[NH2+]Cc2ccncc2OCCC[NH+](C)C)cc1F ZINC000563567025 945217790 /nfs/dbraw/zinc/21/77/90/945217790.db2.gz XUKOOAMKKARFIX-IFMALSPDSA-N 2 0 415.553 4.376 20 0 HIADRP C[NH+](C)CCOC1CC[NH+](Cc2cn(-c3ccccc3)nc2-c2cccs2)CC1 ZINC000539831825 938950938 /nfs/dbraw/zinc/95/09/38/938950938.db2.gz JCLQCAZOTJLAQZ-UHFFFAOYSA-N 2 0 410.587 4.143 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)Nc1cccc(CC[NH+]3CCC(C)CC3)c1)CC2 ZINC000539875610 938963149 /nfs/dbraw/zinc/96/31/49/938963149.db2.gz VEPLJQHWZBVMOP-RPWUZVMVSA-N 2 0 412.622 4.440 20 0 HIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000540043826 939047392 /nfs/dbraw/zinc/04/73/92/939047392.db2.gz HFCMENQREJOVTA-QFIPXVFZSA-N 2 0 412.965 4.079 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@@H](c3cccs3)C3CCCC3)c2)C1 ZINC000540087369 939065395 /nfs/dbraw/zinc/06/53/95/939065395.db2.gz ZSDKIJMNFKLQCW-JTHBVZDNSA-N 2 0 411.615 4.467 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)ccn1 ZINC000540144324 939090146 /nfs/dbraw/zinc/09/01/46/939090146.db2.gz NGSTWGAMPVIVBE-LJQANCHMSA-N 2 0 408.571 4.313 20 0 HIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)cc1 ZINC000540161096 939096526 /nfs/dbraw/zinc/09/65/26/939096526.db2.gz NUHVPBCWTLKSFG-CCDWMCETSA-N 2 0 412.549 4.086 20 0 HIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cc1 ZINC000540161097 939096810 /nfs/dbraw/zinc/09/68/10/939096810.db2.gz NUHVPBCWTLKSFG-GVAUOCQISA-N 2 0 412.549 4.086 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H](CO)Cc1ccccc1C(F)(F)F ZINC000540161844 939097589 /nfs/dbraw/zinc/09/75/89/939097589.db2.gz YWFONWLKXPAWQZ-QMHWCDLVSA-N 2 0 420.519 4.357 20 0 HIADRP C[C@@H]([NH2+]CCc1nc(-c2ccc(Cl)cc2)no1)c1cccc(OCC[NH+](C)C)c1 ZINC000540182696 939108545 /nfs/dbraw/zinc/10/85/45/939108545.db2.gz LRYFPFLIDUZHBS-MRXNPFEDSA-N 2 0 414.937 4.224 20 0 HIADRP C[C@H]([NH2+]CCc1nc2ccccc2n1C(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000540187251 939111836 /nfs/dbraw/zinc/11/18/36/939111836.db2.gz ITIAMUJCXVUECJ-INIZCTEOSA-N 2 0 402.489 4.265 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@@H]1CCCN(Cc3ccccc3)C1)c1ccccc1O2 ZINC000540461018 939261207 /nfs/dbraw/zinc/26/12/07/939261207.db2.gz IRDYJCJBYUSGPZ-VWNXMTODSA-N 2 0 405.586 4.229 20 0 HIADRP Cc1nc2ccccc2n1CCC[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000540468107 939264476 /nfs/dbraw/zinc/26/44/76/939264476.db2.gz KUKGTHLLQGFJBZ-QFIPXVFZSA-N 2 0 404.558 4.313 20 0 HIADRP Cc1cc([C@H]([NH2+][C@H](C)C(=O)NC2CC[NH+](Cc3ccccc3)CC2)C2CC2)ccc1F ZINC000540523148 939286622 /nfs/dbraw/zinc/28/66/22/939286622.db2.gz LEFAVKPOYCYDBU-KBMIEXCESA-N 2 0 423.576 4.344 20 0 HIADRP CCc1ncc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)s1 ZINC000540537084 939295020 /nfs/dbraw/zinc/29/50/20/939295020.db2.gz UCDZZZMSASHIFZ-UHFFFAOYSA-N 2 0 406.599 4.318 20 0 HIADRP CCOc1cccc2cc([C@H](C)[NH2+]CC3CC[NH+](CC(=O)NC(C)(C)C)CC3)oc21 ZINC000540595513 939314145 /nfs/dbraw/zinc/31/41/45/939314145.db2.gz XCZMRNQTZUJGMZ-KRWDZBQOSA-N 2 0 415.578 4.109 20 0 HIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)C(=O)NC(c2ccccc2)c2ccccc2)CC1 ZINC000563671139 945246764 /nfs/dbraw/zinc/24/67/64/945246764.db2.gz RCWYNTJLITVWHO-OAQYLSRUSA-N 2 0 407.602 4.335 20 0 HIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)C(=O)NC(c2ccccc2)c2ccccc2)CC1 ZINC000563671136 945247840 /nfs/dbraw/zinc/24/78/40/945247840.db2.gz RCWYNTJLITVWHO-NRFANRHFSA-N 2 0 407.602 4.335 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3c(Br)cccc32)C1 ZINC000541246991 939487534 /nfs/dbraw/zinc/48/75/34/939487534.db2.gz OOQFBLPRDDFEIW-GCJKJVERSA-N 2 0 415.375 4.183 20 0 HIADRP CCN1CC[C@@H]([NH2+]Cc2cn(-c3cc[nH+]cc3)nc2C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000541377671 939501030 /nfs/dbraw/zinc/50/10/30/939501030.db2.gz HGVORXAXYJERIA-YADHBBJMSA-N 2 0 413.928 4.293 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H]3CCCc4c(Cl)cccc43)c2)C1 ZINC000541744622 939618976 /nfs/dbraw/zinc/61/89/76/939618976.db2.gz UCZLLOPCLUXHNP-XXBNENTESA-N 2 0 411.977 4.205 20 0 HIADRP Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000541744985 939619369 /nfs/dbraw/zinc/61/93/69/939619369.db2.gz BJBNOVJQAQMBRS-XZOQPEGZSA-N 2 0 406.636 4.182 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(F)c(F)c1 ZINC000541913422 939652227 /nfs/dbraw/zinc/65/22/27/939652227.db2.gz JWWPTSFQRMHVOD-OFNKIYASSA-N 2 0 415.528 4.149 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccccc1OC(F)F ZINC000541918973 939653893 /nfs/dbraw/zinc/65/38/93/939653893.db2.gz QWWYFKCMTNEHHS-CTNGQTDRSA-N 2 0 404.501 4.486 20 0 HIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c1 ZINC000541917991 939653925 /nfs/dbraw/zinc/65/39/25/939653925.db2.gz KDKQDNBTZODGDT-FXAWDEMLSA-N 2 0 404.501 4.404 20 0 HIADRP C[NH+](C)CCN(Cc1ccco1)C(=O)c1cccc(C[N@H+](C)Cc2ccccc2)c1 ZINC000542233531 939768807 /nfs/dbraw/zinc/76/88/07/939768807.db2.gz QSIFAPCBTPPELK-UHFFFAOYSA-N 2 0 405.542 4.116 20 0 HIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2cccc(Br)c21 ZINC000542845616 939862428 /nfs/dbraw/zinc/86/24/28/939862428.db2.gz DDNCBFXLZTUFFV-FPDPHYFHSA-N 2 0 415.375 4.354 20 0 HIADRP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000542846350 939862554 /nfs/dbraw/zinc/86/25/54/939862554.db2.gz JMAIZSKNODMRKK-UNMCSNQZSA-N 2 0 400.950 4.219 20 0 HIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cc1F ZINC000542847764 939862837 /nfs/dbraw/zinc/86/28/37/939862837.db2.gz SZCYWQSHRSPQGT-FIXSFTCYSA-N 2 0 412.549 4.217 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(F)cc1Br ZINC000542849459 939863085 /nfs/dbraw/zinc/86/30/85/939863085.db2.gz PMUKUYQZXXEAJC-KSSFIOAISA-N 2 0 407.327 4.006 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+][C@@H](C)c2ccc(NC(C)=O)cc2)CC1 ZINC000543776662 940183179 /nfs/dbraw/zinc/18/31/79/940183179.db2.gz ZQGXMIFHYJOHDD-ZWKOTPCHSA-N 2 0 412.553 4.338 20 0 HIADRP COc1ccc2[nH]cc(C3CC[NH+](Cc4cn(-c5cc[nH+]cc5)nc4C)CC3)c2c1 ZINC000544347277 940396677 /nfs/dbraw/zinc/39/66/77/940396677.db2.gz QTHBVXMFVQEUCB-UHFFFAOYSA-N 2 0 401.514 4.445 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CN1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000544349393 940396837 /nfs/dbraw/zinc/39/68/37/940396837.db2.gz UOPFLMZDGMTCCQ-WIOPSUGQSA-N 2 0 401.558 4.062 20 0 HIADRP Fc1ccc([C@H]([NH2+]CCCN2CC[NH+](Cc3ccccc3)CC2)c2ccccn2)cc1 ZINC000544361665 940401708 /nfs/dbraw/zinc/40/17/08/940401708.db2.gz VXAVEFFREVIVLX-SANMLTNESA-N 2 0 418.560 4.108 20 0 HIADRP C[C@H]([NH2+]CC[S@@](=O)c1cc(Cl)ccc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544419267 940419674 /nfs/dbraw/zinc/41/96/74/940419674.db2.gz AIKASDUHQGLBDA-XSKAOVLVSA-N 2 0 403.419 4.344 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000547505035 941066065 /nfs/dbraw/zinc/06/60/65/941066065.db2.gz POBMDQAPNVTKPP-ATIYNZHBSA-N 3 0 421.629 4.407 20 0 HIADRP C[C@H]([NH2+]C[C@H](CO)Cc1ccc(C(F)(F)F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548154133 941089315 /nfs/dbraw/zinc/08/93/15/941089315.db2.gz FDLVCFMFHADPDV-VLCRHTCISA-N 2 0 420.519 4.357 20 0 HIADRP CC[C@H]([NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000548155920 941089724 /nfs/dbraw/zinc/08/97/24/941089724.db2.gz JSKXBVONUVAUKY-CBRSEMLDSA-N 2 0 417.601 4.455 20 0 HIADRP CC[N@H+](CCNC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C)C1CC1 ZINC000548970540 941135996 /nfs/dbraw/zinc/13/59/96/941135996.db2.gz FHSRKCZGCDRINF-IFTBVCKDSA-N 2 0 419.013 4.037 20 0 HIADRP CC(C)[N@@H+]1CCCC[C@@H]1CSc1nnc(CN2CCCC2)n1Cc1ccccc1 ZINC000549618628 941201627 /nfs/dbraw/zinc/20/16/27/941201627.db2.gz RKOXXYJOCAZPEI-OAQYLSRUSA-N 2 0 413.635 4.277 20 0 HIADRP COc1ccc2c(c1)C[C@H]([NH2+]C[C@H]1C[N@H+](Cc3ccccc3)CC13CCOCC3)CC2 ZINC000549868344 941221220 /nfs/dbraw/zinc/22/12/20/941221220.db2.gz UIVRFMBSICOAIK-LOSJGSFVSA-N 2 0 420.597 4.071 20 0 HIADRP COc1cc(C[NH+]2CCCO[C@@H](C(C)C)C2)cc(C[N@@H+]2CCCO[C@@H](C(C)C)C2)c1 ZINC000550186418 941295473 /nfs/dbraw/zinc/29/54/73/941295473.db2.gz RNQXMIJOVRZSJP-JWQCQUIFSA-N 2 0 418.622 4.189 20 0 HIADRP Brc1cccc2c1C[C@@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CC2 ZINC000550199761 941297858 /nfs/dbraw/zinc/29/78/58/941297858.db2.gz KEFWYUZEYBRHGY-SFHVURJKSA-N 2 0 400.364 4.208 20 0 HIADRP COC(=O)CCC[C@H]1CCC[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000550218581 941300501 /nfs/dbraw/zinc/30/05/01/941300501.db2.gz RGMBZWGLCMSDPT-TZIWHRDSSA-N 2 0 402.579 4.151 20 0 HIADRP CC(C)(C)[N@@H+]1C[C@@H](C(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)[C@H](C(F)(F)F)C1 ZINC000550259679 941304959 /nfs/dbraw/zinc/30/49/59/941304959.db2.gz SGTDKFPPYAXMSX-GUDVDZBRSA-N 2 0 417.560 4.010 20 0 HIADRP COc1ccccc1/C=C/C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000550263814 941305707 /nfs/dbraw/zinc/30/57/07/941305707.db2.gz XEHBADBXBJIASX-QQRRWSATSA-N 2 0 406.570 4.227 20 0 HIADRP C[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ncc(Br)cn1 ZINC000550829872 941371666 /nfs/dbraw/zinc/37/16/66/941371666.db2.gz OQZILVZLGFGGTN-MNNVXMFVSA-N 2 0 403.368 4.333 20 0 HIADRP COc1cc([C@@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)ccc1F ZINC000550883432 941378778 /nfs/dbraw/zinc/37/87/78/941378778.db2.gz ZNWSFCMCFZUQKN-DENIHFKCSA-N 2 0 412.549 4.414 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C2CCC([NH+](C)Cc3ccccc3)CC2)[C@H](C)C1 ZINC000550888031 941379687 /nfs/dbraw/zinc/37/96/87/941379687.db2.gz XITLLLITXRKBOK-WJUOEICESA-N 3 0 401.639 4.156 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCN(C(=O)Nc3ccccc3)C2)CC1 ZINC000550933567 941383015 /nfs/dbraw/zinc/38/30/15/941383015.db2.gz LERNTNBCVDSCNB-WLXPTCNVSA-N 2 0 406.574 4.326 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H]3Cc4[nH]c5ccccc5c4C3)C3(C2)CCOCC3)cc1 ZINC000551265277 941439332 /nfs/dbraw/zinc/43/93/32/941439332.db2.gz RYJODZFGTPRSNS-FCHUYYIVSA-N 2 0 415.581 4.154 20 0 HIADRP O=C(NC1CC[NH+](Cc2ccc(F)cc2)CC1)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000551389859 941467527 /nfs/dbraw/zinc/46/75/27/941467527.db2.gz MTPRYQOPJDLYHN-UHFFFAOYSA-N 2 0 409.549 4.206 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000552050721 941574509 /nfs/dbraw/zinc/57/45/09/941574509.db2.gz PYSRZORKLKOMIT-GUDVDZBRSA-N 2 0 407.558 4.346 20 0 HIADRP COc1cc([C@@H](C)[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)ccc1OCCO ZINC000552252312 941614635 /nfs/dbraw/zinc/61/46/35/941614635.db2.gz IEODQQUZODPVNH-YUVSOPLDSA-N 2 0 412.574 4.160 20 0 HIADRP O=C([C@@H]1CCC[N@H+](Cc2ccccc2)C1)N1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000553124563 941836209 /nfs/dbraw/zinc/83/62/09/941836209.db2.gz ONKGHWRJTVJPMV-XNMGPUDCSA-N 2 0 417.597 4.023 20 0 HIADRP C[NH+](C)C[C@@H](NC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)c1ccc(F)cc1 ZINC000554167186 942054576 /nfs/dbraw/zinc/05/45/76/942054576.db2.gz CSHJRQUIGNLTEY-HSZRJFAPSA-N 2 0 412.553 4.279 20 0 HIADRP COc1cc(CN2C[C@@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C2)ccc1OC(F)F ZINC000554962004 942334768 /nfs/dbraw/zinc/33/47/68/942334768.db2.gz YRACNISAUYBTQF-PMACEKPBSA-N 2 0 402.485 4.251 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCc2sc(Br)cc21 ZINC000556169809 942813600 /nfs/dbraw/zinc/81/36/00/942813600.db2.gz FVQIRPVQUNYBMU-FUHWJXTLSA-N 2 0 421.404 4.244 20 0 HIADRP COc1ccc2c(c1F)CC[C@@H]2[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556230708 942823226 /nfs/dbraw/zinc/82/32/26/942823226.db2.gz AGKPVHGSUWZUQT-OFNKIYASSA-N 2 0 424.560 4.340 20 0 HIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccccc1N(C)C ZINC000556232440 942823739 /nfs/dbraw/zinc/82/37/39/942823739.db2.gz FXOKQZSSMWJFQI-GGAORHGYSA-N 2 0 407.602 4.332 20 0 HIADRP CS(=O)(=O)c1cccc([C@@H]([NH2+]CCCCC[NH+]2CCCC2)c2ccc(F)cc2)c1 ZINC000556233951 942824330 /nfs/dbraw/zinc/82/43/30/942824330.db2.gz UDWBNQCRSBFJMF-QHCPKHFHSA-N 2 0 418.578 4.174 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(Br)c(F)c3)cc2)CC1 ZINC000556409522 942859091 /nfs/dbraw/zinc/85/90/91/942859091.db2.gz WLLDBQBYWFAKJS-UHFFFAOYSA-N 2 0 407.327 4.351 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Cl)c1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556605692 942912300 /nfs/dbraw/zinc/91/23/00/942912300.db2.gz FHKQXXRTCSBQLA-QGZVFWFLSA-N 2 0 415.965 4.320 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000557639341 943244535 /nfs/dbraw/zinc/24/45/35/943244535.db2.gz FLWCHESBFLHELU-AREMUKBSSA-N 2 0 417.553 4.233 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc(C)cc3-c3ccnn3C)CC2)cc1 ZINC000558783343 943662120 /nfs/dbraw/zinc/66/21/20/943662120.db2.gz ZVEDFZKMPMGSBG-UHFFFAOYSA-N 2 0 418.585 4.406 20 0 HIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1OC ZINC000560266025 944212639 /nfs/dbraw/zinc/21/26/39/944212639.db2.gz UOLZIXMJZNEPDP-RTBURBONSA-N 2 0 412.574 4.459 20 0 HIADRP CC[C@H](Cc1ccc(OC)c(OC)c1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000560266688 944212646 /nfs/dbraw/zinc/21/26/46/944212646.db2.gz PBIOCWHKDHVSTH-OAQYLSRUSA-N 2 0 412.574 4.288 20 0 HIADRP O=C(NC1CC[NH+](C2CCCCC2)CC1)[C@H]1C[N@@H+](Cc2ccccc2)CCC1(F)F ZINC000560553481 944252529 /nfs/dbraw/zinc/25/25/29/944252529.db2.gz URTSMXXMUHFEQZ-JOCHJYFZSA-N 2 0 419.560 4.057 20 0 HIADRP CC[C@@H]([NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1)c1cccc(Cl)c1 ZINC000561081253 944434158 /nfs/dbraw/zinc/43/41/58/944434158.db2.gz GDBKVWDHRJLNNP-HSZRJFAPSA-N 2 0 413.993 4.470 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)[C@@H]2C[N@@H+](C(C)(C)C)C[C@H]2C(F)(F)F)cc1 ZINC000561084915 944437583 /nfs/dbraw/zinc/43/75/83/944437583.db2.gz WJEHYEWFKUNTQJ-RTBURBONSA-N 2 0 413.528 4.053 20 0 HIADRP Cc1ccn(-c2ccccc2C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)n1 ZINC000561265296 944533231 /nfs/dbraw/zinc/53/32/31/944533231.db2.gz DQJKJUAYOCZQOB-JOCHJYFZSA-N 2 0 402.542 4.259 20 0 HIADRP COC(=O)[C@H](C)Oc1ccc(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000562213169 945021706 /nfs/dbraw/zinc/02/17/06/945021706.db2.gz DAFAIQPPCLLTHG-NZQKXSOJSA-N 2 0 410.558 4.019 20 0 HIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cn(Cc4ccccc4)nc3-c3cccnc3)C2)CC1 ZINC000564317210 945512561 /nfs/dbraw/zinc/51/25/61/945512561.db2.gz HNOKPHKJZJZBMV-XMMPIXPASA-N 2 0 415.585 4.157 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccccc1-n1ccnn1 ZINC000565413042 945827333 /nfs/dbraw/zinc/82/73/33/945827333.db2.gz LLGRZNMGIZBCCE-LJQANCHMSA-N 2 0 401.514 4.343 20 0 HIADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CCC(=O)Nc3ccc(OCc4ccccc4)cc3)C2)C1 ZINC000565822419 945890753 /nfs/dbraw/zinc/89/07/53/945890753.db2.gz VFTDVRTWFAZQSF-RUZDIDTESA-N 2 0 407.558 4.012 20 0 HIADRP CSc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)cc1F ZINC000566587404 946049317 /nfs/dbraw/zinc/04/93/17/946049317.db2.gz HKIDVBJRIFWYLE-UZLBHIALSA-N 2 0 415.578 4.096 20 0 HIADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)N(Cc1ccncc1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000567056454 946228651 /nfs/dbraw/zinc/22/86/51/946228651.db2.gz DQGMNVZKZSBKPM-XUZZJYLKSA-N 2 0 422.617 4.242 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000568304697 946495781 /nfs/dbraw/zinc/49/57/81/946495781.db2.gz FPVDBYRWIAOEDZ-XUZZJYLKSA-N 3 0 407.602 4.160 20 0 HIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000569158488 946827220 /nfs/dbraw/zinc/82/72/20/946827220.db2.gz MULMCENKEZAAAB-MHZRJXOASA-N 2 0 415.528 4.270 20 0 HIADRP O=C(C[NH2+][C@@H](c1ccccc1)[C@H]1CCCc2ccccc21)NC1CC[NH+](C2CC2)CC1 ZINC000569272625 946847106 /nfs/dbraw/zinc/84/71/06/946847106.db2.gz DCAZHRIPGYEQMO-BDYUSTAISA-N 2 0 417.597 4.180 20 0 HIADRP Cc1ccc(NC(=O)C[C@@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(C)c1 ZINC000570349785 947210269 /nfs/dbraw/zinc/21/02/69/947210269.db2.gz WEYWUXGCZAZCFJ-HXUWFJFHSA-N 2 0 409.574 4.283 20 0 HIADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000570439700 947247992 /nfs/dbraw/zinc/24/79/92/947247992.db2.gz XCGRCCHQRKUJEJ-TZIWHRDSSA-N 2 0 415.603 4.011 20 0 HIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1Cl ZINC000570468254 947254117 /nfs/dbraw/zinc/25/41/17/947254117.db2.gz AMEDKEYNPRWLTG-KRWDZBQOSA-N 2 0 402.970 4.125 20 0 HIADRP C[C@@H]1C[C@H](N(C)C(=O)NC[C@@H](C2CCCCC2)[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000571007172 947429048 /nfs/dbraw/zinc/42/90/48/947429048.db2.gz AIBRIACIAWCREW-HUVFLSCGSA-N 2 0 414.638 4.191 20 0 HIADRP Cc1ccc(C[N@@H+]2C[C@@H]3CC[NH+](Cc4ccccc4)C[C@@H]3C2)c(-c2cnn(C)c2)c1 ZINC000571098253 947494108 /nfs/dbraw/zinc/49/41/08/947494108.db2.gz LDFKYZOCMWPTQW-WIOPSUGQSA-N 2 0 400.570 4.349 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H]2CCC[C@@H](c3ccnn3C)C2)CC1 ZINC000572330913 947886790 /nfs/dbraw/zinc/88/67/90/947886790.db2.gz ICRVIAKTPKZHGX-ZVDOUQERSA-N 2 0 413.585 4.078 20 0 HIADRP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000572908842 948036727 /nfs/dbraw/zinc/03/67/27/948036727.db2.gz WVDMVZBPEMQHDZ-AREMUKBSSA-N 2 0 403.570 4.021 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3cnn(-c4ccc(Cl)cc4)c3)cc2)CC1 ZINC000573272090 948134975 /nfs/dbraw/zinc/13/49/75/948134975.db2.gz MWQJDGPCTUMZDY-UHFFFAOYSA-N 2 0 410.949 4.289 20 0 HIADRP COc1cccc(-c2nn(C(C)(C)C)cc2C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c1 ZINC000573961043 948336531 /nfs/dbraw/zinc/33/65/31/948336531.db2.gz AAYULDKCSMVGKB-OAQYLSRUSA-N 2 0 410.606 4.477 20 0 HIADRP C[C@@H](C[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000576028776 948813512 /nfs/dbraw/zinc/81/35/12/948813512.db2.gz VBKAVFSNDFULPP-INIZCTEOSA-N 2 0 413.528 4.025 20 0 HIADRP Cc1nc(C[NH+]2CCCC23CCN(c2ccc(C[N@@H+](C)C4CC4)cn2)CC3)cs1 ZINC001164691278 719814764 /nfs/dbraw/zinc/81/47/64/719814764.db2.gz CYKBJFQONQYUFZ-UHFFFAOYSA-N 2 0 411.619 4.076 20 0 HIADRP CC[N@@H+]1CCCC[C@@H]1c1ccc(N([C@H]2COC3(C2)CC[NH2+]CC3)C(C)(C)C)nc1 ZINC001164736042 720547707 /nfs/dbraw/zinc/54/77/07/720547707.db2.gz URNXJFRCMHJGKM-NHCUHLMSSA-N 2 0 400.611 4.145 20 0 HIADRP COc1ccc2c(cc[nH+]c2N2CCC3(CC2)C[N@H+](Cc2ccc(C)cc2)CCO3)c1 ZINC001164940552 721923799 /nfs/dbraw/zinc/92/37/99/721923799.db2.gz TVVIXZIYQRJQLH-UHFFFAOYSA-N 2 0 417.553 4.423 20 0 HIADRP COc1ccc([C@@H](CNC(=O)c2ccc(C[NH+]3CCCCC3)cc2)[NH+]2CCCC2)cc1 ZINC000017911884 846276992 /nfs/dbraw/zinc/27/69/92/846276992.db2.gz PIHZCFXNBXOFSV-RUZDIDTESA-N 2 0 421.585 4.248 20 0 HIADRP COc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000030907144 847795760 /nfs/dbraw/zinc/79/57/60/847795760.db2.gz IUPNKRQXPCXNDM-LJQANCHMSA-N 2 0 402.542 4.122 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)C3CC[NH+](Cc4ccccc4)CC3)cc2)C1 ZINC000038831181 848180874 /nfs/dbraw/zinc/18/08/74/848180874.db2.gz BKLUFRFKXVIKSX-JOCHJYFZSA-N 2 0 419.613 4.447 20 0 HIADRP C[C@@H]1C[N@@H+](CCCNC(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)C[C@H](C)O1 ZINC000043391166 848417138 /nfs/dbraw/zinc/41/71/38/848417138.db2.gz HZSOLCTYMWOJFM-BGYRXZFFSA-N 2 0 416.610 4.072 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000045778473 848726709 /nfs/dbraw/zinc/72/67/09/848726709.db2.gz CJMUTIAIDIWHSX-NRFANRHFSA-N 2 0 412.622 4.078 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)N3CCC([NH+]4CCCCC4)CC3)cc2)C1 ZINC000045786425 848727286 /nfs/dbraw/zinc/72/72/86/848727286.db2.gz CRTXWABDRBLRSX-OAQYLSRUSA-N 2 0 412.622 4.078 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NCc1cccc(C[NH+]2CCCC2)c1 ZINC000048216168 849192272 /nfs/dbraw/zinc/19/22/72/849192272.db2.gz YVQZGKCRLNPUQU-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccc(OC)cc2)C1 ZINC000048745152 849261729 /nfs/dbraw/zinc/26/17/29/849261729.db2.gz ZMDIEIJDEGYCTQ-NRFANRHFSA-N 2 0 404.558 4.038 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cc(Cl)c3c(c2)OCCO3)C[C@H](C)O1 ZINC000048816702 849269877 /nfs/dbraw/zinc/26/98/77/849269877.db2.gz CFLUMCQGISLKMW-IRXDYDNUSA-N 2 0 416.949 4.010 20 0 HIADRP Cc1c(O)ccc2c(C[NH2+]Cc3ccccc3C[N@H+]3CCCC[C@@H]3C)cc(=O)oc12 ZINC000056156212 850261796 /nfs/dbraw/zinc/26/17/96/850261796.db2.gz ZGIFKVJMSNWJOU-KRWDZBQOSA-N 2 0 406.526 4.471 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)CC1 ZINC000056846189 850500815 /nfs/dbraw/zinc/50/08/15/850500815.db2.gz GTVNMJOKYNRVJX-NRFANRHFSA-N 2 0 414.638 4.323 20 0 HIADRP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000437037896 862228055 /nfs/dbraw/zinc/22/80/55/862228055.db2.gz JWJCVYHERJWOJG-ZEQRLZLVSA-N 2 0 423.576 4.018 20 0 HIADRP Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2C[NH2+]CCCC[NH+]2CCOCC2)cc1 ZINC000060979264 851265770 /nfs/dbraw/zinc/26/57/70/851265770.db2.gz KGVCDTVEOVAFDN-UHFFFAOYSA-N 2 0 422.548 4.189 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1cccs1 ZINC000061112587 851296320 /nfs/dbraw/zinc/29/63/20/851296320.db2.gz VHWHDKJRTAOJKV-OALUTQOASA-N 2 0 421.010 4.141 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NCC(C)(C)[NH+]1CCc2ccccc2C1 ZINC000061868922 851464438 /nfs/dbraw/zinc/46/44/38/851464438.db2.gz QSASOZFMWFNGMB-UHFFFAOYSA-N 2 0 422.617 4.163 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@@H](c1ccsc1)[NH+](C)C ZINC000061868001 851464656 /nfs/dbraw/zinc/46/46/56/851464656.db2.gz VTPCWOMWMCNEHS-GCJKJVERSA-N 2 0 414.619 4.225 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCc2ccccc2C[N@@H+](C)C(C)C)[NH+]2CCCC2)cc1 ZINC000064237306 851855462 /nfs/dbraw/zinc/85/54/62/851855462.db2.gz DGTDKIPVOORCTP-VWLOTQADSA-N 2 0 422.617 4.472 20 0 HIADRP CCc1ccc([C@@H](CNC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)[NH+](C)C)cc1 ZINC000071913248 852430081 /nfs/dbraw/zinc/43/00/81/852430081.db2.gz MDOHLVQVPSJNLV-RTWAWAEBSA-N 2 0 414.619 4.050 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000097357261 852604614 /nfs/dbraw/zinc/60/46/14/852604614.db2.gz XBITYELJPCHBNU-UHFFFAOYSA-N 2 0 421.507 4.055 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCC1)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000109340111 852955049 /nfs/dbraw/zinc/95/50/49/852955049.db2.gz OAGDRWHXTHVCIH-DEOSSOPVSA-N 2 0 423.576 4.340 20 0 HIADRP O=C(CC[NH+]1CCC(CC[NH+]2CCOCC2)CC1)Nc1ccccc1-c1ccccc1 ZINC000110987877 853181302 /nfs/dbraw/zinc/18/13/02/853181302.db2.gz XWDZVSAWKMINEZ-UHFFFAOYSA-N 2 0 421.585 4.117 20 0 HIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCC(=O)Nc3ccccc3Br)C2)CC1 ZINC000112648246 853236314 /nfs/dbraw/zinc/23/63/14/853236314.db2.gz KBSGXEMSTQAWCQ-GOSISDBHSA-N 2 0 422.411 4.222 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2=Cc3cc(Cl)cc(Cl)c3OC2)[C@@H](C)C1 ZINC000236864949 853930235 /nfs/dbraw/zinc/93/02/35/853930235.db2.gz AOSSXHBZVSXBQU-MGPUTAFESA-N 2 0 413.389 4.496 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+]Cc2cc3ccccc3nc2N2CCCCC2)c1 ZINC000236981814 853946466 /nfs/dbraw/zinc/94/64/66/853946466.db2.gz FVUBAELZPMFEQA-UHFFFAOYSA-N 2 0 418.585 4.455 20 0 HIADRP CCN(CC)c1ncc(C[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)s1 ZINC000236983083 853947214 /nfs/dbraw/zinc/94/72/14/853947214.db2.gz VVSAWGKOQHHIEE-QGZVFWFLSA-N 2 0 419.614 4.121 20 0 HIADRP CCn1nc(C)c(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)c1C ZINC000237049462 853958019 /nfs/dbraw/zinc/95/80/19/853958019.db2.gz ZOMCHMCPZXJLBK-UHFFFAOYSA-N 2 0 417.601 4.132 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+]Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)CC1 ZINC000237171549 853975399 /nfs/dbraw/zinc/97/53/99/853975399.db2.gz WACGPJVGGSKLPB-UHFFFAOYSA-N 2 0 418.029 4.076 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+]Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 ZINC000237501381 854046092 /nfs/dbraw/zinc/04/60/92/854046092.db2.gz WVYZTFLUSVRVBR-KRWDZBQOSA-N 2 0 422.400 4.298 20 0 HIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2csc(COc3ccc(Cl)cc3)n2)C[C@H](C)O1 ZINC000237610599 854061788 /nfs/dbraw/zinc/06/17/88/854061788.db2.gz RMSQHTBEERCLFY-IRXDYDNUSA-N 2 0 424.010 4.355 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+]Cc1cccc(Oc2cccc(C(F)(F)F)c2)c1 ZINC000237665026 854070836 /nfs/dbraw/zinc/07/08/36/854070836.db2.gz ZNNBVHQKKFNHBJ-QGZVFWFLSA-N 2 0 407.480 4.223 20 0 HIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2nc(-c3ccc(Br)cc3)c[nH]2)C1 ZINC000237669224 854072005 /nfs/dbraw/zinc/07/20/05/854072005.db2.gz QKRQPKYYLCKTMY-INIZCTEOSA-N 2 0 405.384 4.441 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cnn(-c3ccc(Cl)cc3)c2)C[C@H](C)O1 ZINC000237779099 854096361 /nfs/dbraw/zinc/09/63/61/854096361.db2.gz DQJZBABNLLZWSZ-OALUTQOASA-N 2 0 424.976 4.425 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3coc(-c4ccccc4)n3)CC2)c1 ZINC000237856793 854109425 /nfs/dbraw/zinc/10/94/25/854109425.db2.gz DURLATDKHNUUDJ-UHFFFAOYSA-N 2 0 404.558 4.342 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccc(-c4ccccc4)cc3)c2)C1 ZINC000237923725 854120078 /nfs/dbraw/zinc/12/00/78/854120078.db2.gz CTUQOTWGINUNGY-AREMUKBSSA-N 2 0 413.565 4.341 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCCCNC(=O)NC1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC000303522678 855010083 /nfs/dbraw/zinc/01/00/83/855010083.db2.gz ZKRZMBQKZINWOK-CJIHJOFQSA-N 2 0 412.622 4.136 20 0 HIADRP CN(c1ccc(NC(=O)c2oc3ccccc3c2C[NH+](C)C)cc1)C1CC[NH+](C)CC1 ZINC000303585181 855058614 /nfs/dbraw/zinc/05/86/14/855058614.db2.gz SGJZGUIUWIIGJI-UHFFFAOYSA-N 2 0 420.557 4.277 20 0 HIADRP C[C@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309712029 855364532 /nfs/dbraw/zinc/36/45/32/855364532.db2.gz JQRLETARHARGBN-BAGYTPMASA-N 2 0 401.595 4.276 20 0 HIADRP Brc1cncc(CN2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000380919764 855429047 /nfs/dbraw/zinc/42/90/47/855429047.db2.gz CJJSAGGWZJFZFK-UHFFFAOYSA-N 2 0 400.364 4.332 20 0 HIADRP C[C@@H]([NH2+]C[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc(Br)cs1 ZINC000390846810 855457372 /nfs/dbraw/zinc/45/73/72/855457372.db2.gz FRLRWUIAYKWQHE-CRAIPNDOSA-N 2 0 409.393 4.452 20 0 HIADRP CC(C)(C)[C@@H](C[N@@H+]1CCc2ccccc2C1)NC(=O)c1ccc(-n2ccnc2)cc1 ZINC000410109797 855824209 /nfs/dbraw/zinc/82/42/09/855824209.db2.gz YVOVBGCYEGDGSO-HSZRJFAPSA-N 2 0 402.542 4.075 20 0 HIADRP CC1CC[NH+](Cc2ccc(CNC(=O)N(CC[NH+](C)C)Cc3ccccc3)cc2)CC1 ZINC000410346461 855940507 /nfs/dbraw/zinc/94/05/07/855940507.db2.gz IDFYHTLQTLBDJK-UHFFFAOYSA-N 2 0 422.617 4.192 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)Nc3cccc(OCC[NH+](C)C)c3)cc2)C1 ZINC000410358555 855948728 /nfs/dbraw/zinc/94/87/28/855948728.db2.gz JOVWDHAEFSMTDY-FQEVSTJZSA-N 2 0 424.589 4.181 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)CC1 ZINC000410362788 855951657 /nfs/dbraw/zinc/95/16/57/855951657.db2.gz VRAGINLQCBWXSO-JOCHJYFZSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)cc2)C1 ZINC000410365847 855953650 /nfs/dbraw/zinc/95/36/50/855953650.db2.gz MKBTWORQCVPBBJ-GOSISDBHSA-N 2 0 400.611 4.027 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)C1 ZINC000410369053 855955966 /nfs/dbraw/zinc/95/59/66/855955966.db2.gz QXNQEGFIZCHAQQ-AVRDEDQJSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)NC[C@H](c3ccsc3)[NH+](C)C)cc2)C1 ZINC000410370096 855956462 /nfs/dbraw/zinc/95/64/62/855956462.db2.gz XFSICNWKCDANDI-XMSQKQJNSA-N 2 0 414.619 4.082 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N(CC[NH+](C)C)Cc1ccccc1 ZINC000410371273 855957258 /nfs/dbraw/zinc/95/72/58/855957258.db2.gz ZPBGBIGAELZJPE-QFIPXVFZSA-N 2 0 422.617 4.334 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NCc2ccccc2C[N@@H+]2CCCC[C@H]2C)CC1 ZINC000410373794 855958793 /nfs/dbraw/zinc/95/87/93/855958793.db2.gz RMRBMQYUCIQHJU-JOCHJYFZSA-N 2 0 414.638 4.372 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NCCCC[NH+]1C[C@H](C)C[C@H](C)C1 ZINC000410382955 855964449 /nfs/dbraw/zinc/96/44/49/855964449.db2.gz MRSLEERQDVJBEX-OYRHEFFESA-N 2 0 402.627 4.084 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)N(CC[NH+](C)C)Cc2ccccc2)C1 ZINC000410391405 855968809 /nfs/dbraw/zinc/96/88/09/855968809.db2.gz HKRMHGQSXKSARD-QFIPXVFZSA-N 2 0 422.617 4.192 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)NC2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000428121450 857080248 /nfs/dbraw/zinc/08/02/48/857080248.db2.gz XJCNQNRNICPSFF-PXDATVDWSA-N 2 0 420.601 4.003 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000428131367 857082979 /nfs/dbraw/zinc/08/29/79/857082979.db2.gz PMFWRCCOIAJZEE-PXDATVDWSA-N 2 0 422.617 4.381 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000428645621 857287943 /nfs/dbraw/zinc/28/79/43/857287943.db2.gz ZNKBAYAWPLPLTA-DHLKQENFSA-N 2 0 419.613 4.316 20 0 HIADRP OC1CC[NH+](Cc2ccc(C[NH2+]Cc3cc(Cl)ccc3OCC3CC3)cc2)CC1 ZINC000430044484 858009828 /nfs/dbraw/zinc/00/98/28/858009828.db2.gz VTGPLYUQFVZNEU-UHFFFAOYSA-N 2 0 414.977 4.375 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)cc1)C1CC1 ZINC000430622277 858239748 /nfs/dbraw/zinc/23/97/48/858239748.db2.gz FGMUXCFPKOIOOX-HYBUGGRVSA-N 2 0 405.586 4.454 20 0 HIADRP C[C@H]1C[C@@H](NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC[N@@H+]1Cc1ccccc1 ZINC000431039339 858413483 /nfs/dbraw/zinc/41/34/83/858413483.db2.gz HVPGMVZKWRAPME-CYFREDJKSA-N 2 0 400.526 4.030 20 0 HIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000431338548 858571798 /nfs/dbraw/zinc/57/17/98/858571798.db2.gz UIDBYHTXFBWNJZ-JOCHJYFZSA-N 2 0 415.622 4.240 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCCOc3cc4c(cc32)CCC4)CC1 ZINC000431352992 858575978 /nfs/dbraw/zinc/57/59/78/858575978.db2.gz UKKYOVQDVHPQCD-VWLOTQADSA-N 2 0 406.570 4.136 20 0 HIADRP O=C(NC1CC[NH+](C2CCCC2)CC1)N1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000431982512 858902033 /nfs/dbraw/zinc/90/20/33/858902033.db2.gz QWWDUHHNLCYVIW-UHFFFAOYSA-N 2 0 424.633 4.091 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC1 ZINC000467548432 881369518 /nfs/dbraw/zinc/36/95/18/881369518.db2.gz ZORTZNHUTADTKS-IBGZPJMESA-N 2 0 400.526 4.203 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)CC1 ZINC000432800594 859367215 /nfs/dbraw/zinc/36/72/15/859367215.db2.gz OLHWUPNHBCVYRW-LOSJGSFVSA-N 2 0 405.586 4.002 20 0 HIADRP C[C@@H]1C[N@H+](CCCNC(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)CCCO1 ZINC000432978017 859459740 /nfs/dbraw/zinc/45/97/40/859459740.db2.gz QAKADOIZEAWXLN-HXUWFJFHSA-N 2 0 416.610 4.074 20 0 HIADRP COc1cc(C[NH+]2CCC[C@@](C)(OC)CC2)cc(C[N@@H+]2CCC[C@](C)(OC)CC2)c1 ZINC000433201032 859564869 /nfs/dbraw/zinc/56/48/69/859564869.db2.gz KIGNACVVSPIUTC-PLQXJYEYSA-N 2 0 418.622 4.477 20 0 HIADRP C[NH+](C)[C@H](CC(=O)NC[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1)c1ccccc1 ZINC000433359485 859660312 /nfs/dbraw/zinc/66/03/12/859660312.db2.gz BYRXRAWPMXZHII-ZEYPLWLESA-N 2 0 417.956 4.281 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](C2c3ccccc3-c3ccccc32)CC1 ZINC000434583563 860412461 /nfs/dbraw/zinc/41/24/61/860412461.db2.gz DWTZGRZGJKXPMY-UHFFFAOYSA-N 2 0 405.586 4.317 20 0 HIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1OC ZINC000467856984 881706176 /nfs/dbraw/zinc/70/61/76/881706176.db2.gz UCHSKQQZWPQGIG-IRXDYDNUSA-N 2 0 401.526 4.007 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H](c2ccc(Br)s2)C2CC2)C1 ZINC000439137633 864571219 /nfs/dbraw/zinc/57/12/19/864571219.db2.gz BAHAHZLAFTWPNW-PXNSSMCTSA-N 2 0 421.404 4.318 20 0 HIADRP CC[NH+](CC)CCN(CCC(F)(F)F)C(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000439456996 864838136 /nfs/dbraw/zinc/83/81/36/864838136.db2.gz AWHZBLUYLKXPGK-UHFFFAOYSA-N 2 0 420.564 4.089 20 0 HIADRP C[N@@H+]1CCN(CCC[NH2+]Cc2cccc(-c3ccncc3)c2)[C@H](c2ccccc2)C1 ZINC000439466172 864842950 /nfs/dbraw/zinc/84/29/50/864842950.db2.gz GWWAIWNWRUHSGJ-SANMLTNESA-N 2 0 400.570 4.217 20 0 HIADRP Cc1ccc(CNC(=O)[C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)cc1 ZINC000439599343 864923129 /nfs/dbraw/zinc/92/31/29/864923129.db2.gz VNVRCZSZIRKBOO-HXUWFJFHSA-N 2 0 405.542 4.015 20 0 HIADRP CC(C)C[C@H](CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000468022840 881857968 /nfs/dbraw/zinc/85/79/68/881857968.db2.gz RWMQLZZOQGYWMC-GMKZXUHWSA-N 2 0 414.638 4.412 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000440529032 865805944 /nfs/dbraw/zinc/80/59/44/865805944.db2.gz GIMNNYGAXTXUBL-RUZDIDTESA-N 2 0 419.613 4.269 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)[C@H](C)C1 ZINC000440688520 865866834 /nfs/dbraw/zinc/86/68/34/865866834.db2.gz AGAJNZKMZCMLRI-KCQQGECQSA-N 2 0 410.602 4.124 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)CC1 ZINC000441223021 866300576 /nfs/dbraw/zinc/30/05/76/866300576.db2.gz XWJJFJCRUBLSNS-OAQYLSRUSA-N 2 0 423.548 4.227 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)CC1 ZINC000441223019 866300717 /nfs/dbraw/zinc/30/07/17/866300717.db2.gz XWJJFJCRUBLSNS-NRFANRHFSA-N 2 0 423.548 4.227 20 0 HIADRP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CC[C@H](C)[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000441273068 866347037 /nfs/dbraw/zinc/34/70/37/866347037.db2.gz WEBHVOOTVIQANF-HRAATJIYSA-N 2 0 411.512 4.077 20 0 HIADRP COc1ccc2cc(CN(C)C(=O)[C@@H](C)N(C)CC[C@H]3CCCC[N@@H+]3C)ccc2c1 ZINC000441327238 866397934 /nfs/dbraw/zinc/39/79/34/866397934.db2.gz GKNOBYARVCANMI-AUSIDOKSSA-N 2 0 411.590 4.002 20 0 HIADRP C[NH+]1CCC(N2CCC([NH2+][C@@H]3CC[C@H](c4ccc(C(F)(F)F)cc4)C3)CC2)CC1 ZINC000442784101 867674368 /nfs/dbraw/zinc/67/43/68/867674368.db2.gz SJPCUJFMEPOYOY-GHTZIAJQSA-N 2 0 409.540 4.490 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)Nc1ccccc1CC[NH+](C)C ZINC000446571720 870483540 /nfs/dbraw/zinc/48/35/40/870483540.db2.gz GTOLOAHZUPHKCS-QFIPXVFZSA-N 2 0 408.590 4.167 20 0 HIADRP C[C@@H]1C[C@H](CCNC(=O)Nc2ccccc2CC[NH+](C)C)C[N@@H+]1Cc1ccccc1 ZINC000446576667 870487639 /nfs/dbraw/zinc/48/76/39/870487639.db2.gz HNGGQRXWDUQICR-IRLDBZIGSA-N 2 0 408.590 4.213 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)Nc2ccccc2CC[NH+](C)C)CC1)CC(C)C ZINC000446580989 870490748 /nfs/dbraw/zinc/49/07/48/870490748.db2.gz PVLWPXNOWYWIHF-UHFFFAOYSA-N 2 0 402.627 4.403 20 0 HIADRP COc1ccccc1[C@@H](CNC(=O)Nc1ccccc1CC[NH+](C)C)[NH+]1CCCCC1 ZINC000446589547 870497930 /nfs/dbraw/zinc/49/79/30/870497930.db2.gz KXZIRVSTYWKXPB-HSZRJFAPSA-N 2 0 424.589 4.148 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NCc1ccccc1C[NH+]1CCCCCC1 ZINC000446591183 870499451 /nfs/dbraw/zinc/49/94/51/870499451.db2.gz RARBVUMQFXMELL-UHFFFAOYSA-N 2 0 408.590 4.488 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)Nc2ccccc2CC[NH+](C)C)c2cccs2)CC1 ZINC000446595588 870502823 /nfs/dbraw/zinc/50/28/23/870502823.db2.gz WJBMMELWDOQLPG-OAQYLSRUSA-N 2 0 414.619 4.447 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000446756276 870668777 /nfs/dbraw/zinc/66/87/77/870668777.db2.gz GKHDNOGEHIKTKU-KUHUBIRLSA-N 2 0 414.819 4.169 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(Br)cc1F ZINC000446881175 870802463 /nfs/dbraw/zinc/80/24/63/870802463.db2.gz NRHMNEBIMGAIMG-KSSFIOAISA-N 2 0 407.327 4.006 20 0 HIADRP COC(=O)[C@](C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccc(F)cc1 ZINC000447089642 870983606 /nfs/dbraw/zinc/98/36/06/870983606.db2.gz JHLVQQSVUFBBFX-KYLYQBOTSA-N 2 0 410.533 4.042 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000447554841 871436100 /nfs/dbraw/zinc/43/61/00/871436100.db2.gz ZOZVVMGMECPVGN-IBGZPJMESA-N 2 0 404.558 4.438 20 0 HIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)c2ccccc21 ZINC000447584904 871490942 /nfs/dbraw/zinc/49/09/42/871490942.db2.gz HJQRLUYACKZKNI-DQEYMECFSA-N 2 0 405.586 4.486 20 0 HIADRP C[NH+](C)CCOCC[NH2+][C@@H](c1ccc(Br)cc1C(F)(F)F)C1CC1 ZINC000447596755 871505019 /nfs/dbraw/zinc/50/50/19/871505019.db2.gz DDQZPCPFLAVBTH-MRXNPFEDSA-N 2 0 409.290 4.087 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000448211746 872113896 /nfs/dbraw/zinc/11/38/96/872113896.db2.gz FAAADLDHVQNQHR-JHMXWDHMSA-N 2 0 424.633 4.219 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000448211748 872114297 /nfs/dbraw/zinc/11/42/97/872114297.db2.gz FAAADLDHVQNQHR-QFZRFWILSA-N 2 0 424.633 4.219 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000448218839 872124453 /nfs/dbraw/zinc/12/44/53/872124453.db2.gz WLLJSNMDIDLTCS-JHMXWDHMSA-N 2 0 424.633 4.219 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000448218841 872124698 /nfs/dbraw/zinc/12/46/98/872124698.db2.gz WLLJSNMDIDLTCS-QFZRFWILSA-N 2 0 424.633 4.219 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCCCC2)cc1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000448409305 872365157 /nfs/dbraw/zinc/36/51/57/872365157.db2.gz FECUIFLFWAVQLX-ZJSXRUAMSA-N 2 0 410.606 4.196 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N2C[C@@H]3CC[N@H+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC000461435848 874487400 /nfs/dbraw/zinc/48/74/00/874487400.db2.gz KQJPHJKKSSLNJL-LOSJGSFVSA-N 2 0 405.586 4.123 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+]C1CCN(Cc2ccccc2Cl)CC1 ZINC000463115022 876154939 /nfs/dbraw/zinc/15/49/39/876154939.db2.gz VXEVTZAHFGTPNW-UHFFFAOYSA-N 2 0 401.982 4.035 20 0 HIADRP COc1ccc([C@H](CN[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[NH+]2CCCC2)cc1 ZINC000463141813 876193335 /nfs/dbraw/zinc/19/33/35/876193335.db2.gz ZZYKNXURAATERF-QQSVUBKYSA-N 2 0 407.602 4.475 20 0 HIADRP O=C(CCc1ccccc1)N1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000463242078 876298323 /nfs/dbraw/zinc/29/83/23/876298323.db2.gz JYKXNIRXTXWNSX-QYIJMHBESA-N 2 0 417.597 4.005 20 0 HIADRP CCC[NH+]1CCC(C[NH2+]Cc2cc(Br)cc(Br)c2N)CC1 ZINC000463287401 876346367 /nfs/dbraw/zinc/34/63/67/876346367.db2.gz YJBWXQCWCPVEME-UHFFFAOYSA-N 2 0 419.205 4.005 20 0 HIADRP C[C@H]1CC[N@H+](CCOc2ccc(NC(=O)C3CC[NH+](Cc4ccccc4)CC3)cc2)C1 ZINC000465183432 878573878 /nfs/dbraw/zinc/57/38/78/878573878.db2.gz JUSGKZUXDRISTA-NRFANRHFSA-N 2 0 421.585 4.258 20 0 HIADRP CCc1ccc([C@H](CNC(=O)N(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)[NH+](C)C)cc1 ZINC000465427301 878858169 /nfs/dbraw/zinc/85/81/69/878858169.db2.gz DXJDCVQTQUTCQJ-NOZRDPDXSA-N 2 0 422.617 4.015 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2C[NH+]2C[C@H](C)C[C@H](C)C2)C1 ZINC000465537023 878996075 /nfs/dbraw/zinc/99/60/75/878996075.db2.gz GERXVVMGIQRAPW-BDTNDASRSA-N 2 0 414.638 4.038 20 0 HIADRP CC(C)[N@@H+]1[C@@H]2CC[C@H]1CN(C(=O)NCc1ccccc1C[NH+]1CCC[C@@H](C)C1)CC2 ZINC000465552859 879018527 /nfs/dbraw/zinc/01/85/27/879018527.db2.gz BMQJCBNGGAJCDH-HUVFLSCGSA-N 2 0 412.622 4.075 20 0 HIADRP CCC(CC)[C@H](CNC(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[NH+]1CCCC1 ZINC000465564736 879036764 /nfs/dbraw/zinc/03/67/64/879036764.db2.gz IGOYKFOIESXZFQ-URVUXULASA-N 2 0 420.667 4.331 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)C1 ZINC000465606020 879098194 /nfs/dbraw/zinc/09/81/94/879098194.db2.gz QMFDQFMVHDMQJG-DNVJHFABSA-N 2 0 414.638 4.051 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCC[NH+]1CCC[C@H](C)C1 ZINC000465612040 879109181 /nfs/dbraw/zinc/10/91/81/879109181.db2.gz YEHMAGCTGLRQJQ-LADGPHEKSA-N 2 0 414.638 4.052 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N1CC[C@@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000465615253 879115093 /nfs/dbraw/zinc/11/50/93/879115093.db2.gz IKEBBLMQJCLSKJ-JOCHJYFZSA-N 2 0 422.617 4.334 20 0 HIADRP C[NH+](C)C1(CNC(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CCCCCC1 ZINC000465622994 879129728 /nfs/dbraw/zinc/12/97/28/879129728.db2.gz CGXHJVRVHTYFPL-QUCCMNQESA-N 2 0 406.640 4.085 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N1CCC[C@H](C[NH+]2CCC(C)CC2)C1)c1ccsc1 ZINC000503446326 912468339 /nfs/dbraw/zinc/46/83/39/912468339.db2.gz KONPSKBPWLTRCG-IFMALSPDSA-N 2 0 420.667 4.285 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)CCCC1)c1ccccc1 ZINC000465911890 879573720 /nfs/dbraw/zinc/57/37/20/879573720.db2.gz SBTAIYFDFHPHRF-UNMCSNQZSA-N 2 0 400.611 4.166 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCC2)cc1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000503475006 912513673 /nfs/dbraw/zinc/51/36/73/912513673.db2.gz YOTYLSGKJFSRHV-DEOSSOPVSA-N 2 0 412.622 4.080 20 0 HIADRP CC1CC[NH+](C[C@@H]2CCCN(C(=O)NC[C@H](c3cccs3)[NH+]3CCCC3)C2)CC1 ZINC000503505336 912553115 /nfs/dbraw/zinc/55/31/15/912553115.db2.gz SYZUEZLHJTVSAE-LEWJYISDSA-N 2 0 418.651 4.039 20 0 HIADRP CC[NH+](CC)CCOC1CC[NH+](CCC(=O)Nc2c(Cl)cccc2Cl)CC1 ZINC000467166975 880896891 /nfs/dbraw/zinc/89/68/91/880896891.db2.gz YTPUCCLBYGMKGL-UHFFFAOYSA-N 2 0 416.393 4.145 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)CC1 ZINC000467349620 881105560 /nfs/dbraw/zinc/10/55/60/881105560.db2.gz XXHUEHSTGBLXLP-GPQLQYNLSA-N 2 0 403.586 4.214 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)CCS2 ZINC000467422237 881211470 /nfs/dbraw/zinc/21/14/70/881211470.db2.gz ZJOVUSCPFSVAAN-IIBYNOLFSA-N 2 0 415.578 4.474 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCSCC2)cc1)c1ccc(Nc2cc[nH+]cc2)cc1 ZINC000469123965 883218230 /nfs/dbraw/zinc/21/82/30/883218230.db2.gz XHRRAWUFCWJHJV-UHFFFAOYSA-N 2 0 418.566 4.091 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(NC(=O)CCCOc3ccccc3)cc2)[C@H](C)C1 ZINC000469232664 883331671 /nfs/dbraw/zinc/33/16/71/883331671.db2.gz UMPYULNFPRVXAS-YKSBVNFPSA-N 2 0 409.574 4.304 20 0 HIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000469315789 883417559 /nfs/dbraw/zinc/41/75/59/883417559.db2.gz OMZXKZXBEQRDKR-HSZRJFAPSA-N 2 0 415.528 4.087 20 0 HIADRP C[NH+](C)CCN(Cc1ccccn1)C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000503666306 912773484 /nfs/dbraw/zinc/77/34/84/912773484.db2.gz IKIZDPMDHRBKJT-UHFFFAOYSA-N 2 0 423.605 4.442 20 0 HIADRP CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1CCOCC[NH+]1CC[C@H](C(F)(F)F)C1(C)C ZINC000469992640 884209322 /nfs/dbraw/zinc/20/93/22/884209322.db2.gz SKTKANGMYOWJEY-OKILXGFUSA-N 2 0 404.439 4.329 20 0 HIADRP C[C@H]1CC[N@H+](CCOc2ccc(NC(=O)c3ccc(Nc4cc[nH+]cc4)cc3)cc2)C1 ZINC000470082631 884341381 /nfs/dbraw/zinc/34/13/81/884341381.db2.gz RJBDUJQWFVJBCE-IBGZPJMESA-N 2 0 416.525 4.220 20 0 HIADRP C[C@H]1CC[N@H+](CCOc2ccc(NC(=O)c3oc4ccccc4c3C[NH+](C)C)cc2)C1 ZINC000470126351 884387841 /nfs/dbraw/zinc/38/78/41/884387841.db2.gz ZJLKVGQHWDLLAR-SFHVURJKSA-N 2 0 421.541 4.467 20 0 HIADRP CCC[N@H+](C)C[C@H]1CCN(C(=O)[C@@H](c2cccc(C(F)(F)F)c2)[NH+](CC)CC)C1 ZINC000470540758 884944635 /nfs/dbraw/zinc/94/46/35/884944635.db2.gz YOYKGMHILVEVIN-YLJYHZDGSA-N 2 0 413.528 4.279 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000470746457 885211086 /nfs/dbraw/zinc/21/10/86/885211086.db2.gz TVMJXDUOYYMEMS-RUZDIDTESA-N 2 0 422.617 4.334 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC1CC[NH+](CC(C)C)CC1)c1ccccc1Cl ZINC000504031974 912934275 /nfs/dbraw/zinc/93/42/75/912934275.db2.gz BAPUNNRSBCDMHP-NRFANRHFSA-N 2 0 409.018 4.143 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC1CC[NH+](CC(C)C)CC1)c1ccccc1Cl ZINC000504031975 912934769 /nfs/dbraw/zinc/93/47/69/912934769.db2.gz BAPUNNRSBCDMHP-OAQYLSRUSA-N 2 0 409.018 4.143 20 0 HIADRP O=C(NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)Nc1ccc(CC[NH+]2CCCCC2)cc1 ZINC000471247142 885824578 /nfs/dbraw/zinc/82/45/78/885824578.db2.gz YLFYLOWGOKRING-DEOSSOPVSA-N 2 0 420.601 4.359 20 0 HIADRP CCN(C(=O)NC[C@H](c1cccs1)[NH+](C)C)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000471374865 886015823 /nfs/dbraw/zinc/01/58/23/886015823.db2.gz UDZDNRFNOMXPFA-CEWLAPEOSA-N 2 0 414.619 4.218 20 0 HIADRP C[C@H](CCCCN1C(=O)c2ccccc2C1=O)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000471583146 886295448 /nfs/dbraw/zinc/29/54/48/886295448.db2.gz VBZOVDOZKWNOSI-LJQANCHMSA-N 2 0 411.590 4.228 20 0 HIADRP C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000471601257 886314985 /nfs/dbraw/zinc/31/49/85/886314985.db2.gz HQNCMGVPRGMBAS-ZIAGYGMSSA-N 2 0 411.434 4.401 20 0 HIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000471895064 886676842 /nfs/dbraw/zinc/67/68/42/886676842.db2.gz ILNROOHBLFUJNM-JTHBVZDNSA-N 2 0 420.601 4.033 20 0 HIADRP CCN(CCC[NH+]1CCCC1)C(=O)NCc1ccccc1C[NH+]1CCCCCC1 ZINC000472062891 886871396 /nfs/dbraw/zinc/87/13/96/886871396.db2.gz MFFQLSNZOLRXBE-UHFFFAOYSA-N 2 0 400.611 4.080 20 0 HIADRP CCN(CCC[NH+]1CCCC1)C(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000472101188 886892874 /nfs/dbraw/zinc/89/28/74/886892874.db2.gz BLRUBNURYRMSPI-UHFFFAOYSA-N 2 0 400.611 4.080 20 0 HIADRP COc1ccsc1[C@@H](C)[NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1 ZINC000472151801 886949020 /nfs/dbraw/zinc/94/90/20/886949020.db2.gz GNFUHSFBCLYDPW-QGZVFWFLSA-N 2 0 404.576 4.097 20 0 HIADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CCC(=O)Nc2ccc(Oc3ccccc3)cc2)C1 ZINC000472490006 887357475 /nfs/dbraw/zinc/35/74/75/887357475.db2.gz YLQPLBGKOZIYLV-OAQYLSRUSA-N 2 0 407.558 4.471 20 0 HIADRP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000473506582 888234464 /nfs/dbraw/zinc/23/44/64/888234464.db2.gz IQHYMMQQLWSPDT-MHZLTWQESA-N 2 0 417.597 4.411 20 0 HIADRP CC[NH+](CC)CCOc1ccc(NC(=O)NC2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000473626515 888366443 /nfs/dbraw/zinc/36/64/43/888366443.db2.gz QBLWXQXVHNXCQL-UHFFFAOYSA-N 2 0 416.610 4.326 20 0 HIADRP CCN(C(=O)Nc1cccc(OCC[NH+](C)C)c1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473748827 888534162 /nfs/dbraw/zinc/53/41/62/888534162.db2.gz UGIXIZHBZNFWNY-OFNKIYASSA-N 2 0 424.589 4.316 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N(C)CC[NH+](C)C2CC2)cc1)C[C@@H]1CCCCO1 ZINC000473771219 888570249 /nfs/dbraw/zinc/57/02/49/888570249.db2.gz BWPOHFKITSPPPO-QHCPKHFHSA-N 2 0 416.610 4.024 20 0 HIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000474061742 888895133 /nfs/dbraw/zinc/89/51/33/888895133.db2.gz DJBMNJORCKHELL-DEOSSOPVSA-N 2 0 421.585 4.033 20 0 HIADRP CC[N@@H+](Cc1ccc(Cl)cc1-n1cncn1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000474276323 889139551 /nfs/dbraw/zinc/13/95/51/889139551.db2.gz QLQDDFVGHYUGBW-FQEVSTJZSA-N 2 0 409.965 4.265 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)N(C)C2CC[NH+](CCc3ccccn3)CC2)cc1 ZINC000504545653 913322853 /nfs/dbraw/zinc/32/28/53/913322853.db2.gz JVFBPOKZOGGBMT-UHFFFAOYSA-N 2 0 422.617 4.093 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCN(c3ccc(Cl)cc3Cl)C2)[C@@H](C)C1 ZINC000474425403 889289029 /nfs/dbraw/zinc/28/90/29/889289029.db2.gz JDLYMSQBXOCNBU-QRFRQXIXSA-N 2 0 414.421 4.299 20 0 HIADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)CCc2ccc(I)cc2)CC1 ZINC000474467573 889330186 /nfs/dbraw/zinc/33/01/86/889330186.db2.gz BYAPQYRWXFZREO-HNNXBMFYSA-N 2 0 400.348 4.075 20 0 HIADRP CC(C)C[C@H](CNC(=O)NC1CC([NH+]2CCCCC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000474522938 889392405 /nfs/dbraw/zinc/39/24/05/889392405.db2.gz NFVCEEQWDUBKQZ-JYUKWDKTSA-N 2 0 400.611 4.068 20 0 HIADRP CC(C)C[C@H](CNC(=O)NC1CC([NH+]2CCCCC2)C1)[NH2+][C@@H](C)c1ccccc1 ZINC000474522936 889392908 /nfs/dbraw/zinc/39/29/08/889392908.db2.gz NFVCEEQWDUBKQZ-IDJJCAIYSA-N 2 0 400.611 4.068 20 0 HIADRP COc1cc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1OCC(F)(F)F ZINC000475275219 890172132 /nfs/dbraw/zinc/17/21/32/890172132.db2.gz ALMRLFDGLNJCRK-LJQANCHMSA-N 2 0 408.464 4.248 20 0 HIADRP O=C(NC[C@H]1CCC[N@H+](Cc2cccs2)C1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000475318393 890235843 /nfs/dbraw/zinc/23/58/43/890235843.db2.gz IPSSUGDBCMEZKJ-LJQANCHMSA-N 2 0 418.651 4.056 20 0 HIADRP Cc1ccccc1[C@@H]([C@@H](C)NC(=O)NCc1ccccc1C[NH+]1CCCC1)[NH+](C)C ZINC000476908240 891860578 /nfs/dbraw/zinc/86/05/78/891860578.db2.gz UNLLZTUYHZQXIQ-HYBUGGRVSA-N 2 0 408.590 4.081 20 0 HIADRP O=C(Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000477729118 892829489 /nfs/dbraw/zinc/82/94/89/892829489.db2.gz DWBGVYIXRMHCLN-UHFFFAOYSA-N 2 0 421.585 4.129 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)[C@H]3CCC[N@H+](Cc4cccc(F)c4)C3)CC2)CC1 ZINC000505134488 913836168 /nfs/dbraw/zinc/83/61/68/913836168.db2.gz NRCNSPSRCPPCMV-KHRZNOOSSA-N 2 0 415.597 4.197 20 0 HIADRP c1c2c(nn1-c1ccccc1)CCC[C@H]2[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000479064565 894327142 /nfs/dbraw/zinc/32/71/42/894327142.db2.gz RXWNXOJDLJVUQX-RCZVLFRGSA-N 2 0 400.570 4.404 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H]2CC(C)(C)c3ccc(Br)cc32)CC1 ZINC000479072169 894335721 /nfs/dbraw/zinc/33/57/21/894335721.db2.gz UTYLRGDSXVYVPH-OXJNMPFZSA-N 2 0 408.428 4.035 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](c2ccc(Br)cc2F)C2CC2)CC1 ZINC000479333642 894627571 /nfs/dbraw/zinc/62/75/71/894627571.db2.gz WSRAQKHDMOPTFR-HXUWFJFHSA-N 2 0 412.391 4.047 20 0 HIADRP CC1(C)C[C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)c2cc(Br)ccc21 ZINC000479407731 894715370 /nfs/dbraw/zinc/71/53/70/894715370.db2.gz BSDRPKFARAXZRB-XUVXKRRUSA-N 2 0 407.396 4.139 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)CC1 ZINC000479433863 894748525 /nfs/dbraw/zinc/74/85/25/894748525.db2.gz CCFCHFGQOZFLDO-QFIPXVFZSA-N 2 0 406.659 4.185 20 0 HIADRP COc1ccc(-c2ccncc2)cc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000479446684 894763390 /nfs/dbraw/zinc/76/33/90/894763390.db2.gz OCYFXPRVYZHBCC-RUZDIDTESA-N 2 0 417.553 4.004 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@@H](c2ccsc2)[NH+](C)C)CC1 ZINC000479447780 894764518 /nfs/dbraw/zinc/76/45/18/894764518.db2.gz CQISFPHMUMEJRV-RXVVDRJESA-N 2 0 406.640 4.037 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cccc(N2CCCC2=O)c1 ZINC000480225432 895629431 /nfs/dbraw/zinc/62/94/31/895629431.db2.gz KMHXIVIXGVPQMC-QHAWAJNXSA-N 2 0 421.585 4.273 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc1)CCCO2 ZINC000480241885 895650643 /nfs/dbraw/zinc/65/06/43/895650643.db2.gz QQJCKUBKMOBFOG-GLDPYIMESA-N 2 0 410.558 4.308 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)[C@@H](C)C1 ZINC000480264572 895672251 /nfs/dbraw/zinc/67/22/51/895672251.db2.gz VYOQRNKDZWEXQJ-WIOPSUGQSA-N 3 0 401.639 4.145 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+]Cc1cc(Br)c(Cl)s1 ZINC000480335279 895738901 /nfs/dbraw/zinc/73/89/01/895738901.db2.gz MNMBQOAMFPEFAF-UHFFFAOYSA-N 2 0 403.773 4.394 20 0 HIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@H](C(C)C)N1CC[NH+](C)CC1 ZINC000480536631 895898925 /nfs/dbraw/zinc/89/89/25/895898925.db2.gz CWPUJFMQHAPMDS-GHTZIAJQSA-N 2 0 400.636 4.350 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000480599258 895960739 /nfs/dbraw/zinc/96/07/39/895960739.db2.gz DCKMBEJKVYEQLU-ROUUACIJSA-N 2 0 418.578 4.312 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 ZINC000480604032 895967910 /nfs/dbraw/zinc/96/79/10/895967910.db2.gz FKEWZLSGRHGRFY-CVEARBPZSA-N 2 0 407.027 4.449 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000480612356 895978560 /nfs/dbraw/zinc/97/85/60/895978560.db2.gz LQCYVTJIFXSIQP-TVZXLZGTSA-N 2 0 406.618 4.456 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480614666 895980203 /nfs/dbraw/zinc/98/02/03/895980203.db2.gz VMRVLBJSESFOHQ-RTBURBONSA-N 2 0 415.603 4.141 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480614662 895980592 /nfs/dbraw/zinc/98/05/92/895980592.db2.gz VMRVLBJSESFOHQ-OALUTQOASA-N 2 0 415.603 4.141 20 0 HIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H](c1ccccc1)N1CCOCC1 ZINC000480621167 895987504 /nfs/dbraw/zinc/98/75/04/895987504.db2.gz JBTRAVZFQVJIMC-GLOSAHNISA-N 2 0 419.613 4.234 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000480619852 895987571 /nfs/dbraw/zinc/98/75/71/895987571.db2.gz QPZLURIDUWIWKG-RTBURBONSA-N 2 0 415.603 4.141 20 0 HIADRP C[C@H](Nc1cccc2c1CC[N@H+](CC(C)(C)O)C2)[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000480671432 896034834 /nfs/dbraw/zinc/03/48/34/896034834.db2.gz MSZZPWYFVAPQLK-UNMCSNQZSA-N 2 0 407.602 4.138 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000480691851 896054288 /nfs/dbraw/zinc/05/42/88/896054288.db2.gz GPPWMZGXPDBSHK-GOSISDBHSA-N 2 0 403.517 4.276 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000480693320 896056049 /nfs/dbraw/zinc/05/60/49/896056049.db2.gz BJBOUHQZZDKCEC-MSOLQXFVSA-N 2 0 410.562 4.323 20 0 HIADRP Cc1cc(C[NH+]2CCSCC2)ccc1NC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000480710811 896072013 /nfs/dbraw/zinc/07/20/13/896072013.db2.gz WKYWECPMXNQZLR-HXUWFJFHSA-N 2 0 401.620 4.137 20 0 HIADRP C[C@@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(SCC(F)F)cc1 ZINC000480713135 896074884 /nfs/dbraw/zinc/07/48/84/896074884.db2.gz VHRPHTRBHVCYDG-MRXNPFEDSA-N 2 0 406.546 4.041 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CC4(CCC4)Oc4ccccc43)cc2)CC1 ZINC000480725148 896084393 /nfs/dbraw/zinc/08/43/93/896084393.db2.gz XQDTWQQKOJIAJK-DEOSSOPVSA-N 2 0 405.586 4.360 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cccc(Br)c1 ZINC000480732005 896092381 /nfs/dbraw/zinc/09/23/81/896092381.db2.gz RIRJWKHBVBQJDW-HXUWFJFHSA-N 2 0 417.395 4.227 20 0 HIADRP C[C@H]([NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1)c1ccc(Oc2ccccc2)cc1 ZINC000480734488 896095931 /nfs/dbraw/zinc/09/59/31/896095931.db2.gz IRDSLXDHBDDMHD-FQEVSTJZSA-N 2 0 402.542 4.477 20 0 HIADRP C[C@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000480749889 896111189 /nfs/dbraw/zinc/11/11/89/896111189.db2.gz QJOWJSLZZYWBCG-HZPDHXFCSA-N 2 0 403.364 4.444 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](c2cccc(Cl)c2)N2CCCC2)[C@H](C)C1 ZINC000480762775 896124766 /nfs/dbraw/zinc/12/47/66/896124766.db2.gz LFVGIRLUHBDFHF-OIBXWCBGSA-N 2 0 408.030 4.204 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]Cc1cccc(NC(=O)C2CCCC2)c1 ZINC000480886093 896242428 /nfs/dbraw/zinc/24/24/28/896242428.db2.gz XHBFMQULRZQXFV-NTKDMRAZSA-N 2 0 406.574 4.211 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3cccc(Cl)c3)CCOCC2)[C@H](C)C1 ZINC000481053912 896376769 /nfs/dbraw/zinc/37/67/69/896376769.db2.gz QMZISANPASQLTL-DENIHFKCSA-N 2 0 409.014 4.115 20 0 HIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]C1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000481301395 896645434 /nfs/dbraw/zinc/64/54/34/896645434.db2.gz YYTJNXBHPWJFFZ-CLOONOSVSA-N 2 0 413.556 4.429 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1Br ZINC000481305724 896652708 /nfs/dbraw/zinc/65/27/08/896652708.db2.gz LEADWIHWINVLPU-OAHLLOKOSA-N 2 0 407.352 4.249 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H](O)COc1cccc(Cl)c1Cl ZINC000481532489 896893384 /nfs/dbraw/zinc/89/33/84/896893384.db2.gz JQQCKNUWQMQAMI-POAQFYNOSA-N 2 0 423.384 4.233 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)nnn1-c1ccc(F)cc1 ZINC000481727017 897121864 /nfs/dbraw/zinc/12/18/64/897121864.db2.gz SVCVWOGFWPARGV-MRXNPFEDSA-N 2 0 413.566 4.339 20 0 HIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCc2c1cc(Br)cc2F ZINC000481731063 897125684 /nfs/dbraw/zinc/12/56/84/897125684.db2.gz PTHRRHWKYZDOGE-IBGZPJMESA-N 2 0 407.327 4.306 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc4c(c3)C(C)(C)C(=O)N4)CC2)cc1 ZINC000481732638 897127408 /nfs/dbraw/zinc/12/74/08/897127408.db2.gz FTKFUYIKVDWQLI-SFHVURJKSA-N 2 0 421.585 4.488 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CC[N@H+](Cc4ccccc4)C[C@H]3C)CC2)cc1 ZINC000481734971 897129428 /nfs/dbraw/zinc/12/94/28/897129428.db2.gz LLEQIOZYJFUORX-AJTFRIOCSA-N 3 0 421.629 4.407 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000481742260 897136710 /nfs/dbraw/zinc/13/67/10/897136710.db2.gz VRBATKGYTOHEHG-LJQANCHMSA-N 2 0 415.603 4.285 20 0 HIADRP C[NH+](C)[C@@]1(CNC(=O)Nc2ccccc2C[N@@H+](C)C2CCCCC2)CCSC1 ZINC000481790997 897171055 /nfs/dbraw/zinc/17/10/55/897171055.db2.gz VBUHGKGQTMQCNN-JOCHJYFZSA-N 2 0 404.624 4.010 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(NC(=O)c2ccncc2)cc1 ZINC000482111368 897561936 /nfs/dbraw/zinc/56/19/36/897561936.db2.gz BGKOEIUGJLRWAU-NLFFAJNJSA-N 2 0 414.553 4.334 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CCCN(Cc2cccs2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000482122407 897575794 /nfs/dbraw/zinc/57/57/94/897575794.db2.gz NAJCKMKXDHVODB-VQTJNVASSA-N 2 0 401.620 4.251 20 0 HIADRP C[C@@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1cccc(-c2ccncc2)c1 ZINC000482123418 897579443 /nfs/dbraw/zinc/57/94/43/897579443.db2.gz GSVUBHBHPLYFDJ-OAQYLSRUSA-N 2 0 401.558 4.007 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)cc1F ZINC000482257495 897739875 /nfs/dbraw/zinc/73/98/75/897739875.db2.gz DAQVOPZDEPPKOD-GOSISDBHSA-N 2 0 416.537 4.175 20 0 HIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C3CCOCC3)c1)CCC2 ZINC000482265980 897751114 /nfs/dbraw/zinc/75/11/14/897751114.db2.gz WSNQQKQVXCDERD-SANMLTNESA-N 2 0 424.585 4.352 20 0 HIADRP CN(C)CC[NH+]1CCC(C[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000482355173 897870572 /nfs/dbraw/zinc/87/05/72/897870572.db2.gz FCDSUSYLCNJZKS-FQEVSTJZSA-N 2 0 416.610 4.190 20 0 HIADRP c1cnc(N2CC[NH+](CCCC[NH2+][C@H]3CCCc4c5ccccc5sc43)CC2)nc1 ZINC000482450867 898015679 /nfs/dbraw/zinc/01/56/79/898015679.db2.gz JDSVBDHGKZSCQA-NRFANRHFSA-N 2 0 421.614 4.261 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000482476980 898054656 /nfs/dbraw/zinc/05/46/56/898054656.db2.gz JDRPFVOFWMGRQV-JOCHJYFZSA-N 2 0 405.542 4.135 20 0 HIADRP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1ccc(-c2ccccc2Cl)s1 ZINC000482547655 898136608 /nfs/dbraw/zinc/13/66/08/898136608.db2.gz CMJSPWATHZERFB-HOTGVXAUSA-N 2 0 405.995 4.307 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CCc1ccc(OCC[NH+](C)C)cc1 ZINC000482548066 898138691 /nfs/dbraw/zinc/13/86/91/898138691.db2.gz LXUHKVJGXAWNEB-QGZVFWFLSA-N 2 0 410.587 4.347 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000482548334 898138761 /nfs/dbraw/zinc/13/87/61/898138761.db2.gz ASGPBPAZFSTEOG-LJQANCHMSA-N 2 0 415.603 4.141 20 0 HIADRP C[C@H](C[NH2+][C@@H](CCSc1ccc(F)cc1)c1ccc(F)cc1)N1CC[NH+](C)CC1 ZINC000482569724 898163509 /nfs/dbraw/zinc/16/35/09/898163509.db2.gz PVHJBPPTTDWGEK-JPYJTQIMSA-N 2 0 419.585 4.414 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccc(-n2cncn2)cc1 ZINC000482634112 898236997 /nfs/dbraw/zinc/23/69/97/898236997.db2.gz UBMUPZREDKGWEA-GOSISDBHSA-N 2 0 409.965 4.484 20 0 HIADRP CCC[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(OC)cc1 ZINC000482642481 898247362 /nfs/dbraw/zinc/24/73/62/898247362.db2.gz MQYGVJGRBGYKAM-ISKFKSNPSA-N 2 0 409.574 4.024 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(F)c(Br)c2)[C@@H](C)C1 ZINC000483123137 898810073 /nfs/dbraw/zinc/81/00/73/898810073.db2.gz DJARNAQPDZFGSF-KHYOSLBOSA-N 2 0 401.364 4.376 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000483207051 898859825 /nfs/dbraw/zinc/85/98/25/898859825.db2.gz VDBJRAXHPIBIDJ-HOTGVXAUSA-N 2 0 402.526 4.493 20 0 HIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000483219672 898865183 /nfs/dbraw/zinc/86/51/83/898865183.db2.gz UNQQEXPIGUJOSM-XHSDSOJGSA-N 2 0 401.378 4.240 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+]([C@H](C)c2cccc(Br)c2)CC1 ZINC000483408066 899038310 /nfs/dbraw/zinc/03/83/10/899038310.db2.gz NSURBUZMFINCEX-QGZVFWFLSA-N 2 0 424.427 4.070 20 0 HIADRP C[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1cc(Br)ccc1F ZINC000483516403 899177078 /nfs/dbraw/zinc/17/70/78/899177078.db2.gz GXPXDWDWSURXRD-INIZCTEOSA-N 2 0 412.391 4.189 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccc(-n2cncn2)cc1 ZINC000483725304 899384856 /nfs/dbraw/zinc/38/48/56/899384856.db2.gz LFUWMSOCUMWELV-LJQANCHMSA-N 2 0 401.514 4.343 20 0 HIADRP C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)c1ccc2c(c1)COC2 ZINC000483728166 899387498 /nfs/dbraw/zinc/38/74/98/899387498.db2.gz HVJWCUKLCLGEIS-INIZCTEOSA-N 2 0 419.491 4.338 20 0 HIADRP COc1cccc2c1CC[C@@H]2[NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000483727356 899387946 /nfs/dbraw/zinc/38/79/46/899387946.db2.gz GFEYDKRRQFNAFO-FQEVSTJZSA-N 2 0 419.491 4.243 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H](CO)Cc1c(F)cccc1Cl ZINC000483803690 899478889 /nfs/dbraw/zinc/47/88/89/899478889.db2.gz FYVRIEWBOHPBBK-FHJLPGHOSA-N 2 0 404.957 4.130 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000484031260 899662939 /nfs/dbraw/zinc/66/29/39/899662939.db2.gz IBVXAVNOTXSLAY-SQJMNOBHSA-N 2 0 422.617 4.238 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(-n3ccnc3)cc2C)CC1 ZINC000484068539 899701823 /nfs/dbraw/zinc/70/18/23/899701823.db2.gz BYESJGMTBAQCBR-FQEVSTJZSA-N 2 0 421.564 4.313 20 0 HIADRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+][C@@H]2CCSc3c(Cl)cccc32)CC1 ZINC000484274251 899845130 /nfs/dbraw/zinc/84/51/30/899845130.db2.gz HCPZHUCEXNRGFW-GOSISDBHSA-N 2 0 410.027 4.093 20 0 HIADRP CC(C)(C)NC(=O)C[NH+]1CCC(C[NH2+][C@@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000484296883 899859891 /nfs/dbraw/zinc/85/98/91/899859891.db2.gz SAMUYOQFZWKKHY-GOSISDBHSA-N 2 0 410.027 4.093 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000484304986 899865215 /nfs/dbraw/zinc/86/52/15/899865215.db2.gz IDVVFCYAFUNSSX-CQSZACIVSA-N 2 0 400.394 4.271 20 0 HIADRP OC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000484484782 899977133 /nfs/dbraw/zinc/97/71/33/899977133.db2.gz OLQMNMZTXHMUDU-QFIPXVFZSA-N 2 0 400.950 4.300 20 0 HIADRP COc1ccc([C@H](C)[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)cc1NC(C)=O ZINC000484498824 899989545 /nfs/dbraw/zinc/98/95/45/899989545.db2.gz FGWUEAMALIDOOO-FHWLQOOXSA-N 2 0 409.574 4.461 20 0 HIADRP CCOc1ccccc1NC(=O)CC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC000485347945 900639937 /nfs/dbraw/zinc/63/99/37/900639937.db2.gz NAWKVCBMYACIJC-LADGPHEKSA-N 2 0 421.585 4.400 20 0 HIADRP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000485918637 901144158 /nfs/dbraw/zinc/14/41/58/901144158.db2.gz YSUVQNAGEUBOFD-XMMPIXPASA-N 2 0 405.586 4.267 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000488526565 902870524 /nfs/dbraw/zinc/87/05/24/902870524.db2.gz ZTXIFKALENLOCQ-QFZRFWILSA-N 2 0 423.576 4.065 20 0 HIADRP CCOc1ccccc1C[N@H+](CCCn1ccnc1)Cc1c(C)nc2ccccn21 ZINC000506025055 914704453 /nfs/dbraw/zinc/70/44/53/914704453.db2.gz BQNFXFXDCJGYAP-UHFFFAOYSA-N 2 0 403.530 4.330 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC000489294473 903314649 /nfs/dbraw/zinc/31/46/49/903314649.db2.gz PFGMRKBTKSBESP-XUZZJYLKSA-N 2 0 420.601 4.128 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CC(=O)N[C@@H](c2ccccc2)C2CC2)CC1 ZINC000489680019 903539448 /nfs/dbraw/zinc/53/94/48/903539448.db2.gz RFCBWAMRTNFYLM-SANMLTNESA-N 2 0 405.586 4.098 20 0 HIADRP C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506047355 914741716 /nfs/dbraw/zinc/74/17/16/914741716.db2.gz KJFFFFCGGAYYIF-QGZVFWFLSA-N 2 0 418.969 4.275 20 0 HIADRP C[NH+]1CCC(N(Cc2ccccc2)C(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)CC1 ZINC000489995915 903716047 /nfs/dbraw/zinc/71/60/47/903716047.db2.gz VRCHVPJQQLZFJP-VWLOTQADSA-N 2 0 420.601 4.130 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@H](c2ccc(F)c(C)c2)c2ccccc2Cl)CC1 ZINC000490120396 903777152 /nfs/dbraw/zinc/77/71/52/903777152.db2.gz UCIKLXOUDAIUMU-HSZRJFAPSA-N 2 0 403.973 4.494 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@H](c1cccc(F)c1)c1cccc(Cl)c1)N1CC[NH+](C)CC1 ZINC000490164737 903805343 /nfs/dbraw/zinc/80/53/43/903805343.db2.gz PTOQWJUKFHTUHO-PKTZIBPZSA-N 2 0 403.973 4.430 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2ccc3c(c2)CCCC3)c1)C1CCOCC1 ZINC000490780771 904229322 /nfs/dbraw/zinc/22/93/22/904229322.db2.gz CVYWYCPZNAJRMA-UHFFFAOYSA-N 2 0 408.586 4.345 20 0 HIADRP C[C@@H](NC(=O)c1oc2ccccc2c1C[NH+](C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000490802107 904249338 /nfs/dbraw/zinc/24/93/38/904249338.db2.gz XWOCOJDBTOAFJL-UYAOXDASSA-N 2 0 405.542 4.135 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 ZINC000491019792 904371568 /nfs/dbraw/zinc/37/15/68/904371568.db2.gz LRDYMCWAJLXKEY-FDDCHVKYSA-N 2 0 403.973 4.432 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1 ZINC000491018469 904371979 /nfs/dbraw/zinc/37/19/79/904371979.db2.gz IBECWOYMYDNSQW-IERDGZPVSA-N 2 0 423.935 4.256 20 0 HIADRP CCOc1ccc([C@@H]([NH2+]C[C@H](C)N2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000491026861 904377686 /nfs/dbraw/zinc/37/76/86/904377686.db2.gz ZGIUYTLSCAZSDZ-FDDCHVKYSA-N 2 0 401.982 4.054 20 0 HIADRP Cc1cc([C@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2ccccc2Cl)ccc1F ZINC000493062938 905007167 /nfs/dbraw/zinc/00/71/67/905007167.db2.gz VCGBVDPEDIWVSU-QHCPKHFHSA-N 2 0 403.973 4.493 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2)CC1 ZINC000493543888 905155620 /nfs/dbraw/zinc/15/56/20/905155620.db2.gz KIBAFHBNVUVPBK-OZXSUGGESA-N 2 0 419.613 4.077 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccc(Br)c(Cl)c1 ZINC000494196614 905531910 /nfs/dbraw/zinc/53/19/10/905531910.db2.gz YCJNPDSIIMDCHM-SFHVURJKSA-N 2 0 423.782 4.349 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]C2CC(c3ccc(Br)cc3)C2)C1 ZINC000494744402 905942125 /nfs/dbraw/zinc/94/21/25/905942125.db2.gz HIEQLOJKWRHBJN-KITAHSCOSA-N 2 0 415.375 4.052 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]C2CCC(c3nc(C)no3)CC2)CC1 ZINC000495080615 906227725 /nfs/dbraw/zinc/22/77/25/906227725.db2.gz RTVRKGLJBXIFFZ-PPDQVPDSSA-N 2 0 415.557 4.036 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000495420541 906441066 /nfs/dbraw/zinc/44/10/66/906441066.db2.gz JBPWCIVBSLYBKH-IPJJNNNSSA-N 2 0 415.603 4.009 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1cccc2ccccc21 ZINC000495460701 906465422 /nfs/dbraw/zinc/46/54/22/906465422.db2.gz LLFWXDWVCSUTFV-AUSIDOKSSA-N 2 0 401.554 4.388 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H](Cc2ccccc2)c2ccccc2)c1 ZINC000495705194 906531294 /nfs/dbraw/zinc/53/12/94/906531294.db2.gz YUJYQYJJJNRDCO-RUZDIDTESA-N 2 0 401.554 4.052 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C(=O)NCCc1ccc(F)cc1 ZINC000497276409 906827060 /nfs/dbraw/zinc/82/70/60/906827060.db2.gz OHTKZXXUBQMNFU-HXUWFJFHSA-N 2 0 411.565 4.039 20 0 HIADRP c1cn(Cc2cccc(C[NH2+][C@@H]3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)c2)cn1 ZINC000512643110 921271490 /nfs/dbraw/zinc/27/14/90/921271490.db2.gz VRZGCOQPMLOVNB-JIMJEQGWSA-N 2 0 400.570 4.322 20 0 HIADRP CC(=O)N1CC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c2ccccc21 ZINC000512667859 921281605 /nfs/dbraw/zinc/28/16/05/921281605.db2.gz RJLNNFMQFMHKNS-CGBRIMPHSA-N 2 0 403.570 4.375 20 0 HIADRP C[C@H](NC(=O)N1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1)[C@@H]1CCC[NH+](C2CCC2)C1 ZINC000512694378 921289812 /nfs/dbraw/zinc/28/98/12/921289812.db2.gz OEJGABUWBBERLP-QNWVGRARSA-N 2 0 418.670 4.326 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)cc1 ZINC000498122938 907634756 /nfs/dbraw/zinc/63/47/56/907634756.db2.gz BJLYVCWXAVMANL-ZCYQVOJMSA-N 2 0 420.601 4.041 20 0 HIADRP COc1cc(OC)cc(N2CC[C@H]([NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)C2)c1 ZINC000499238026 908602431 /nfs/dbraw/zinc/60/24/31/908602431.db2.gz QGVUSXNWAJDLCQ-CWBXHPNXSA-N 2 0 421.585 4.068 20 0 HIADRP CCCC[N@H+](CC)Cc1cccc(CNC(=O)N(C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c1 ZINC000499740441 908894895 /nfs/dbraw/zinc/89/48/95/908894895.db2.gz KCQIIVBOMVBOJW-AIZNXBIQSA-N 2 0 400.611 4.075 20 0 HIADRP Cc1cc(Br)cc(C)c1NC(=O)CCC[N@H+](C)CCC[NH+]1CCCC1 ZINC000499955929 909396155 /nfs/dbraw/zinc/39/61/55/909396155.db2.gz PYMNFPPJQVIADD-UHFFFAOYSA-N 2 0 410.400 4.202 20 0 HIADRP COc1ccc([C@H]2C[C@H]([NH2+]Cc3ccccc3N(C)C3CC[NH+](C)CC3)C2)cc1F ZINC000500562438 909931005 /nfs/dbraw/zinc/93/10/05/909931005.db2.gz UPCHTONJNHTKJT-MEMLXQNLSA-N 2 0 411.565 4.401 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(CNC(=O)NCc3ccc(C[NH+](C)C)cc3)cc2)C1 ZINC000500694315 910026675 /nfs/dbraw/zinc/02/66/75/910026675.db2.gz AWLQPYLUYJMOEZ-OYRHEFFESA-N 2 0 422.617 4.226 20 0 HIADRP CC(C)C[NH+]1CCC(NC(=O)NCc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)CC1 ZINC000500694960 910027665 /nfs/dbraw/zinc/02/76/65/910027665.db2.gz HOUQELYVLBGNKP-NHCUHLMSSA-N 2 0 414.638 4.084 20 0 HIADRP C[NH+](C)CCCC1CCN(C(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)CC1 ZINC000500774716 910071069 /nfs/dbraw/zinc/07/10/69/910071069.db2.gz AWRAHSFIPVXZKI-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP C[NH+](C)CCCC1CCN(C(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)CC1 ZINC000500793881 910084265 /nfs/dbraw/zinc/08/42/65/910084265.db2.gz PTTWRKUWVNFBBD-UHFFFAOYSA-N 2 0 421.029 4.068 20 0 HIADRP Cc1ccc(-c2noc(CCC[N@@H+](C)CC3CCN(c4cc[nH+]cc4)CC3)n2)cc1F ZINC000501020420 910239495 /nfs/dbraw/zinc/23/94/95/910239495.db2.gz BQDRWSSFVWRXHZ-UHFFFAOYSA-N 2 0 423.536 4.360 20 0 HIADRP C[C@@H](c1cc2ccccc2o1)N(C)C(=O)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501021562 910239609 /nfs/dbraw/zinc/23/96/09/910239609.db2.gz GLFXMDKHHOSWNE-IBGZPJMESA-N 2 0 420.557 4.196 20 0 HIADRP C[N@H+](CCOc1ccc(Br)cc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501023219 910240285 /nfs/dbraw/zinc/24/02/85/910240285.db2.gz SWWLKKWLELGSMN-UHFFFAOYSA-N 2 0 404.352 4.071 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1)c1ccsc1 ZINC000501177243 910345098 /nfs/dbraw/zinc/34/50/98/910345098.db2.gz VSOHRQHUNIXCOS-RBUKOAKNSA-N 2 0 420.648 4.329 20 0 HIADRP C[C@@H](CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)[N@@H+]1CCCC[C@H]1C ZINC000501547298 910651288 /nfs/dbraw/zinc/65/12/88/910651288.db2.gz ASFAHOQZGYVSMZ-RTWAWAEBSA-N 2 0 422.617 4.477 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2c(C)cc(C)cc2C)CC1 ZINC000501767870 910823475 /nfs/dbraw/zinc/82/34/75/910823475.db2.gz ZIHUNVZDNVWYHJ-NRFANRHFSA-N 2 0 403.611 4.009 20 0 HIADRP C[NH+](C)Cc1cc(C[NH2+]C2CCN(Cc3c(F)cccc3Cl)CC2)ccc1F ZINC000513225676 921640473 /nfs/dbraw/zinc/64/04/73/921640473.db2.gz CAWRWNQWMLREDT-UHFFFAOYSA-N 2 0 407.936 4.434 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(Cc2ccccc2)CC1)c1cnn(C2CCCC2)c1 ZINC000502686555 911727289 /nfs/dbraw/zinc/72/72/89/911727289.db2.gz MXDYCRKYAQCIMI-QFIPXVFZSA-N 2 0 409.622 4.247 20 0 HIADRP CC1CC[NH+](C[C@@H]2CCCN(C(=O)NC3CCC([NH+]4CCC(C)CC4)CC3)C2)CC1 ZINC000502766382 911788699 /nfs/dbraw/zinc/78/86/99/911788699.db2.gz GVGFGWPPVHIFOE-BOMBAVFCSA-N 2 0 418.670 4.183 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)[NH+]2CCCC2)o1 ZINC000502767458 911790105 /nfs/dbraw/zinc/79/01/05/911790105.db2.gz LQCBKCWPINJVQH-HRTMPFAESA-N 2 0 416.610 4.067 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)[NH+]2CCCC2)o1 ZINC000502781379 911805404 /nfs/dbraw/zinc/80/54/04/911805404.db2.gz LVCVENIZEXYACU-FPOVZHCZSA-N 2 0 412.578 4.154 20 0 HIADRP CC1CC[NH+](CCCCNC(=O)NC[C@@H](c2cccs2)[NH+]2CCC(C)CC2)CC1 ZINC000502803511 911822351 /nfs/dbraw/zinc/82/23/51/911822351.db2.gz QJISEFCNKMWQMS-NRFANRHFSA-N 2 0 420.667 4.332 20 0 HIADRP C[C@H]([NH2+]C(C)(C)CNC(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1)c1ccccc1 ZINC000502930804 911918004 /nfs/dbraw/zinc/91/80/04/911918004.db2.gz AAKMYRXODUFHAA-NZQKXSOJSA-N 2 0 408.590 4.252 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NCCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1 ZINC000502974012 911954751 /nfs/dbraw/zinc/95/47/51/911954751.db2.gz ZNGCCFBZYZIWQM-QHAWAJNXSA-N 2 0 402.627 4.173 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1ccccc1 ZINC000503140916 912103071 /nfs/dbraw/zinc/10/30/71/912103071.db2.gz NFYHCPYIBRWOHP-OFNKIYASSA-N 2 0 408.590 4.252 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)N2CCC(CCC[NH+]3CCCC3)CC2)[NH+]2CCCC2)o1 ZINC000506467992 915065321 /nfs/dbraw/zinc/06/53/21/915065321.db2.gz KMGVARKRKPBELQ-JOCHJYFZSA-N 2 0 416.610 4.023 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](Cc3ccccn3)c3cccnc3)CC2)cc1 ZINC000513378348 921752883 /nfs/dbraw/zinc/75/28/83/921752883.db2.gz QUVRPVQLKXQYFI-AREMUKBSSA-N 2 0 416.569 4.271 20 0 HIADRP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccccc2-c2ccc(Cn3cncn3)cc2)CC1 ZINC000513385198 921757631 /nfs/dbraw/zinc/75/76/31/921757631.db2.gz UVTVLENJMZMEKP-UHFFFAOYSA-N 2 0 403.574 4.346 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH+]2CCC(C(=O)Nc3ccccc3)CC2)CC1 ZINC000506721592 915401840 /nfs/dbraw/zinc/40/18/40/915401840.db2.gz FGFBCLKXRFQUFF-UHFFFAOYSA-N 2 0 420.601 4.069 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000506904776 915703622 /nfs/dbraw/zinc/70/36/22/915703622.db2.gz XASCEYCCMRILBU-QPPBQGQZSA-N 2 0 412.622 4.078 20 0 HIADRP O=C(c1cccc(C[NH+]2CCCC2)c1)N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000507155495 915895743 /nfs/dbraw/zinc/89/57/43/915895743.db2.gz HPBRSYUQBGNLNF-UHFFFAOYSA-N 2 0 405.586 4.063 20 0 HIADRP CC[C@@H]1Oc2cc([C@H](C)[NH2+][C@@H]3CC[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]34)ccc2NC1=O ZINC000507487941 916254085 /nfs/dbraw/zinc/25/40/85/916254085.db2.gz SODZGNFRFWSADA-CCMOONMYSA-N 2 0 419.569 4.357 20 0 HIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H]3CCc4nnc(-c5ccc(F)cc5)n4C3)CC2)C1 ZINC000507604839 916361331 /nfs/dbraw/zinc/36/13/31/916361331.db2.gz IVLCEXFRDKHGMF-VOQZNFBZSA-N 2 0 411.569 4.032 20 0 HIADRP CC[NH+](CC)CC1CC[NH+](CCC(=O)Nc2ccccc2C(=O)c2ccccc2)CC1 ZINC000507966473 916820410 /nfs/dbraw/zinc/82/04/10/916820410.db2.gz MYLUYNFCACKZAJ-UHFFFAOYSA-N 2 0 421.585 4.300 20 0 HIADRP COc1cc(OC)cc(N2CC[C@H](C[NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000508698617 917460225 /nfs/dbraw/zinc/46/02/25/917460225.db2.gz PIEPAXZTLRIPRF-YMPZKCBVSA-N 2 0 423.601 4.030 20 0 HIADRP C[C@@H](Nc1ccccc1C[NH+]1CCC(CO)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508699515 917460933 /nfs/dbraw/zinc/46/09/33/917460933.db2.gz OICMRIBWLJVKPD-QPPBQGQZSA-N 2 0 407.602 4.213 20 0 HIADRP C[C@@H]([NH2+]CCc1nc(-c2cccc(Cl)c2)no1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508718483 917480824 /nfs/dbraw/zinc/48/08/24/917480824.db2.gz NULGHKQIEUSAQF-XLIONFOSSA-N 2 0 410.949 4.433 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N(C)[C@@H]1CC[NH+](CC)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000509025073 917778908 /nfs/dbraw/zinc/77/89/08/917778908.db2.gz TWQZDVYLDNWONE-IOMROCGXSA-N 2 0 409.018 4.237 20 0 HIADRP Cc1ccccc1[C@@H]([C@H](C)NC(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)[NH+](C)C ZINC000510547592 918992577 /nfs/dbraw/zinc/99/25/77/918992577.db2.gz OZOUEUDVSYZGEM-XUZZJYLKSA-N 2 0 407.602 4.405 20 0 HIADRP O=C(Cc1ccccc1)N1CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000511003897 919563807 /nfs/dbraw/zinc/56/38/07/919563807.db2.gz XFHLEPWFLDDBCL-FXSWLTOZSA-N 2 0 417.597 4.005 20 0 HIADRP Cc1ccc([C@H](CNC(=O)N[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)[NH+]2CCCC2)cc1 ZINC000511251965 919854108 /nfs/dbraw/zinc/85/41/08/919854108.db2.gz RGQZTYKLLVOMCM-FJIJXJHWSA-N 2 0 412.622 4.084 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000511631265 920291550 /nfs/dbraw/zinc/29/15/50/920291550.db2.gz VGGRNLHDRZCANS-UHFFFAOYSA-N 2 0 407.602 4.270 20 0 HIADRP Cc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)sc1Br ZINC000511926038 920673468 /nfs/dbraw/zinc/67/34/68/920673468.db2.gz JNPUOXPUJJVIFD-WMLDXEAASA-N 2 0 409.393 4.236 20 0 HIADRP CCOc1cc(C[NH+]2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1OC(F)F ZINC000512188153 920930477 /nfs/dbraw/zinc/93/04/77/920930477.db2.gz WHWAHEVOXWZREZ-CALCHBBNSA-N 2 0 412.521 4.008 20 0 HIADRP CCOc1ccc(NC(=O)CC[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1 ZINC000512237311 920991520 /nfs/dbraw/zinc/99/15/20/920991520.db2.gz PEIJPTGEVPNINI-VWLOTQADSA-N 2 0 407.558 4.012 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](CC(=O)N2CC=C(c3c[nH]c4ccccc43)CC2)CC1 ZINC000512266769 921023403 /nfs/dbraw/zinc/02/34/03/921023403.db2.gz UOCIWDBCJFZTFF-UHFFFAOYSA-N 2 0 422.617 4.228 20 0 HIADRP COc1ccc(CC[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c(OC)c1OC ZINC000512287613 921043126 /nfs/dbraw/zinc/04/31/26/921043126.db2.gz IYXZJXLGPDMLLX-XPWALMASSA-N 2 0 424.585 4.145 20 0 HIADRP C[C@@H]1C[C@@H](CC[NH2+][C@H](C(=O)NC2CC2)c2ccc(F)cc2)C[N@@H+]1Cc1ccccc1 ZINC000512323588 921074713 /nfs/dbraw/zinc/07/47/13/921074713.db2.gz CYVHJMJDBUIPSF-FPGHNAPASA-N 2 0 409.549 4.036 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)[C@@H]2C[NH+](Cc3ccccc3)CCC2(F)F)CC1 ZINC000512327746 921078649 /nfs/dbraw/zinc/07/86/49/921078649.db2.gz HROBVTMACYQZAO-QFIPXVFZSA-N 2 0 421.576 4.114 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512332045 921080771 /nfs/dbraw/zinc/08/07/71/921080771.db2.gz MUYGMLYIAQDVCE-ZACQAIPSSA-N 2 0 422.411 4.409 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512337860 921083978 /nfs/dbraw/zinc/08/39/78/921083978.db2.gz UZRCHEVCKTXFCG-KEZQHZCBSA-N 2 0 423.601 4.227 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCOCC2)cc1 ZINC000513474882 921834038 /nfs/dbraw/zinc/83/40/38/921834038.db2.gz DJHQBSPEQJROIH-OAQYLSRUSA-N 2 0 423.601 4.158 20 0 HIADRP Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513495270 921845535 /nfs/dbraw/zinc/84/55/35/921845535.db2.gz NMTZSMCJFWAREQ-APWZRJJASA-N 2 0 424.511 4.060 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)c1 ZINC000513783637 922108654 /nfs/dbraw/zinc/10/86/54/922108654.db2.gz BWXBUKJKFLWAOG-QHCPKHFHSA-N 2 0 421.585 4.294 20 0 HIADRP O=C(c1ccccc1)N1CC[C@H](C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000514082095 922406449 /nfs/dbraw/zinc/40/64/49/922406449.db2.gz FPWWWKSLONUVEW-AFESJLNVSA-N 2 0 417.597 4.135 20 0 HIADRP Cc1cc(C)n(-c2ccc(C[NH2+]C3CCC([N@H+](C)Cc4ccccc4)CC3)cn2)n1 ZINC000514103820 922433163 /nfs/dbraw/zinc/43/31/63/922433163.db2.gz FFXNDHNJGVFYSA-UHFFFAOYSA-N 2 0 403.574 4.417 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)C1 ZINC000514162627 922500689 /nfs/dbraw/zinc/50/06/89/922500689.db2.gz NQTHNQLNTZMTDH-HMXCVIKNSA-N 2 0 412.603 4.020 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)NC[C@H](c1ccc(C)cc1)[NH+](C)C)c1ccsc1 ZINC000514221957 922557434 /nfs/dbraw/zinc/55/74/34/922557434.db2.gz LENXOCBKIQEKQZ-RTWAWAEBSA-N 2 0 402.608 4.042 20 0 HIADRP O=C(NCC1([NH+]2CCCCC2)CCCCC1)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000514436441 922626149 /nfs/dbraw/zinc/62/61/49/922626149.db2.gz CYDSLXMJXVOOBD-UHFFFAOYSA-N 2 0 412.622 4.139 20 0 HIADRP C[C@H]1CCC[N@H+](CCCCNC(=O)NC[C@@H](c2ccccc2Cl)[NH+]2CCCC2)C1 ZINC000514458877 922635397 /nfs/dbraw/zinc/63/53/97/922635397.db2.gz DUXHVZQWKTWLNA-UGKGYDQZSA-N 2 0 421.029 4.288 20 0 HIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccc2c(c1)OCCO2 ZINC000514682387 922753449 /nfs/dbraw/zinc/75/34/49/922753449.db2.gz IXFCWJBJRPRHEN-REWPJTCUSA-N 2 0 422.569 4.037 20 0 HIADRP COc1ccccc1[C@@H](C)NC(=O)[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000514962760 922856151 /nfs/dbraw/zinc/85/61/51/922856151.db2.gz FKQIGGOGMKSRTJ-UXHICEINSA-N 2 0 409.574 4.037 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C(=O)NCCc1ccc(F)cc1 ZINC000515518117 923149115 /nfs/dbraw/zinc/14/91/15/923149115.db2.gz QLVCCTUHATWMHQ-WOJBJXKFSA-N 2 0 411.565 4.037 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)Nc2cccc(OCC[NH+](C)C)c2)c2ccccc2)CC1 ZINC000516468731 923747141 /nfs/dbraw/zinc/74/71/41/923747141.db2.gz BPXIFYLYNFKBJI-XMMPIXPASA-N 2 0 424.589 4.222 20 0 HIADRP O=C(Nc1ccnc(N2CCc3ccccc3C2)c1)c1ccc(C[NH+]2CCCC2)cc1 ZINC000516592004 923806419 /nfs/dbraw/zinc/80/64/19/923806419.db2.gz SUVLTHHSMSSXDA-UHFFFAOYSA-N 2 0 412.537 4.492 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000516765774 923882127 /nfs/dbraw/zinc/88/21/27/923882127.db2.gz QKBBTWADVRTMNX-TZIWHRDSSA-N 2 0 415.578 4.053 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)cc1 ZINC000517422414 924172462 /nfs/dbraw/zinc/17/24/62/924172462.db2.gz UXWSGLHVORPSOC-ZJSXRUAMSA-N 2 0 412.622 4.221 20 0 HIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]Cc3ccncc3OCC[NH+](C)C)cs2)cs1 ZINC000517777993 926831798 /nfs/dbraw/zinc/83/17/98/926831798.db2.gz PALLUGBAHDEWMQ-CQSZACIVSA-N 2 0 402.589 4.366 20 0 HIADRP C[N@H+](CCN1CC[NH+](CCCOc2ccc3ccccc3c2)CC1)Cc1ccccc1 ZINC000518745922 927472028 /nfs/dbraw/zinc/47/20/28/927472028.db2.gz YPQWGAJNRZUQOO-UHFFFAOYSA-N 2 0 417.597 4.358 20 0 HIADRP Cc1nn(-c2ccccc2)cc1C[NH2+]CCCC[NH+]1CCN(c2cccc(C)c2)CC1 ZINC000518769657 927484537 /nfs/dbraw/zinc/48/45/37/927484537.db2.gz NRHCCXZWRULTTK-UHFFFAOYSA-N 2 0 417.601 4.181 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(=O)N(C)Cc1cccc(F)c1 ZINC000518842290 927542346 /nfs/dbraw/zinc/54/23/46/927542346.db2.gz QJOWXLSWFCEGSU-PMACEKPBSA-N 2 0 411.565 4.337 20 0 HIADRP C[NH+](Cc1ccccc1CNC(=O)NCC[N@@H+](C)C1CCCC1)C1CCCCC1 ZINC000519153956 927805240 /nfs/dbraw/zinc/80/52/40/927805240.db2.gz KLGAOOOJQQWBLH-UHFFFAOYSA-N 2 0 400.611 4.125 20 0 HIADRP CSC1(C[NH2+]Cc2csc(COc3ccc(Cl)cc3)n2)CC[NH+](C)CC1 ZINC000519861740 928102784 /nfs/dbraw/zinc/10/27/84/928102784.db2.gz YNUAIWQVAJRPTP-UHFFFAOYSA-N 2 0 412.024 4.293 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)N2CCC[N@@H+](C(C)(C)C)CC2)c2cccs2)CC1 ZINC000519924265 928156780 /nfs/dbraw/zinc/15/67/80/928156780.db2.gz AJHZFMVVGFIVOY-LJQANCHMSA-N 2 0 406.640 4.037 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1)c1cccs1 ZINC000520209581 928389417 /nfs/dbraw/zinc/38/94/17/928389417.db2.gz HWLWZAURKYEBHR-OAQYLSRUSA-N 2 0 414.619 4.226 20 0 HIADRP CC(C)(C)[NH+]1CCC(NC(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)CC1 ZINC000520299546 928462026 /nfs/dbraw/zinc/46/20/26/928462026.db2.gz HBBZCCOAOSPPPJ-UHFFFAOYSA-N 2 0 400.611 4.125 20 0 HIADRP C[N@H+](CCN1CC[NH+](CCCOc2cccc3ccccc32)CC1)Cc1ccccc1 ZINC000521783887 929444311 /nfs/dbraw/zinc/44/43/11/929444311.db2.gz STZITOULZYFGLT-UHFFFAOYSA-N 2 0 417.597 4.358 20 0 HIADRP O=C(NCCCCC[NH+]1CCCCC1)NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000522066832 929627372 /nfs/dbraw/zinc/62/73/72/929627372.db2.gz COJYGFQMIUBJHV-UHFFFAOYSA-N 2 0 400.611 4.128 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CCC[NH+](Cc3ccccc3)C[C@@H]2C)cc1)C1CC1 ZINC000524868561 929865734 /nfs/dbraw/zinc/86/57/34/929865734.db2.gz KFHZYJNLZGWSEC-NRFANRHFSA-N 2 0 405.586 4.408 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)[NH+]2CCCC2)o1 ZINC000524884771 929872138 /nfs/dbraw/zinc/87/21/38/929872138.db2.gz SUQFRUMTKNWEDH-NZQKXSOJSA-N 2 0 424.589 4.031 20 0 HIADRP CCCOc1ccc(NC(=O)N(CC[NH+](C)C)C[C@@H]2CCC[N@@H+]2CC)cc1Cl ZINC000525375467 930204666 /nfs/dbraw/zinc/20/46/66/930204666.db2.gz SMLVIMIVPMHDDF-SFHVURJKSA-N 2 0 410.990 4.009 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N2CCC[NH+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000525402568 930220663 /nfs/dbraw/zinc/22/06/63/930220663.db2.gz PKYBYSZHTJPOOH-ZRBLBEILSA-N 2 0 414.638 4.051 20 0 HIADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)N[C@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000525437335 930239938 /nfs/dbraw/zinc/23/99/38/930239938.db2.gz KMHIKYMZFRQXDU-RUZDIDTESA-N 2 0 418.585 4.064 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000525451151 930248095 /nfs/dbraw/zinc/24/80/95/930248095.db2.gz OQHGTSDZNXCNOH-JOCHJYFZSA-N 2 0 420.601 4.088 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+](Cc2ccc3ccccc3c2)CC1)Cc1ccccc1 ZINC000530689849 930798586 /nfs/dbraw/zinc/79/85/86/930798586.db2.gz CNRBMKVCSLCEPR-UHFFFAOYSA-N 2 0 415.581 4.300 20 0 HIADRP Fc1ccc(-n2cc(C[NH2+]CCCOC3CC[NH+](Cc4ccccc4)CC3)cn2)cc1 ZINC000531380822 931038438 /nfs/dbraw/zinc/03/84/38/931038438.db2.gz DTBRDHLSPKDQFR-UHFFFAOYSA-N 2 0 422.548 4.172 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3sccc3Br)cc2)CC1 ZINC000531682422 931150531 /nfs/dbraw/zinc/15/05/31/931150531.db2.gz VPXOKZCDFFTROY-MRXNPFEDSA-N 2 0 422.436 4.499 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)C(c1ccccc1)c1ccccc1 ZINC000531941666 931254786 /nfs/dbraw/zinc/25/47/86/931254786.db2.gz VAONQSPAARTDIG-OAQYLSRUSA-N 2 0 400.570 4.144 20 0 HIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000531941766 931254987 /nfs/dbraw/zinc/25/49/87/931254987.db2.gz ZWIFJACDXJKKFQ-JOCHJYFZSA-N 2 0 406.599 4.277 20 0 HIADRP CCN(CC)C(=O)C[C@@H](C)[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000531960318 931265564 /nfs/dbraw/zinc/26/55/64/931265564.db2.gz QKZWNCCCIUANPH-HXUWFJFHSA-N 2 0 404.558 4.335 20 0 HIADRP CCN(CC)C(=O)C[C@H](C)[NH2+]Cc1ccccc1-c1ccc(Cn2ccnc2)cc1 ZINC000531960317 931265773 /nfs/dbraw/zinc/26/57/73/931265773.db2.gz QKZWNCCCIUANPH-FQEVSTJZSA-N 2 0 404.558 4.335 20 0 HIADRP C[NH+]1CCN(C[C@@H]([NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)c2ccccc2)CC1 ZINC000531965289 931268347 /nfs/dbraw/zinc/26/83/47/931268347.db2.gz PZIFBRVZTMQHRD-FCHUYYIVSA-N 2 0 419.491 4.151 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@@H](C)[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC000531977780 931273146 /nfs/dbraw/zinc/27/31/46/931273146.db2.gz GDKWGYOEBDORQL-QGZVFWFLSA-N 2 0 410.002 4.413 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1 ZINC000531989581 931278483 /nfs/dbraw/zinc/27/84/83/931278483.db2.gz NNJFBEHUOIVIGI-QGZVFWFLSA-N 2 0 407.587 4.116 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc(NC(=O)C3CCC3)c2)CC1 ZINC000532042732 931295276 /nfs/dbraw/zinc/29/52/76/931295276.db2.gz XNZUTBNDGOWZHW-UHFFFAOYSA-N 2 0 420.601 4.247 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]C2CCN(c3ccccc3)CC2)CC1 ZINC000532215143 931355954 /nfs/dbraw/zinc/35/59/54/931355954.db2.gz IUMDZTQMMVNMGR-HXUWFJFHSA-N 2 0 410.581 4.287 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(Br)s1 ZINC000532215197 931356909 /nfs/dbraw/zinc/35/69/09/931356909.db2.gz ZIHFSOHLWCCLCD-AWEZNQCLSA-N 2 0 409.393 4.318 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000532361093 931408567 /nfs/dbraw/zinc/40/85/67/931408567.db2.gz DGPBDBDEXPEBNO-UHFFFAOYSA-N 3 0 408.634 4.347 20 0 HIADRP CC(C)CC[NH+]1CCC(C[NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)CC1 ZINC000532517476 931471578 /nfs/dbraw/zinc/47/15/78/931471578.db2.gz QDSMDOXOEMFSBD-UHFFFAOYSA-N 2 0 406.014 4.292 20 0 HIADRP COc1ccc([C@H]2CCCCCN2C(=O)C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cc1 ZINC000532537919 931514921 /nfs/dbraw/zinc/51/49/21/931514921.db2.gz WLPIVJAPRNOAAM-XMMPIXPASA-N 2 0 415.622 4.191 20 0 HIADRP O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@@H]([NH2+]CCCCC[NH+]2CCCCC2)C1 ZINC000532762651 931625137 /nfs/dbraw/zinc/62/51/37/931625137.db2.gz ZFXYBMNUCVBGIK-RTWAWAEBSA-N 2 0 411.590 4.230 20 0 HIADRP O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@H]([NH2+]CCCCC[NH+]2CCCCC2)C1 ZINC000532762652 931625254 /nfs/dbraw/zinc/62/52/54/931625254.db2.gz ZFXYBMNUCVBGIK-SFTDATJTSA-N 2 0 411.590 4.230 20 0 HIADRP CN(c1ccccc1C[NH2+]CCOCc1ccc(Cl)cc1)C1CC[NH+](C)CC1 ZINC000532803920 931634732 /nfs/dbraw/zinc/63/47/32/931634732.db2.gz PUWCPHUJAINBLC-UHFFFAOYSA-N 2 0 401.982 4.177 20 0 HIADRP COc1cc(CNc2c[nH+]ccc2N2CC[NH+](C)CC2)ccc1OCc1ccccc1 ZINC000532830343 931645365 /nfs/dbraw/zinc/64/53/65/931645365.db2.gz LAAFZTSJUSUNSR-UHFFFAOYSA-N 2 0 418.541 4.033 20 0 HIADRP CC(C)[N@H+](C)CC1CC[NH+](CC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)CC1 ZINC000532950008 931708178 /nfs/dbraw/zinc/70/81/78/931708178.db2.gz QWAXWFRTUZUDCY-AREMUKBSSA-N 2 0 419.613 4.213 20 0 HIADRP C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000532977950 931724013 /nfs/dbraw/zinc/72/40/13/931724013.db2.gz XXSDKFSZELPPDC-DENIHFKCSA-N 2 0 409.599 4.052 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+]Cc3ccc(Sc4ccccc4)cc3)ccn2)CC1 ZINC000533149774 931787341 /nfs/dbraw/zinc/78/73/41/931787341.db2.gz OYSMAPOXDDOVPG-UHFFFAOYSA-N 2 0 404.583 4.274 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1C[C@H](c2ccc(F)cc2)C[C@H]1C ZINC000533300023 931832969 /nfs/dbraw/zinc/83/29/69/931832969.db2.gz XBQSNYDSEKWLFU-TXTKFYIRSA-N 2 0 423.576 4.173 20 0 HIADRP CN(c1ccccc1C[NH2+]C[C@@H](c1ccccc1)C(C)(C)CO)C1CC[NH+](C)CC1 ZINC000533329418 931839644 /nfs/dbraw/zinc/83/96/44/931839644.db2.gz GOOINXSPOPPLCE-DEOSSOPVSA-N 2 0 409.618 4.109 20 0 HIADRP C[C@@H](C[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1)CN1CC[NH+](C)CC1 ZINC000533608338 931921267 /nfs/dbraw/zinc/92/12/67/931921267.db2.gz OGKUWLQSQPZANO-AWEZNQCLSA-N 2 0 413.418 4.090 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2ccc(F)c(Cl)c2)c1)C1CCOCC1 ZINC000533754661 932011396 /nfs/dbraw/zinc/01/13/96/932011396.db2.gz XGBGDFJXSURJRH-UHFFFAOYSA-N 2 0 406.929 4.259 20 0 HIADRP C[NH+](C)Cc1cccc(NC(=O)NC[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)c1 ZINC000534243184 932360797 /nfs/dbraw/zinc/36/07/97/932360797.db2.gz VVCNJHKMYDZIGZ-DYESRHJHSA-N 2 0 418.944 4.355 20 0 HIADRP O=C([C@H]1CCC[N@@H+]1Cc1ccccc1)N1CCC2(CC[NH+](Cc3ccccc3)C2)CC1 ZINC000534247994 932363837 /nfs/dbraw/zinc/36/38/37/932363837.db2.gz LMWHKCJSNSRFAW-RUZDIDTESA-N 2 0 417.597 4.166 20 0 HIADRP O=C1[C@H](NC2CC[NH+](C3CCCC3)CC2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000537476962 933789919 /nfs/dbraw/zinc/78/99/19/933789919.db2.gz FSDXBQNOGFQHBY-OAQYLSRUSA-N 2 0 423.523 4.193 20 0 HIADRP COc1cc(OC)cc(Oc2ccc(C[NH+]3CCC(OCC[NH+](C)C)CC3)cc2)c1 ZINC000537630433 938340715 /nfs/dbraw/zinc/34/07/15/938340715.db2.gz WEPHLAFUERDFBG-UHFFFAOYSA-N 2 0 414.546 4.039 20 0 HIADRP CN(c1ccccc1C[N@@H+]1CC[C@@H](COCc2ccccc2)C1)C1CC[NH+](C)CC1 ZINC000537648707 938345719 /nfs/dbraw/zinc/34/57/19/938345719.db2.gz URTFBSKEHZQNCD-HSZRJFAPSA-N 2 0 407.602 4.256 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)CC(=O)Nc2cccc(Br)c2)C1 ZINC000537950981 938429281 /nfs/dbraw/zinc/42/92/81/938429281.db2.gz UPTRXWFZKCMVJM-IRXDYDNUSA-N 2 0 410.400 4.124 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@H](Cc2ccccc2)c2ccccc2)cc1 ZINC000537973247 938442467 /nfs/dbraw/zinc/44/24/67/938442467.db2.gz BHDUIGNRCZCAMP-RUZDIDTESA-N 2 0 401.554 4.052 20 0 HIADRP CC[N@H+](CCC1CC[NH+]([C@@H](C)C(=O)N2CCc3sccc3C2)CC1)CC(C)C ZINC000537994965 938454834 /nfs/dbraw/zinc/45/48/34/938454834.db2.gz JPDCZOMWZUPEQQ-IBGZPJMESA-N 2 0 405.652 4.101 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](c3cccc(C(F)(F)F)c3)C3CC3)cn2)CC1 ZINC000538062079 938491484 /nfs/dbraw/zinc/49/14/84/938491484.db2.gz MCYSSXDQARWVHR-NRFANRHFSA-N 2 0 404.480 4.093 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+][C@@H]1CCCN(c3cccc(F)c3)C1)c1ccccc1O2 ZINC000538293663 938585068 /nfs/dbraw/zinc/58/50/68/938585068.db2.gz LUQANYUTIXJULD-OFNKIYASSA-N 2 0 409.549 4.372 20 0 HIADRP Cc1ccccc1[C@@H]([NH2+][C@@H](C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1)C1CC1 ZINC000538390465 938609557 /nfs/dbraw/zinc/60/95/57/938609557.db2.gz ALIZXOIYSFMFPR-CPJSRVTESA-N 2 0 405.586 4.205 20 0 HIADRP CC(C)c1ncc(C[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)s1 ZINC000538400656 938611771 /nfs/dbraw/zinc/61/17/71/938611771.db2.gz IFAJIKGYTSLETO-UHFFFAOYSA-N 2 0 412.525 4.327 20 0 HIADRP C[C@@H](Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000538528752 938642272 /nfs/dbraw/zinc/64/22/72/938642272.db2.gz ZAJSIKIOXUQBAE-OAQYLSRUSA-N 2 0 422.617 4.332 20 0 HIADRP C[C@H](Nc1cccc(C[NH+]2CCC(CO)CC2)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000538549977 938646591 /nfs/dbraw/zinc/64/65/91/938646591.db2.gz OXORLPJXEUXRFD-FQEVSTJZSA-N 2 0 411.590 4.004 20 0 HIADRP Cc1cc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)ccc1-n1cncn1 ZINC000538797907 938714410 /nfs/dbraw/zinc/71/44/10/938714410.db2.gz FAIZOIXSHZDBBV-UKILVPOCSA-N 2 0 401.558 4.062 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)nnn1-c1ccc(Cl)cc1 ZINC000539038789 938777473 /nfs/dbraw/zinc/77/74/73/938777473.db2.gz NSKRIRCOOXGKMY-MRXNPFEDSA-N 2 0 410.953 4.191 20 0 HIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000539041068 938778224 /nfs/dbraw/zinc/77/82/24/938778224.db2.gz HAZCNCUXENDABX-BJLQDIEVSA-N 2 0 418.578 4.181 20 0 HIADRP COc1ccc(NC(=O)C[C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c(OC)c1 ZINC000539041181 938779081 /nfs/dbraw/zinc/77/90/81/938779081.db2.gz UKSOGEVAAXVGGT-HDYDNRTBSA-N 2 0 417.594 4.054 20 0 HIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CCN(C(=O)NC3CCCCC3)CC2)CC1 ZINC000539078798 938796638 /nfs/dbraw/zinc/79/66/38/938796638.db2.gz CAJWTGASNMNVIY-XXBNENTESA-N 2 0 404.643 4.126 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1cccc(N2CCCC2=O)c1 ZINC000539091629 938801405 /nfs/dbraw/zinc/80/14/05/938801405.db2.gz YVGKGYJSKCDAKP-JOCHJYFZSA-N 2 0 420.601 4.066 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](c3cccc(C(F)(F)F)c3)C3CC3)cn2)CC1 ZINC000539159809 938813997 /nfs/dbraw/zinc/81/39/97/938813997.db2.gz BHKIRKIRTWEBHU-QFIPXVFZSA-N 2 0 418.507 4.483 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)NCc2ccc(F)c(C[NH+](C)C)c2)CC1)CC(C)C ZINC000539170350 938815144 /nfs/dbraw/zinc/81/51/44/938815144.db2.gz YHLLCLFGAJAOQK-UHFFFAOYSA-N 2 0 420.617 4.177 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(CN2CCO[C@H](C)C2)c1)c1nc2ccc(Cl)cc2n1C ZINC000539203813 938818658 /nfs/dbraw/zinc/81/86/58/938818658.db2.gz ZFRZOIWDMUOKEL-IAGOWNOFSA-N 2 0 412.965 4.298 20 0 HIADRP CC(C)Oc1ccccc1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000563501735 945207261 /nfs/dbraw/zinc/20/72/61/945207261.db2.gz CBIGEWQQULYMFZ-XMMPIXPASA-N 2 0 408.586 4.492 20 0 HIADRP COC[C@@H]([NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1)c1ccc(F)c(F)c1 ZINC000539316945 938840094 /nfs/dbraw/zinc/84/00/94/938840094.db2.gz DSRIPFBWGRETLI-HSZRJFAPSA-N 2 0 404.501 4.163 20 0 HIADRP COc1cccc(N2CC[C@@H](C[NH2+][C@@H]3CC4(CC[NH+](C)CC4)Oc4ccccc43)C2)c1 ZINC000539363708 938849045 /nfs/dbraw/zinc/84/90/45/938849045.db2.gz QSWZXPDSKAJQRK-GBXCKJPGSA-N 2 0 421.585 4.099 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]Cc1ccccc1Cn1cccn1)c1ccccc1O2 ZINC000539370431 938850328 /nfs/dbraw/zinc/85/03/28/938850328.db2.gz VEGFMHVRXQZFBY-HSZRJFAPSA-N 2 0 402.542 4.009 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)[C@@H]2C[N@@H+](C(C)(C)C)C[C@H]2C(F)(F)F)c1 ZINC000563558444 945215616 /nfs/dbraw/zinc/21/56/16/945215616.db2.gz YTAFTCYZBGZJKL-RTBURBONSA-N 2 0 413.528 4.053 20 0 HIADRP Cc1oc2ccccc2c1C[NH+]1CCC(C(=O)NCC[N@@H+](C)Cc2ccccc2)CC1 ZINC000539836126 938953297 /nfs/dbraw/zinc/95/32/97/938953297.db2.gz UDKLHKUVXQZANJ-UHFFFAOYSA-N 2 0 419.569 4.201 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)[C@H](C)C1 ZINC000539874127 938963117 /nfs/dbraw/zinc/96/31/17/938963117.db2.gz KMHBFWDZMSWTSL-OFNKIYASSA-N 2 0 400.611 4.155 20 0 HIADRP Cc1cc2ncc([C@H](C)[NH2+]Cc3ccccc3C[N@H+](C)Cc3ccco3)c(C)n2n1 ZINC000540085831 939064514 /nfs/dbraw/zinc/06/45/14/939064514.db2.gz SXKWUHNJHPFKCY-SFHVURJKSA-N 2 0 403.530 4.422 20 0 HIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000540140958 939088463 /nfs/dbraw/zinc/08/84/63/939088463.db2.gz BPMZZKOUUJUFLP-SVFBPWRDSA-N 2 0 400.588 4.041 20 0 HIADRP C[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c2cccc(Br)c21 ZINC000540159135 939095622 /nfs/dbraw/zinc/09/56/22/939095622.db2.gz XHWADELKWRWHRZ-DPZWOIPNSA-N 2 0 407.396 4.355 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc(C(F)(F)F)cc1 ZINC000540303252 939187793 /nfs/dbraw/zinc/18/77/93/939187793.db2.gz SJQVQVLSLOAJFI-NRFANRHFSA-N 2 0 421.507 4.484 20 0 HIADRP CC(C)c1ccc(-c2nc(CN(C)CC[N@H+](C)C3CCN(C)CC3)cs2)cc1 ZINC000540334128 939198083 /nfs/dbraw/zinc/19/80/83/939198083.db2.gz WMDSWPHVICGXBV-UHFFFAOYSA-N 2 0 400.636 4.391 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1cccc(C[NH+]2CCC(CO)CC2)c1 ZINC000540749963 939358411 /nfs/dbraw/zinc/35/84/11/939358411.db2.gz RRMFHMMRLYMXET-HFZDXXHNSA-N 2 0 407.602 4.213 20 0 HIADRP Cc1ccc([C@H](C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)N2CCCC2)o1 ZINC000540810420 939380071 /nfs/dbraw/zinc/38/00/71/939380071.db2.gz WZXCMNUZBZBDIG-DEOSSOPVSA-N 2 0 410.606 4.045 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(OC(F)(F)F)cc1 ZINC000540988589 939425614 /nfs/dbraw/zinc/42/56/14/939425614.db2.gz NUWTXRYXOBUCMP-UZLBHIALSA-N 2 0 408.464 4.393 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(SCC(F)F)cc1 ZINC000540987909 939425703 /nfs/dbraw/zinc/42/57/03/939425703.db2.gz BZEZNDKXFDCXGS-OXJNMPFZSA-N 2 0 406.542 4.461 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(OC(F)(F)F)cc1 ZINC000540988587 939425746 /nfs/dbraw/zinc/42/57/46/939425746.db2.gz NUWTXRYXOBUCMP-OXQOHEQNSA-N 2 0 408.464 4.393 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(OC(F)(F)F)cc1 ZINC000540988585 939425762 /nfs/dbraw/zinc/42/57/62/939425762.db2.gz NUWTXRYXOBUCMP-OXJNMPFZSA-N 2 0 408.464 4.393 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N[C@H]2CC[NH+](C)[C@H](C)C2)cc1)C[C@@H]1CCCCO1 ZINC000541034148 939437261 /nfs/dbraw/zinc/43/72/61/939437261.db2.gz YLYGBFGVUWUAKL-OIBXWCBGSA-N 2 0 416.610 4.070 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NC2CC[NH+](CC3CCCC3)CC2)CC1 ZINC000541115679 939465213 /nfs/dbraw/zinc/46/52/13/939465213.db2.gz GQJCHKBCDSLSOP-UHFFFAOYSA-N 2 0 406.659 4.185 20 0 HIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCCc3nc(-c4ccc(F)cc4)no3)CC2)C1 ZINC000541553722 939553914 /nfs/dbraw/zinc/55/39/14/939553914.db2.gz MFWSHWHCJJKNQD-LAUBAEHRSA-N 2 0 400.542 4.441 20 0 HIADRP Cc1ccc(Cl)c(OC[C@@H](O)C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000541581939 939560120 /nfs/dbraw/zinc/56/01/20/939560120.db2.gz IJIJVFJOCZEYAZ-NRFANRHFSA-N 2 0 417.981 4.022 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(F)c(Br)c1 ZINC000541913976 939652153 /nfs/dbraw/zinc/65/21/53/939652153.db2.gz FTCBWAREEFCMNT-KXBFYZLASA-N 2 0 421.354 4.396 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3ccc(Br)cc32)C1 ZINC000541915103 939652712 /nfs/dbraw/zinc/65/27/12/939652712.db2.gz XYEKEPYSEHHFBS-IFMALSPDSA-N 2 0 415.375 4.183 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cccc(Br)c1 ZINC000541918048 939653863 /nfs/dbraw/zinc/65/38/63/939653863.db2.gz MBEGQWCUCWFSQK-HRAATJIYSA-N 2 0 403.364 4.257 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1cccc(Br)c1 ZINC000541918051 939653882 /nfs/dbraw/zinc/65/38/82/939653882.db2.gz MBEGQWCUCWFSQK-KKSFZXQISA-N 2 0 403.364 4.257 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1ccc(Br)c(F)c1 ZINC000541917410 939653903 /nfs/dbraw/zinc/65/39/03/939653903.db2.gz NAYBGZJTHWSGCX-RDTXWAMCSA-N 2 0 407.327 4.006 20 0 HIADRP CO[C@@H](c1ccc(Br)cc1)[C@H](C)[NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000542307738 939793790 /nfs/dbraw/zinc/79/37/90/939793790.db2.gz UBNFQRMWGHTOKD-MGPUTAFESA-N 2 0 415.335 4.204 20 0 HIADRP COc1ccc(CC[N@@H+](Cc2cn(-c3cc[nH+]cc3)nc2C)CC(C)C)cc1OC ZINC000542469309 939828209 /nfs/dbraw/zinc/82/82/09/939828209.db2.gz XTWQCDGHUFNKLK-UHFFFAOYSA-N 2 0 408.546 4.294 20 0 HIADRP C[C@H]([NH2+]C[C@H](O)Cn1c2ccccc2c2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000542534731 939839342 /nfs/dbraw/zinc/83/93/42/939839342.db2.gz WBXWXCOHYJEXMW-VWPQPMDRSA-N 2 0 405.586 4.398 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@@H](c3ccccc3)c3cncnc3)CC2)c1 ZINC000542670045 939853061 /nfs/dbraw/zinc/85/30/61/939853061.db2.gz BULADJLXWGDUML-SANMLTNESA-N 2 0 415.585 4.066 20 0 HIADRP CCCOc1ccc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)c(OCCC)c1 ZINC000542689526 939854422 /nfs/dbraw/zinc/85/44/22/939854422.db2.gz IHDCGAPGIZJXKB-UHFFFAOYSA-N 2 0 417.638 4.114 20 0 HIADRP CCCCCOc1cc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)ccc1OC ZINC000542691941 939854643 /nfs/dbraw/zinc/85/46/43/939854643.db2.gz YNXVLOMRBOBHHS-UHFFFAOYSA-N 2 0 417.638 4.114 20 0 HIADRP CCC1(C[NH2+][C@@H](C)CS(=O)(=O)c2ccccc2)CC[NH+](Cc2ccccc2)CC1 ZINC000542707139 939855711 /nfs/dbraw/zinc/85/57/11/939855711.db2.gz HUHHTIDHYHFISK-NRFANRHFSA-N 2 0 414.615 4.131 20 0 HIADRP CCC(CC)(CNC(=O)N(C)[C@@H](C)C1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000542748224 939858730 /nfs/dbraw/zinc/85/87/30/939858730.db2.gz FVZGUZDTJPSTCX-UXHICEINSA-N 2 0 402.627 4.268 20 0 HIADRP CCC(CC)(CNC(=O)N(C)[C@H](C)C1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000542748226 939858820 /nfs/dbraw/zinc/85/88/20/939858820.db2.gz FVZGUZDTJPSTCX-WOJBJXKFSA-N 2 0 402.627 4.268 20 0 HIADRP CCC1(CNC(=O)N(C)[C@H](C)C2CC[NH+](C)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000542757566 939859366 /nfs/dbraw/zinc/85/93/66/939859366.db2.gz UZBKJGFCYISJEP-OAQYLSRUSA-N 2 0 414.638 4.051 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)NCCC[NH+]2CCCC2)cc1)C[C@@H]1CCCCO1 ZINC000542891291 939865631 /nfs/dbraw/zinc/86/56/31/939865631.db2.gz VKIDJYSVXUIBCW-QHCPKHFHSA-N 2 0 416.610 4.074 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000543071637 939923321 /nfs/dbraw/zinc/92/33/21/939923321.db2.gz CFSIOMVALGTKKE-MRXNPFEDSA-N 2 0 422.411 4.410 20 0 HIADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000543073084 939925019 /nfs/dbraw/zinc/92/50/19/939925019.db2.gz VSFMSDRFEXBFAD-ZIAGYGMSSA-N 2 0 405.892 4.397 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2c[nH]c3ccc(Br)cc23)[C@H](C)C1 ZINC000543416750 940058561 /nfs/dbraw/zinc/05/85/61/940058561.db2.gz ZZQQNAOFEDFQIN-UZLBHIALSA-N 2 0 422.411 4.200 20 0 HIADRP C[C@H]1C[C@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000543420683 940059679 /nfs/dbraw/zinc/05/96/79/940059679.db2.gz BXIUUANKQURJJW-WIOPSUGQSA-N 2 0 419.613 4.458 20 0 HIADRP O=C(NCc1ccccc1)[C@H](Cc1ccccc1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000543769940 940181202 /nfs/dbraw/zinc/18/12/02/940181202.db2.gz NFYALUICAGZQON-SANMLTNESA-N 2 0 419.613 4.301 20 0 HIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000543776882 940183618 /nfs/dbraw/zinc/18/36/18/940183618.db2.gz PTIMNYZQOXWBIR-WZONZLPQSA-N 2 0 421.610 4.460 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NCc2ccccc2C[NH+]2CCCC2)CC1 ZINC000543911494 940239887 /nfs/dbraw/zinc/23/98/87/940239887.db2.gz NXYJKNNTZHJGFC-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000543998485 940291526 /nfs/dbraw/zinc/29/15/26/940291526.db2.gz LRSMYSQYOJSIPK-KBPBESRZSA-N 2 0 405.892 4.397 20 0 HIADRP COc1ccc(Oc2ccc(C[NH2+]C3CC[NH+]([C@H]4CCCC[C@H]4O)CC3)cc2)cc1 ZINC000544179816 940345191 /nfs/dbraw/zinc/34/51/91/940345191.db2.gz NFHHMQHAYKWJJJ-LOSJGSFVSA-N 2 0 410.558 4.345 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1)N1CC[NH+](C)CC1 ZINC000544366707 940403012 /nfs/dbraw/zinc/40/30/12/940403012.db2.gz TYOUQQNSJIXEFA-FTJBHMTQSA-N 2 0 420.576 4.325 20 0 HIADRP O=C(NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)Nc1cccc(C(F)F)c1Cl ZINC000544630065 940494158 /nfs/dbraw/zinc/49/41/58/940494158.db2.gz YLWDEUIFQQDXFU-UHFFFAOYSA-N 2 0 423.895 4.006 20 0 HIADRP C[NH+]1CCN(c2ncccc2C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)CC1 ZINC000563933985 945329387 /nfs/dbraw/zinc/32/93/87/945329387.db2.gz AUPAVUUKHQXCTR-XMMPIXPASA-N 2 0 404.533 4.046 20 0 HIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000564007404 945346180 /nfs/dbraw/zinc/34/61/80/945346180.db2.gz COULEEAFGMBIRI-QIGHUWCUSA-N 2 0 406.618 4.184 20 0 HIADRP C[NH+](C)CCOc1ccc(-c2noc(C3CC[NH+](Cc4ccccc4)CC3)n2)cc1 ZINC000546999943 940949092 /nfs/dbraw/zinc/94/90/92/940949092.db2.gz GFIAJXUWKKJXTF-UHFFFAOYSA-N 2 0 406.530 4.057 20 0 HIADRP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000547395943 941060437 /nfs/dbraw/zinc/06/04/37/941060437.db2.gz ZLQZYWVZYWBWAY-AVRDEDQJSA-N 2 0 405.508 4.215 20 0 HIADRP C[C@H]([NH2+]C[C@H](CO)Cc1c(F)cccc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548155677 941089300 /nfs/dbraw/zinc/08/93/00/941089300.db2.gz UGPTVXTVQGYDSK-SXLOBPIMSA-N 2 0 404.957 4.130 20 0 HIADRP C[C@H]([NH2+]C[C@@H](CO)Cc1c(F)cccc1Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548155676 941089533 /nfs/dbraw/zinc/08/95/33/941089533.db2.gz UGPTVXTVQGYDSK-IHPCNDPISA-N 2 0 404.957 4.130 20 0 HIADRP C[C@@H]1CC[N@H+](CCOc2ccc(NC(=O)c3ccc(C[NH+]4CCCC4)cc3)cc2)C1 ZINC000549060402 941150590 /nfs/dbraw/zinc/15/05/90/941150590.db2.gz LOFTZRBBXHEULE-HXUWFJFHSA-N 2 0 407.558 4.255 20 0 HIADRP Cc1cc2ncn(C[C@H](O)C[NH2+]Cc3ccc(C[N@H+]4CCC[C@@H](C)C4)cc3)c2cc1C ZINC000549192103 941170081 /nfs/dbraw/zinc/17/00/81/941170081.db2.gz SJGYWFIOLRQOHI-NTKDMRAZSA-N 2 0 420.601 4.036 20 0 HIADRP CC[C@@H](C(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[NH+](CC)CC ZINC000549617557 941201483 /nfs/dbraw/zinc/20/14/83/941201483.db2.gz UQTVJCVIZVTKPU-IGMZMZPDSA-N 2 0 406.014 4.491 20 0 HIADRP O=C(NCCC[NH+](Cc1ccccc1)Cc1ccccc1)C1CC[NH+](C2CC2)CC1 ZINC000549707013 941205272 /nfs/dbraw/zinc/20/52/72/941205272.db2.gz UZBADXAAQGWQED-UHFFFAOYSA-N 2 0 405.586 4.070 20 0 HIADRP c1cc(-c2n[nH]cc2C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cs1 ZINC000550263025 941305757 /nfs/dbraw/zinc/30/57/57/941305757.db2.gz SPTFYGLKNDTGPV-JOCHJYFZSA-N 2 0 422.598 4.157 20 0 HIADRP CCS(=O)(=O)c1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC000550421497 941324573 /nfs/dbraw/zinc/32/45/73/941324573.db2.gz DCTZZQSZIHNVDS-LJQANCHMSA-N 2 0 400.588 4.317 20 0 HIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000551263858 941438742 /nfs/dbraw/zinc/43/87/42/941438742.db2.gz VDEJSEYYTAQTHG-GBXCKJPGSA-N 2 0 421.585 4.224 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3Cc4[nH]c5ccccc5c4C3)C3(C2)CCOCC3)cc1 ZINC000551265279 941439249 /nfs/dbraw/zinc/43/92/49/941439249.db2.gz RYJODZFGTPRSNS-VXKWHMMOSA-N 2 0 415.581 4.154 20 0 HIADRP COC1CCN(C(C)(C)C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000552043513 941572647 /nfs/dbraw/zinc/57/26/47/941572647.db2.gz PZAMOGKJTXLABX-ZKMPZPQNSA-N 2 0 413.650 4.156 20 0 HIADRP c1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4ccccc4N4CCOCC4)C3)CC2)cc1 ZINC000552273013 941619719 /nfs/dbraw/zinc/61/97/19/941619719.db2.gz NBROGQQOOGKDDD-UHFFFAOYSA-N 2 0 405.586 4.011 20 0 HIADRP c1nn(Cc2ccccc2)cc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000552273777 941619791 /nfs/dbraw/zinc/61/97/91/941619791.db2.gz RVSMIIHQDQEJDW-UHFFFAOYSA-N 2 0 400.570 4.420 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000552273404 941619804 /nfs/dbraw/zinc/61/98/04/941619804.db2.gz IRQDSRZGVSZWLB-UHFFFAOYSA-N 3 0 401.558 4.064 20 0 HIADRP O=C([C@H]1CCC[N@H+](Cc2ccccc2)C1)N1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000553124560 941836253 /nfs/dbraw/zinc/83/62/53/941836253.db2.gz ONKGHWRJTVJPMV-AHKZPQOWSA-N 2 0 417.597 4.023 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1)C1CC1 ZINC000553173537 941844590 /nfs/dbraw/zinc/84/45/90/941844590.db2.gz OUHXIJBMAFUPEA-HHHXNRCGSA-N 2 0 417.597 4.409 20 0 HIADRP CCCN(CC[NH+]1CCCCC1)C(=O)Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC000554183465 942060713 /nfs/dbraw/zinc/06/07/13/942060713.db2.gz XSYUTWUNLPJWLT-UHFFFAOYSA-N 2 0 418.651 4.008 20 0 HIADRP CCC[N@H+](C)[C@H](CNC(=O)N1CC[C@@H](C2CC[NH+](C)CC2)C1)c1ccc(Cl)cc1 ZINC000554251271 942079106 /nfs/dbraw/zinc/07/91/06/942079106.db2.gz NFZRHUHTIAXRDH-IFMALSPDSA-N 2 0 421.029 4.096 20 0 HIADRP C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1C[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC000554961105 942335248 /nfs/dbraw/zinc/33/52/48/942335248.db2.gz SHLQOFJWVPDPFP-YPIGPJMWSA-N 2 0 423.626 4.254 20 0 HIADRP CCCOc1cccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000555612694 942669459 /nfs/dbraw/zinc/66/94/59/942669459.db2.gz ZYOVLRCIVNHYFJ-XMMPIXPASA-N 2 0 408.586 4.494 20 0 HIADRP Cc1cccc([C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C(=O)N(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000556317121 942839837 /nfs/dbraw/zinc/83/98/37/942839837.db2.gz MVUUTXNATKSWNZ-MRLUPLGUSA-N 2 0 419.613 4.152 20 0 HIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]Cc3ccc(OC[C@@H]4CCCO4)cc3)cc2)CC1 ZINC000556405995 942858232 /nfs/dbraw/zinc/85/82/32/942858232.db2.gz JYZVODGOSCTROG-VWLOTQADSA-N 2 0 410.558 4.007 20 0 HIADRP Cc1cc(NC(=O)c2ccc3c[nH+]cn3c2)cc(C)c1NC(=O)c1ccc2c[nH+]cn2c1 ZINC000556438678 942867335 /nfs/dbraw/zinc/86/73/35/942867335.db2.gz ITNAUEQYNCCIHP-UHFFFAOYSA-N 2 0 424.464 4.103 20 0 HIADRP Cn1c2ccc(C[N@@H+]3CCC4(C3)CC[NH+](Cc3ccccc3)CC4)cc2sc1=O ZINC000556882665 942950172 /nfs/dbraw/zinc/95/01/72/942950172.db2.gz BQGIWQHQGWWZDF-UHFFFAOYSA-N 2 0 407.583 4.088 20 0 HIADRP COc1ccc(Br)c(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000557262661 943063340 /nfs/dbraw/zinc/06/33/40/943063340.db2.gz NKBWWXUVGIWYLA-HNNXBMFYSA-N 2 0 407.352 4.249 20 0 HIADRP Cc1c([C@H](C)[NH2+]CCCCC[NH+]2CCCC2)nnn1-c1cccc(Br)c1 ZINC000557330025 943072608 /nfs/dbraw/zinc/07/26/08/943072608.db2.gz MJZHNTDNFTWESZ-INIZCTEOSA-N 2 0 420.399 4.255 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](CCC(=O)Nc2cccc(Br)c2)CC1 ZINC000557514613 943182742 /nfs/dbraw/zinc/18/27/42/943182742.db2.gz MKWFGZYBMKSDCV-UHFFFAOYSA-N 2 0 410.400 4.222 20 0 HIADRP C[NH+](C)CCOc1cnccc1C[NH2+][C@H]1CCc2c1cc(Br)cc2Cl ZINC000558164465 943405883 /nfs/dbraw/zinc/40/58/83/943405883.db2.gz CKUPCSCWXIQQOR-SFHVURJKSA-N 2 0 424.770 4.215 20 0 HIADRP CCc1nc(CN2CCC(C[NH2+]Cc3ccc(C)cc3-c3ccnn3C)CC2)cs1 ZINC000558779190 943659580 /nfs/dbraw/zinc/65/95/80/943659580.db2.gz IOZKAIPZFOXZDC-UHFFFAOYSA-N 2 0 423.630 4.416 20 0 HIADRP CC1CC[NH+](CCC[C@H]([NH2+]CCC(=O)N2CCCCC2)c2ccc(F)cc2)CC1 ZINC000559921525 944085832 /nfs/dbraw/zinc/08/58/32/944085832.db2.gz LATRVUUZQWCASV-QHCPKHFHSA-N 2 0 403.586 4.371 20 0 HIADRP COc1ccc(Br)cc1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000560094561 944157399 /nfs/dbraw/zinc/15/73/99/944157399.db2.gz FQLGKTIPXIBYEA-UHFFFAOYSA-N 2 0 419.363 4.221 20 0 HIADRP Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CCC1(F)F ZINC000560535187 944245801 /nfs/dbraw/zinc/24/58/01/944245801.db2.gz WSXFQAXXKHHQGJ-FQEVSTJZSA-N 2 0 401.501 4.153 20 0 HIADRP O=C1c2ccccc2C(=O)N1[C@H]1CCCC[C@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000560912289 944368732 /nfs/dbraw/zinc/36/87/32/944368732.db2.gz ZCIKEIIGWVGGSI-VXKWHMMOSA-N 2 0 423.601 4.228 20 0 HIADRP C[NH+](C)[C@@H](CNc1cncc(NC[C@H](c2ccsc2)[NH+](C)C)n1)c1ccsc1 ZINC000561143458 944479787 /nfs/dbraw/zinc/47/97/87/944479787.db2.gz TYBKGFNWHQCTST-HDICACEKSA-N 2 0 416.620 4.029 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[NH2+][C@@H](c2ccccc2C)C2CC2)CC1 ZINC000561402337 944581076 /nfs/dbraw/zinc/58/10/76/944581076.db2.gz MMSRMGVKVHMURH-AREMUKBSSA-N 2 0 405.586 4.125 20 0 HIADRP Cc1cccn2cc(COc3ccc(C[N@@H+](C)C4C[C@H]5CC[C@@H](C4)[NH+]5C)cc3)nc12 ZINC000561974374 944883260 /nfs/dbraw/zinc/88/32/60/944883260.db2.gz VYWKYLAPYBWJAT-AIZNXBIQSA-N 2 0 404.558 4.279 20 0 HIADRP CSc1ccccc1NC(=O)CC[N@@H+]1C[C@@H]2CC[NH+](Cc3ccccc3)C[C@H]2C1 ZINC000562061172 944918163 /nfs/dbraw/zinc/91/81/63/944918163.db2.gz GCANIDHZRKMRTD-SFTDATJTSA-N 2 0 409.599 4.191 20 0 HIADRP Cc1cccc(C)c1[C@@H](C)NC(=O)N(C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000562164497 944991191 /nfs/dbraw/zinc/99/11/91/944991191.db2.gz BZXCGXXDHLIDDO-OAQYLSRUSA-N 2 0 414.638 4.202 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+][C@H]3CCN(C)[C@@H](c4ccccc4)C3)CC2)c1 ZINC000564474770 945606329 /nfs/dbraw/zinc/60/63/29/945606329.db2.gz SQYYMEVDFOPKPV-AHKZPQOWSA-N 2 0 420.645 4.322 20 0 HIADRP Fc1cc(Cl)cc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000565612151 945854715 /nfs/dbraw/zinc/85/47/15/945854715.db2.gz GOMPGLVMPFWVNG-FQEVSTJZSA-N 2 0 402.941 4.498 20 0 HIADRP C[N@@H+]1CCC[C@]2(CC[NH+](CCC(=O)Nc3ccc(OCc4ccccc4)cc3)C2)C1 ZINC000565822422 945890598 /nfs/dbraw/zinc/89/05/98/945890598.db2.gz VFTDVRTWFAZQSF-VWLOTQADSA-N 2 0 407.558 4.012 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000566996702 946207876 /nfs/dbraw/zinc/20/78/76/946207876.db2.gz LLJVFOMKMYDOOB-JXFKEZNVSA-N 2 0 420.395 4.134 20 0 HIADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)N(Cc1ccncc1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000567056453 946228215 /nfs/dbraw/zinc/22/82/15/946228215.db2.gz DQGMNVZKZSBKPM-URXFXBBRSA-N 2 0 422.617 4.242 20 0 HIADRP O=C(CC[NH2+]Cc1ccc(-n2ccnc2)c(F)c1)Nc1cccc(C(F)(F)F)c1 ZINC000567179387 946261397 /nfs/dbraw/zinc/26/13/97/946261397.db2.gz WBUUUUMDSLGSOG-UHFFFAOYSA-N 2 0 406.383 4.149 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000567495770 946350265 /nfs/dbraw/zinc/35/02/65/946350265.db2.gz XBQGTZVQUIBZAI-UHFFFAOYSA-N 2 0 415.585 4.372 20 0 HIADRP COCC(=O)Nc1cccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000567495543 946351055 /nfs/dbraw/zinc/35/10/55/946351055.db2.gz LHIQKXZWBBLHMC-QLBJFCOMSA-N 2 0 421.585 4.052 20 0 HIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000568132259 946474700 /nfs/dbraw/zinc/47/47/00/946474700.db2.gz RPVPSJIICVPVLL-SFQUDFHCSA-N 2 0 419.491 4.190 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000568494509 946571947 /nfs/dbraw/zinc/57/19/47/946571947.db2.gz PIYVHYGJSUMSGH-GBXCKJPGSA-N 2 0 408.590 4.432 20 0 HIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000569395728 946866301 /nfs/dbraw/zinc/86/63/01/946866301.db2.gz HPIAETFUKUJFSD-ZAVKOYKVSA-N 2 0 416.512 4.438 20 0 HIADRP CC(C)(C)[C@H](CN1CCc2ccccc2C1)[NH2+]C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000569711678 946950960 /nfs/dbraw/zinc/95/09/60/946950960.db2.gz KGGDURHGKGMCQZ-BWKNWUBXSA-N 2 0 419.613 4.211 20 0 HIADRP C[C@@H]([NH2+]C1CCN(CCc2ccc(F)cc2)CC1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000569729801 946956392 /nfs/dbraw/zinc/95/63/92/946956392.db2.gz SWMAMRLMYLPMTK-GOSISDBHSA-N 2 0 424.564 4.467 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@H+]2C[C@H](c3ccc(F)cc3)C[C@@H]2C)CC1 ZINC000570949334 947395574 /nfs/dbraw/zinc/39/55/74/947395574.db2.gz DSJMHDYSTDZAEL-NZQKXSOJSA-N 2 0 423.576 4.093 20 0 HIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000572439182 947904942 /nfs/dbraw/zinc/90/49/42/947904942.db2.gz OJEOEVHOBFOJKT-GHRIWEEISA-N 2 0 404.480 4.045 20 0 HIADRP c1ccc(C[N@@H+]2CCc3nc(N4CC[C@]5(C[NH2+]C[C@@H]5c5ccccc5)C4)ccc3C2)cc1 ZINC001164618372 719045345 /nfs/dbraw/zinc/04/53/45/719045345.db2.gz AVVPIFMNMMODOK-NAKRPHOHSA-N 2 0 424.592 4.223 20 0 HIADRP C[NH+]1CCC(Oc2cc[nH+]c(N3CC[C@@H](OCC4CC4)[C@@H]3Cc3ccccc3)c2)CC1 ZINC001165006232 722272060 /nfs/dbraw/zinc/27/20/60/722272060.db2.gz MFZATZKQXZVMNO-LOSJGSFVSA-N 2 0 421.585 4.171 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000031149165 847831026 /nfs/dbraw/zinc/83/10/26/847831026.db2.gz NSOYSYZQGAHWQE-UHFFFAOYSA-N 2 0 422.617 4.035 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)cc1O ZINC000042230061 848305802 /nfs/dbraw/zinc/30/58/02/848305802.db2.gz XSTHVCIEKPDCOC-UHFFFAOYSA-N 2 0 417.553 4.013 20 0 HIADRP C[N@@H+]1CCCN(c2ccc(NC(=O)c3ccc(C[NH+]4CCCCC4)cc3)cc2)CC1 ZINC000046404009 848842744 /nfs/dbraw/zinc/84/27/44/848842744.db2.gz ZWCBZWGQCNZFQO-UHFFFAOYSA-N 2 0 406.574 4.067 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NCc2ccccc2C[NH+]2CCCC2)cc1 ZINC000054092949 849809493 /nfs/dbraw/zinc/80/94/93/849809493.db2.gz FKTBDZRHHQMREE-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)CC1 ZINC000056763964 850470845 /nfs/dbraw/zinc/47/08/45/850470845.db2.gz IJOCHDKHDFTYHK-UHFFFAOYSA-N 2 0 400.611 4.299 20 0 HIADRP O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)Nc1ccc(CC[NH+]2CCCCC2)cc1 ZINC000056764412 850472240 /nfs/dbraw/zinc/47/22/40/850472240.db2.gz AXTYADVFPXJXMQ-JOCHJYFZSA-N 2 0 410.562 4.267 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N2CCC[N@H+](CCCc3ccccc3)CC2)cc1 ZINC000060355319 851075769 /nfs/dbraw/zinc/07/57/69/851075769.db2.gz CIFRFGJORRQVOM-UHFFFAOYSA-N 2 0 407.602 4.309 20 0 HIADRP O=C([C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccc1)N1CCCCC1 ZINC000060926380 851249487 /nfs/dbraw/zinc/24/94/87/851249487.db2.gz ZRJVXSCXQNZZAZ-HSZRJFAPSA-N 2 0 411.615 4.304 20 0 HIADRP COc1cc(C[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)cc2c1OCCO2 ZINC000061000050 851270163 /nfs/dbraw/zinc/27/01/63/851270163.db2.gz CFJAIKHHMFGURJ-OALUTQOASA-N 2 0 410.558 4.234 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)NCC(C)(C)[NH+]2CCCCC2)cc1 ZINC000061185659 851312191 /nfs/dbraw/zinc/31/21/91/851312191.db2.gz MTBDVHONWIZNDL-UHFFFAOYSA-N 2 0 422.617 4.479 20 0 HIADRP CN(c1ccc(NC(=O)c2cccc(C[NH+]3CCCC3)c2)cc1)C1CC[NH+](C)CC1 ZINC000064026886 851817641 /nfs/dbraw/zinc/81/76/41/851817641.db2.gz QCNRIVYGOZHZFW-UHFFFAOYSA-N 2 0 406.574 4.065 20 0 HIADRP C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C1 ZINC000065549349 852174161 /nfs/dbraw/zinc/17/41/61/852174161.db2.gz IKIREFVMCXUDGX-SFHVURJKSA-N 2 0 421.029 4.114 20 0 HIADRP O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000065892641 852306454 /nfs/dbraw/zinc/30/64/54/852306454.db2.gz VDXGLSFDWPXGAP-JOCHJYFZSA-N 2 0 409.549 4.315 20 0 HIADRP CC1CC[NH+](CCCC[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)CC1 ZINC000065931935 852321676 /nfs/dbraw/zinc/32/16/76/852321676.db2.gz LEDQYNDJCIVJLL-UHFFFAOYSA-N 2 0 411.384 4.212 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)cc1 ZINC000071816172 852411712 /nfs/dbraw/zinc/41/17/12/852411712.db2.gz QPVTXDIBSMAUCW-DEOSSOPVSA-N 2 0 408.590 4.165 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)c1oc2ccccc2c1C[NH+](C)C)c1cccc(OC)c1 ZINC000079308733 852541728 /nfs/dbraw/zinc/54/17/28/852541728.db2.gz FNUDHXCQJOGJPQ-QFIPXVFZSA-N 2 0 423.557 4.316 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)cc1F ZINC000097287830 852597441 /nfs/dbraw/zinc/59/74/41/852597441.db2.gz MGBZUZOSIHLFOO-UHFFFAOYSA-N 2 0 419.544 4.446 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C(=O)NC2CC[NH+](CC3CCCCC3)CC2)cc1 ZINC000116070216 853281440 /nfs/dbraw/zinc/28/14/40/853281440.db2.gz ITCWEATYXKDSPV-UHFFFAOYSA-N 2 0 415.622 4.182 20 0 HIADRP COc1c(Br)cc(Br)cc1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000134404957 853372379 /nfs/dbraw/zinc/37/23/79/853372379.db2.gz GOHDMJLCGRGCKC-UHFFFAOYSA-N 2 0 420.189 4.042 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnc3ccc(Br)cn23)c1 ZINC000236668443 853909343 /nfs/dbraw/zinc/90/93/43/853909343.db2.gz HGRGQSJTEQYPDU-UHFFFAOYSA-N 2 0 401.352 4.227 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc(OCC(F)(F)F)c2)CC1 ZINC000236803268 853924441 /nfs/dbraw/zinc/92/44/41/853924441.db2.gz UYGMQMBVLUDMPR-UHFFFAOYSA-N 2 0 421.507 4.450 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cc3ccccc3[nH]c2=O)CC1 ZINC000236852747 853928787 /nfs/dbraw/zinc/92/87/87/853928787.db2.gz DOVNOHRDVBTMJK-KRWDZBQOSA-N 2 0 408.521 4.072 20 0 HIADRP COc1cc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)ccc1OC(C)C ZINC000237216002 853984203 /nfs/dbraw/zinc/98/42/03/853984203.db2.gz ZKWOQCNSRJIMIY-PMACEKPBSA-N 2 0 412.574 4.381 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cnn(-c3ccc(Cl)cc3)c2)C[C@@H](C)O1 ZINC000237575549 854057131 /nfs/dbraw/zinc/05/71/31/854057131.db2.gz DQJZBABNLLZWSZ-RTBURBONSA-N 2 0 424.976 4.425 20 0 HIADRP Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000237608817 854061606 /nfs/dbraw/zinc/06/16/06/854061606.db2.gz HSXNDHMQCLMSLG-HDICACEKSA-N 2 0 419.013 4.181 20 0 HIADRP C[C@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2cccc(Br)c2)C[C@H](C)O1 ZINC000237622903 854063976 /nfs/dbraw/zinc/06/39/76/854063976.db2.gz HALZADLTUNSYOB-IRXDYDNUSA-N 2 0 403.364 4.348 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2cc(Br)ccc2OC(F)F)C[C@H](C)O1 ZINC000237667486 854072312 /nfs/dbraw/zinc/07/23/12/854072312.db2.gz RMFDVTDDXWKEOU-OKILXGFUSA-N 2 0 421.326 4.030 20 0 HIADRP Cc1nn(-c2ccccc2)cc1C[NH2+]Cc1ccccc1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000237778700 854095837 /nfs/dbraw/zinc/09/58/37/854095837.db2.gz ATRDFPMDHNVDMW-BGYRXZFFSA-N 2 0 404.558 4.080 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+]Cc3ccc(-c4ccccc4)s3)c2)C1 ZINC000237923823 854120026 /nfs/dbraw/zinc/12/00/26/854120026.db2.gz FYTHAXOWSHUGRG-JOCHJYFZSA-N 2 0 419.594 4.402 20 0 HIADRP CC(C)(C)OC(=O)N1CCC[C@@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000309689649 855363059 /nfs/dbraw/zinc/36/30/59/855363059.db2.gz CNGZEEIKEJVHPZ-FCHUYYIVSA-N 2 0 401.595 4.278 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309906947 855365397 /nfs/dbraw/zinc/36/53/97/855365397.db2.gz KRSAUYKAOCEPRC-BDKRGJGYSA-N 2 0 401.595 4.323 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309906949 855365410 /nfs/dbraw/zinc/36/54/10/855365410.db2.gz KRSAUYKAOCEPRC-UVUJQTEASA-N 2 0 401.595 4.323 20 0 HIADRP C[C@H]([NH2+]C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381779477 855431707 /nfs/dbraw/zinc/43/17/07/855431707.db2.gz YKNOPYYLGAHRPP-NNWRFLSQSA-N 2 0 401.595 4.134 20 0 HIADRP CC(C)(C)OC(=O)N1CCC([NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000381894834 855432740 /nfs/dbraw/zinc/43/27/40/855432740.db2.gz FTIBEFFBAAGRRV-OAQYLSRUSA-N 2 0 401.595 4.278 20 0 HIADRP CC(C)(C)OC(=O)N1CCC([NH2+][C@@H]2CCN(Cc3ccccc3)CC2(C)C)CC1 ZINC000390721468 855456490 /nfs/dbraw/zinc/45/64/90/855456490.db2.gz ZKURPAJWIGIALJ-OAQYLSRUSA-N 2 0 401.595 4.276 20 0 HIADRP OC1(C[NH2+][C@@H]2CCc3c2cccc3Br)CC[NH+](Cc2ccccc2)CC1 ZINC000397627960 855472915 /nfs/dbraw/zinc/47/29/15/855472915.db2.gz YTXUMZRLXNIPBU-OAQYLSRUSA-N 2 0 415.375 4.053 20 0 HIADRP OC1(C[NH2+][C@@H]2CCc3cc(Br)ccc32)CC[NH+](Cc2ccccc2)CC1 ZINC000397620315 855472951 /nfs/dbraw/zinc/47/29/51/855472951.db2.gz VYLXRYPYECLZOT-OAQYLSRUSA-N 2 0 415.375 4.053 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000398045427 855474891 /nfs/dbraw/zinc/47/48/91/855474891.db2.gz VLLTXPSIHNMLNS-CEMLEFRQSA-N 2 0 401.595 4.134 20 0 HIADRP CC(C)(C)[C@H](C[N@@H+]1CCc2ccccc2C1)NC(=O)c1ccc(-n2ccnc2)cc1 ZINC000410109798 855824364 /nfs/dbraw/zinc/82/43/64/855824364.db2.gz YVOVBGCYEGDGSO-QHCPKHFHSA-N 2 0 402.542 4.075 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000410316290 855924784 /nfs/dbraw/zinc/92/47/84/855924784.db2.gz ZPRNQCLGFKKBCA-UHFFFAOYSA-N 2 0 420.601 4.055 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC1 ZINC000410333526 855934510 /nfs/dbraw/zinc/93/45/10/855934510.db2.gz SCJVPNKIDVAQPB-UHFFFAOYSA-N 2 0 420.601 4.055 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCCNC(=O)NCc2ccc(C[NH+]3CCC[C@H](C)C3)cc2)C1 ZINC000410357904 855948038 /nfs/dbraw/zinc/94/80/38/855948038.db2.gz GLNFJVYNMUOCJT-YADHBBJMSA-N 2 0 414.638 4.230 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=O)NCCC[NH2+]C3CCCCC3)cc2)C1 ZINC000410365757 855954020 /nfs/dbraw/zinc/95/40/20/855954020.db2.gz KLSVMQGNWHGCMP-HXUWFJFHSA-N 2 0 400.611 4.030 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@H](c1cccs1)[NH+](C)C ZINC000410365716 855954203 /nfs/dbraw/zinc/95/42/03/855954203.db2.gz KIOLKYWQGJCSLO-WIYYLYMNSA-N 2 0 414.619 4.225 20 0 HIADRP C[C@@H]1CCCC[NH+]1Cc1ccccc1CNC(=O)NCCCC[N@H+]1CCC[C@H](C)C1 ZINC000410372529 855957860 /nfs/dbraw/zinc/95/78/60/855957860.db2.gz OHGYXUOZQQSRGU-FCHUYYIVSA-N 2 0 414.638 4.372 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)NCCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000410382957 855964229 /nfs/dbraw/zinc/96/42/29/855964229.db2.gz MRSLEERQDVJBEX-SFTDATJTSA-N 2 0 402.627 4.084 20 0 HIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCc2ncc(C(F)(F)F)cc21 ZINC000427847277 856980027 /nfs/dbraw/zinc/98/00/27/856980027.db2.gz JVJAQBKNVNBYFJ-CTNGQTDRSA-N 2 0 419.491 4.224 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)NCC1CC[NH+](C2CC2)CC1)C1CCCCC1 ZINC000428635654 857284711 /nfs/dbraw/zinc/28/47/11/857284711.db2.gz HCOFUCKXDGSZHK-UHFFFAOYSA-N 2 0 412.622 4.125 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)N[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000428653479 857290042 /nfs/dbraw/zinc/29/00/42/857290042.db2.gz WTZCTBXFYULHFV-GBAAUQCPSA-N 2 0 414.638 4.097 20 0 HIADRP c1cc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)ccc1C[NH+]1CCOC[C@@H](C2CCC2)C1 ZINC000429030747 857466176 /nfs/dbraw/zinc/46/61/76/857466176.db2.gz SOEYEAZYQQHYLT-WMPKNSHKSA-N 2 0 412.618 4.184 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429422407 857657513 /nfs/dbraw/zinc/65/75/13/857657513.db2.gz XCMKEXLVKMGSPT-AHWVRZQESA-N 2 0 404.529 4.466 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H](Cc3ccccc3F)c3ccccc3)ccn2)CC1 ZINC000429518205 857713019 /nfs/dbraw/zinc/71/30/19/857713019.db2.gz IEEFXSDIWGDYQO-DEOSSOPVSA-N 2 0 404.533 4.046 20 0 HIADRP COc1ccccc1-n1nccc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000430017415 857999591 /nfs/dbraw/zinc/99/95/91/857999591.db2.gz ACWCDNOSHUZZLO-HXUWFJFHSA-N 2 0 404.558 4.403 20 0 HIADRP C[C@H]1C[C@H](NC(=O)C2CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000430620735 858238620 /nfs/dbraw/zinc/23/86/20/858238620.db2.gz BQAXPVZAGMTFGU-SQJMNOBHSA-N 2 0 405.586 4.068 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)[C@H]2CCC[NH+](Cc3cccc(F)c3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000431316309 858560293 /nfs/dbraw/zinc/56/02/93/858560293.db2.gz CIKHQUSLXCFKBJ-JHMXWDHMSA-N 2 0 423.576 4.207 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)N[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000431677857 858733137 /nfs/dbraw/zinc/73/31/37/858733137.db2.gz FPIYIDGZXIACFF-URXFXBBRSA-N 2 0 414.638 4.193 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433077572 859511896 /nfs/dbraw/zinc/51/18/96/859511896.db2.gz ORJHTAUXDCGILV-ZJSXRUAMSA-N 2 0 405.586 4.035 20 0 HIADRP CCOc1ccccc1NC(=O)[C@@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433192226 859560318 /nfs/dbraw/zinc/56/03/18/859560318.db2.gz KERCFRDEKJGLHM-OAQYLSRUSA-N 2 0 421.585 4.400 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3ncc(C(F)(F)F)s3)CC2)c1 ZINC000433330381 859646813 /nfs/dbraw/zinc/64/68/13/859646813.db2.gz JFEOZILRRBXMJE-UHFFFAOYSA-N 2 0 412.525 4.162 20 0 HIADRP C[NH+](C)[C@@H](CC(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccccc1 ZINC000433350477 859657817 /nfs/dbraw/zinc/65/78/17/859657817.db2.gz FSNNRBVSMSCDSF-QHCPKHFHSA-N 2 0 413.993 4.361 20 0 HIADRP C[C@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[N@@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000434898589 860543574 /nfs/dbraw/zinc/54/35/74/860543574.db2.gz VZAWTQQWPHAQKG-BKSPAHHJSA-N 2 0 405.586 4.034 20 0 HIADRP CCSc1ccc(Cl)cc1NC(=O)N(CC[NH+](C)C)C[C@@H]1CCC[N@@H+]1CC ZINC000438044070 863403932 /nfs/dbraw/zinc/40/39/32/863403932.db2.gz YAENFYKPUZJGPE-KRWDZBQOSA-N 2 0 413.031 4.332 20 0 HIADRP COc1cc(NC(C)=O)ccc1[C@H](C)N[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000439002768 864456985 /nfs/dbraw/zinc/45/69/85/864456985.db2.gz ZMJRYMQXBMXBND-WKGYELDXSA-N 2 0 409.574 4.461 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H](c2ccc(Br)s2)C2CC2)C[C@H](C)O1 ZINC000439139677 864571943 /nfs/dbraw/zinc/57/19/43/864571943.db2.gz YOEWFJPVUNXZLC-QWQRMKEZSA-N 2 0 401.414 4.441 20 0 HIADRP c1ccc(C[NH+]2CCC([C@@H]3CCCO3)CC2)c(C[NH+]2CCC([C@@H]3CCCO3)CC2)c1 ZINC000439273981 864692525 /nfs/dbraw/zinc/69/25/25/864692525.db2.gz NMLRNMFSRPYRSX-UIOOFZCWSA-N 2 0 412.618 4.469 20 0 HIADRP c1cc(C[NH+]2CCC([C@@H]3CCCO3)CC2)cc(C[NH+]2CCC([C@@H]3CCCO3)CC2)c1 ZINC000439297632 864723946 /nfs/dbraw/zinc/72/39/46/864723946.db2.gz SNORHSBIQAIMEL-UIOOFZCWSA-N 2 0 412.618 4.469 20 0 HIADRP CCN(C(=O)[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccccc1 ZINC000439594767 864917359 /nfs/dbraw/zinc/91/73/59/864917359.db2.gz KQRKIRCELYMDMC-HXUWFJFHSA-N 2 0 405.542 4.443 20 0 HIADRP CC(C)C[C@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000468016078 881854065 /nfs/dbraw/zinc/85/40/65/881854065.db2.gz HRAQGPCXKHRPSR-DENIHFKCSA-N 2 0 402.627 4.314 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000468037924 881867407 /nfs/dbraw/zinc/86/74/07/881867407.db2.gz OHBSORIERKNBAA-UHFFFAOYSA-N 2 0 405.542 4.136 20 0 HIADRP Cc1ccc(NC2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)cc1NC(=O)CC[NH+](C)C ZINC000468041851 881870569 /nfs/dbraw/zinc/87/05/69/881870569.db2.gz ZGKQREVTTWHHNZ-AVRDEDQJSA-N 2 0 400.611 4.340 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CCC[NH+]1Cc1ccccc1 ZINC000440528061 865804875 /nfs/dbraw/zinc/80/48/75/865804875.db2.gz ATZBWVVLYCNPQD-RPBOFIJWSA-N 2 0 405.586 4.022 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2CCCCOc1ccccc1C(F)(F)F ZINC000441188408 866260816 /nfs/dbraw/zinc/26/08/16/866260816.db2.gz KISKDRSLQPZLTB-KPFFTGBYSA-N 2 0 400.485 4.048 20 0 HIADRP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2CC[C@@H](C)[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000441273069 866347811 /nfs/dbraw/zinc/34/78/11/866347811.db2.gz WEBHVOOTVIQANF-IERDGZPVSA-N 2 0 411.512 4.077 20 0 HIADRP Cc1ccc([C@@H](Cn2ccnc2)NC(=O)c2cccc(C[NH+]3CCCC3)c2)c(C)c1 ZINC000442187629 867209997 /nfs/dbraw/zinc/20/99/97/867209997.db2.gz KSASPTVJPJRHCM-XMMPIXPASA-N 2 0 402.542 4.267 20 0 HIADRP C[N@@H+]1CCN(CC[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1(C)C ZINC000442872463 867706460 /nfs/dbraw/zinc/70/64/60/867706460.db2.gz JNSBFJALFZPJSN-SFHVURJKSA-N 2 0 419.038 4.457 20 0 HIADRP C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443602542 868160641 /nfs/dbraw/zinc/16/06/41/868160641.db2.gz PNZURUTWGMXPQS-TZIWHRDSSA-N 2 0 403.636 4.388 20 0 HIADRP Cc1cc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)nc(-c2ccc(Cl)cc2)n1 ZINC000443614251 868180285 /nfs/dbraw/zinc/18/02/85/868180285.db2.gz FXOULIFNJKJUSL-UHFFFAOYSA-N 2 0 414.981 4.182 20 0 HIADRP CC[NH+](CC)CCCNC(=O)C1CC[NH+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC000444601744 868897846 /nfs/dbraw/zinc/89/78/46/868897846.db2.gz ZLYJXUWTLZFYJM-UHFFFAOYSA-N 2 0 413.631 4.475 20 0 HIADRP CCC[C@H]1CN(C(=O)Nc2ccccc2CC[NH+](C)C)CC[N@@H+]1Cc1ccccc1 ZINC000446579284 870489550 /nfs/dbraw/zinc/48/95/50/870489550.db2.gz BMTQQVXPHGOYNF-QHCPKHFHSA-N 2 0 408.590 4.309 20 0 HIADRP CCN(C(=O)Nc1ccccc1CC[NH+](C)C)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000446588198 870496046 /nfs/dbraw/zinc/49/60/46/870496046.db2.gz YGZUJPLAGAPEFX-REWPJTCUSA-N 2 0 408.590 4.480 20 0 HIADRP CC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccc(Br)cc1Cl ZINC000446816201 870730182 /nfs/dbraw/zinc/73/01/82/870730182.db2.gz AIEZUCLHKIAPEG-KDOFPFPSSA-N 2 0 402.808 4.027 20 0 HIADRP CC[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccc(Br)cc1Cl ZINC000446816200 870730695 /nfs/dbraw/zinc/73/06/95/870730695.db2.gz AIEZUCLHKIAPEG-KBXCAEBGSA-N 2 0 402.808 4.027 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(Br)cc1F ZINC000446832145 870747591 /nfs/dbraw/zinc/74/75/91/870747591.db2.gz MNTCVRCEPOYVPP-HNNXBMFYSA-N 2 0 421.354 4.396 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)CCCS2 ZINC000446915281 870831529 /nfs/dbraw/zinc/83/15/29/870831529.db2.gz UMHGHWBIIAXMGG-NFBKMPQASA-N 2 0 412.599 4.369 20 0 HIADRP C[NH+](C)CCNC(=O)c1cccc(C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)c1 ZINC000447534815 871400002 /nfs/dbraw/zinc/40/00/02/871400002.db2.gz AESBXRWVPWJMJR-VWLOTQADSA-N 2 0 419.544 4.191 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(OCc2cn3ccccc3n2)c1 ZINC000447554842 871436823 /nfs/dbraw/zinc/43/68/23/871436823.db2.gz ZOZVVMGMECPVGN-LJQANCHMSA-N 2 0 404.558 4.438 20 0 HIADRP O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000448221102 872129846 /nfs/dbraw/zinc/12/98/46/872129846.db2.gz WCCLPDYQMJRUGH-ILBGXUMGSA-N 2 0 424.633 4.221 20 0 HIADRP Cc1ccc(N[C@H]2C[C@H](C)C[N@@H+](Cc3ccccc3)C2)cc1NC(=O)CC[NH+](C)C ZINC000468686293 882811333 /nfs/dbraw/zinc/81/13/33/882811333.db2.gz UUJTXZILAQEQJT-CVDCTZTESA-N 2 0 408.590 4.208 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+](Cc2ccc(C(F)F)cc2)CC1)Cc1ccccc1 ZINC000461396785 874405679 /nfs/dbraw/zinc/40/56/79/874405679.db2.gz BGCTTYYXWVMHIH-UHFFFAOYSA-N 2 0 415.528 4.084 20 0 HIADRP O=C(NC[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(C[NH+]2CCCC2)c1 ZINC000461469760 874526056 /nfs/dbraw/zinc/52/60/56/874526056.db2.gz PPMJXGKZDHZOKJ-XMMPIXPASA-N 2 0 405.586 4.315 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cnn1C(C)C ZINC000468784284 882858429 /nfs/dbraw/zinc/85/84/29/882858429.db2.gz BKFIHHUHVIVSJS-MRXNPFEDSA-N 2 0 423.527 4.394 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3cc(C)c(C)cc3OC(F)F)cc2)CC1 ZINC000462689806 875781301 /nfs/dbraw/zinc/78/13/01/875781301.db2.gz WIVRGKZWOLEMKI-UHFFFAOYSA-N 2 0 417.544 4.332 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@H](C)C1 ZINC000462813582 875855830 /nfs/dbraw/zinc/85/58/30/875855830.db2.gz APQWSWARTWNLMG-DWIQEWEKSA-N 2 0 409.412 4.422 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Br)cc3)C2)[C@@H](C)C1 ZINC000462813581 875856039 /nfs/dbraw/zinc/85/60/39/875856039.db2.gz APQWSWARTWNLMG-BVPXEZJJSA-N 2 0 409.412 4.422 20 0 HIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CCC(C[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000463080171 876111040 /nfs/dbraw/zinc/11/10/40/876111040.db2.gz SJCGLVGZWZIPHQ-SFTDATJTSA-N 2 0 412.622 4.336 20 0 HIADRP COc1ccccc1[C@H](CNC1CC[NH+](CCc2ccccc2)CC1)[NH+]1CCCC1 ZINC000463135828 876185353 /nfs/dbraw/zinc/18/53/53/876185353.db2.gz ADERCQHUJSPESN-VWLOTQADSA-N 2 0 407.602 4.129 20 0 HIADRP COc1cccc([C@H](CN[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[NH+]2CCCC2)c1 ZINC000463139452 876189795 /nfs/dbraw/zinc/18/97/95/876189795.db2.gz GYDRXIFBMYBQIX-DSBYRVASSA-N 2 0 407.602 4.475 20 0 HIADRP COc1cccc([C@H](CN[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[NH+]2CCCC2)c1 ZINC000463139453 876190465 /nfs/dbraw/zinc/19/04/65/876190465.db2.gz GYDRXIFBMYBQIX-NZJKTDFXSA-N 2 0 407.602 4.475 20 0 HIADRP C[NH+](C)CCOc1ccc(CC[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)cc1 ZINC000463147739 876202153 /nfs/dbraw/zinc/20/21/53/876202153.db2.gz IRZLYLVFBXEPQJ-UHFFFAOYSA-N 2 0 416.009 4.077 20 0 HIADRP C[C@H]1C[C@H](NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC000463238033 876295180 /nfs/dbraw/zinc/29/51/80/876295180.db2.gz NDLQFDPXDBPBDG-XALWFJFJSA-N 2 0 409.540 4.434 20 0 HIADRP COC(=O)CCC[NH+]1CCC(Nc2ccccc2C[N@H+](C)C2CCCCC2)CC1 ZINC000463293378 876353191 /nfs/dbraw/zinc/35/31/91/876353191.db2.gz IDPROKRWMFCCPI-UHFFFAOYSA-N 2 0 401.595 4.281 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)[NH+]2CCCC2)o1 ZINC000503342916 912319872 /nfs/dbraw/zinc/31/98/72/912319872.db2.gz LILROMNKICBWCQ-FGZHOGPDSA-N 2 0 416.610 4.023 20 0 HIADRP C[N@H+](CCCNC(=O)NC[C@H]1CCC[NH+](C)[C@@H]1c1cccs1)C1CCCCC1 ZINC000465541846 879002047 /nfs/dbraw/zinc/00/20/47/879002047.db2.gz MMPSRBABCYNGMW-NQIIRXRSSA-N 2 0 406.640 4.085 20 0 HIADRP C[C@@H]1C[C@H](NC(=O)NCc2ccccc2-c2ccc(C[NH+]3CCCC3)cc2)CC[N@@H+]1C ZINC000465567802 879040605 /nfs/dbraw/zinc/04/06/05/879040605.db2.gz IWKDUFIINCFCAH-HYBUGGRVSA-N 2 0 420.601 4.231 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)CC(C)C ZINC000465581207 879061111 /nfs/dbraw/zinc/06/11/11/879061111.db2.gz ZEFVTHHDMNQUAO-SVFBPWRDSA-N 2 0 408.656 4.187 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCC[NH+]1CCCC[C@H]1C ZINC000465602786 879093114 /nfs/dbraw/zinc/09/31/14/879093114.db2.gz PYJFKEHDKVAZCD-ISKFKSNPSA-N 2 0 414.638 4.195 20 0 HIADRP C[C@H]1CCN(C(=O)N[C@H](C[NH+]2CCCC2)c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000465607280 879099532 /nfs/dbraw/zinc/09/95/32/879099532.db2.gz UJQMVZNFOMTWPC-WIOPSUGQSA-N 2 0 420.601 4.130 20 0 HIADRP CC[NH+](CC)[C@H]1CCN(C(=O)NCc2ccccc2C[N@H+](C)C2CCCCC2)C1 ZINC000465713228 879284528 /nfs/dbraw/zinc/28/45/28/879284528.db2.gz CMVXKTJZUKOMQH-QHCPKHFHSA-N 2 0 400.611 4.077 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)NC[C@@H]2CCC[NH+](C)[C@H]2c2cccs2)C1 ZINC000465750038 879337657 /nfs/dbraw/zinc/33/76/57/879337657.db2.gz HLGREOGHLICGCZ-YOUFYPILSA-N 2 0 420.667 4.187 20 0 HIADRP CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)NCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000465772432 879373069 /nfs/dbraw/zinc/37/30/69/879373069.db2.gz CEDVZOSMUZWPJY-QHCPKHFHSA-N 2 0 400.611 4.078 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@@H](c1ccc(C)cc1)[NH+](C)C ZINC000465817086 879440860 /nfs/dbraw/zinc/44/08/60/879440860.db2.gz ORPHINXACFAAPT-NOZRDPDXSA-N 2 0 422.617 4.151 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)C1 ZINC000465927803 879592007 /nfs/dbraw/zinc/59/20/07/879592007.db2.gz QASLJLWGRRILOA-RTWAWAEBSA-N 2 0 400.611 4.023 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)NCCCCC[NH+]2CCCCC2)[C@@H]1c1cccs1 ZINC000465951135 879619181 /nfs/dbraw/zinc/61/91/81/879619181.db2.gz NGNNKYTZFNXESU-TZIWHRDSSA-N 2 0 406.640 4.086 20 0 HIADRP C[NH+](C)CCN(CC1CCCCC1)C(=O)NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000466075971 879785265 /nfs/dbraw/zinc/78/52/65/879785265.db2.gz HXYJIXBNFWKGNS-IRLDBZIGSA-N 2 0 420.667 4.285 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NC[C@H]2CCC[NH+](C)[C@@H]2c2cccs2)CC1 ZINC000466087542 879806929 /nfs/dbraw/zinc/80/69/29/879806929.db2.gz YIQGCMGUCNLZFE-IRLDBZIGSA-N 2 0 420.667 4.285 20 0 HIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+][C@@H]3CCC[C@H]([C@@H]4CCOC4)C3)CC2)cc1 ZINC000466347619 880104993 /nfs/dbraw/zinc/10/49/93/880104993.db2.gz SGGOULPSLMVNIL-RBZQAINGSA-N 2 0 400.607 4.243 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1cncc(Br)c1 ZINC000466446369 880223225 /nfs/dbraw/zinc/22/32/25/880223225.db2.gz PICDZVAQWSOGAY-UHFFFAOYSA-N 2 0 400.320 4.359 20 0 HIADRP O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000503505356 912552206 /nfs/dbraw/zinc/55/22/06/912552206.db2.gz TWXYLQJTACGLEE-LEWJYISDSA-N 2 0 418.651 4.183 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccnn1-c1ccccc1 ZINC000467333313 881083210 /nfs/dbraw/zinc/08/32/10/881083210.db2.gz SCUHQVSJCSZTHJ-QFIPXVFZSA-N 2 0 403.574 4.125 20 0 HIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(NC(=O)CCCOc3ccccc3)cc2)[C@H](C)C1 ZINC000469232622 883332080 /nfs/dbraw/zinc/33/20/80/883332080.db2.gz UMPYULNFPRVXAS-HYBUGGRVSA-N 2 0 409.574 4.304 20 0 HIADRP CN(C(=O)[C@@H]1CCCC[N@@H+]1Cc1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000469493192 883732408 /nfs/dbraw/zinc/73/24/08/883732408.db2.gz CIGKFFLBKJTNMR-VWLOTQADSA-N 2 0 405.586 4.164 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1ccc(C[NH+]2CCCC2)cc1 ZINC000469723635 883887291 /nfs/dbraw/zinc/88/72/91/883887291.db2.gz WJMJVDPJKDVLDJ-DEOSSOPVSA-N 2 0 405.586 4.267 20 0 HIADRP C[NH+](C)CCOc1ccc(NC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccccc2)cc1Cl ZINC000469903092 884092145 /nfs/dbraw/zinc/09/21/45/884092145.db2.gz YXJJFXPTCDJZQV-NRFANRHFSA-N 2 0 415.965 4.274 20 0 HIADRP CCC[NH+]1CCC(N(C)C(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)CC1 ZINC000503706032 912804218 /nfs/dbraw/zinc/80/42/18/912804218.db2.gz UIQIRGYEXHSGKW-HXUWFJFHSA-N 2 0 400.611 4.166 20 0 HIADRP C[C@@H]1CC[N@H+](CCOc2ccc(NC(=O)c3ccc(Nc4cc[nH+]cc4)cc3)cc2)C1 ZINC000470082633 884340653 /nfs/dbraw/zinc/34/06/53/884340653.db2.gz RJBDUJQWFVJBCE-LJQANCHMSA-N 2 0 416.525 4.220 20 0 HIADRP CCCOc1c(Br)cc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1OCC ZINC000503905088 912858388 /nfs/dbraw/zinc/85/83/88/912858388.db2.gz YAUYEFGVWNBAJJ-UHFFFAOYSA-N 2 0 413.400 4.458 20 0 HIADRP CCOc1cc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc(Br)c1OC(F)F ZINC000503920378 912865230 /nfs/dbraw/zinc/86/52/30/912865230.db2.gz KZWFNBFHROAKPG-UHFFFAOYSA-N 2 0 421.326 4.271 20 0 HIADRP CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1ccc(Nc2cc[nH+]cc2)cc1 ZINC000470527248 884921796 /nfs/dbraw/zinc/92/17/96/884921796.db2.gz GTBAKBZGTDVCLO-QFIPXVFZSA-N 2 0 414.553 4.231 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1ccc(Nc2cc[nH+]cc2)cc1 ZINC000470527247 884922914 /nfs/dbraw/zinc/92/29/14/884922914.db2.gz GTBAKBZGTDVCLO-JOCHJYFZSA-N 2 0 414.553 4.231 20 0 HIADRP CN(C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470740225 885199680 /nfs/dbraw/zinc/19/96/80/885199680.db2.gz KEAOXZFPCGOYNJ-RUZDIDTESA-N 2 0 420.601 4.088 20 0 HIADRP CN(C(=O)N[C@H](C[NH+]1CCCC1)c1ccccc1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470752789 885217693 /nfs/dbraw/zinc/21/76/93/885217693.db2.gz BEVRMITWQGYOMU-JWQCQUIFSA-N 2 0 420.601 4.130 20 0 HIADRP CCN(CCC[NH+]1CCCC1)C(=O)NCC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000472109370 886897124 /nfs/dbraw/zinc/89/71/24/886897124.db2.gz YPVCXPJCPXZSJU-UHFFFAOYSA-N 2 0 421.029 4.069 20 0 HIADRP CCN(C(=O)Nc1cccc(OCC[NH+](C)C)c1)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000473748826 888534715 /nfs/dbraw/zinc/53/47/15/888534715.db2.gz UGIXIZHBZNFWNY-NZQKXSOJSA-N 2 0 424.589 4.316 20 0 HIADRP CCN(C(=O)NCc1ccc(C[NH+](C)C)cc1)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000473875466 888738515 /nfs/dbraw/zinc/73/85/15/888738515.db2.gz NQJOQKMHCCLYJQ-YKSBVNFPSA-N 2 0 408.590 4.115 20 0 HIADRP Clc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c(-n2cncn2)c1 ZINC000474278189 889142429 /nfs/dbraw/zinc/14/24/29/889142429.db2.gz OORLATBHBUFYAS-UHFFFAOYSA-N 2 0 421.976 4.409 20 0 HIADRP COc1ccc(Cn2nc(C)c(C[NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)c2C)cc1 ZINC000475225483 890096082 /nfs/dbraw/zinc/09/60/82/890096082.db2.gz SRFMHNWIYIAPPE-DEOSSOPVSA-N 2 0 418.585 4.169 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475297560 890204967 /nfs/dbraw/zinc/20/49/67/890204967.db2.gz NPPGOHCJNFTQFM-KNQAVFIVSA-N 2 0 413.993 4.189 20 0 HIADRP C[C@H]1CCC[C@H]([NH+]2CCC(NC3CC([NH+]4CCC(C(F)(F)F)CC4)C3)CC2)C1 ZINC000475353764 890277819 /nfs/dbraw/zinc/27/78/19/890277819.db2.gz LGRPHFUPNOSBCH-QGZBPCDMSA-N 2 0 401.561 4.424 20 0 HIADRP O=C(CC[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2)N1CCc2sccc2C1 ZINC000475736376 890676022 /nfs/dbraw/zinc/67/60/22/890676022.db2.gz HCMHHXCGESVQLZ-VWLOTQADSA-N 2 0 423.626 4.011 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NC1CC([NH+]2CCCCC2)C1)c1cccc(C(F)(F)F)c1 ZINC000477962970 893053508 /nfs/dbraw/zinc/05/35/08/893053508.db2.gz GVAQYZDZZVPAPC-MHJFOBGBSA-N 2 0 411.512 4.221 20 0 HIADRP C[C@H]1[C@@H]([NH+]2CCCC2)CCN1C(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000478222286 893382760 /nfs/dbraw/zinc/38/27/60/893382760.db2.gz DAKVSZCXCZCDEW-CPJSRVTESA-N 2 0 420.601 4.183 20 0 HIADRP CC[C@@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(Br)cc1C(F)(F)F ZINC000479083367 894348971 /nfs/dbraw/zinc/34/89/71/894348971.db2.gz YDAGTUJFYGYDEN-QGZVFWFLSA-N 2 0 423.317 4.213 20 0 HIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NCc2ccc(Cn3ccnc3)cc2)CC1 ZINC000479424266 894736642 /nfs/dbraw/zinc/73/66/42/894736642.db2.gz MXKYUAXFZUDTFY-NRFANRHFSA-N 2 0 423.605 4.118 20 0 HIADRP O[C@H]1CC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3cc(Br)ccc32)C1 ZINC000479434585 894748558 /nfs/dbraw/zinc/74/85/58/894748558.db2.gz DYWRKTMMZUFOST-UNMCSNQZSA-N 2 0 415.375 4.183 20 0 HIADRP CCS(=O)(=O)c1c(Cl)cccc1C[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000479475051 894798258 /nfs/dbraw/zinc/79/82/58/894798258.db2.gz KWCAKRJVLZBVAI-UHFFFAOYSA-N 2 0 413.027 4.266 20 0 HIADRP COc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1OC ZINC000480241869 895652381 /nfs/dbraw/zinc/65/23/81/895652381.db2.gz QLXWJFMGFWXDQE-ZCNNSNEGSA-N 2 0 412.574 4.472 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc1 ZINC000480424416 895819873 /nfs/dbraw/zinc/81/98/73/895819873.db2.gz FGUMFXCLTNAWOY-IBGZPJMESA-N 2 0 415.603 4.285 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC000480449693 895838094 /nfs/dbraw/zinc/83/80/94/895838094.db2.gz SKGZYRGSZYIRQG-LJQANCHMSA-N 2 0 415.603 4.285 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCN(Cc3ccccn3)C[C@@H]2C)C1 ZINC000480621961 895989916 /nfs/dbraw/zinc/98/99/16/895989916.db2.gz UQNLPBRDFQTAHE-UFPGJGBJSA-N 2 0 406.618 4.314 20 0 HIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000480630932 896001527 /nfs/dbraw/zinc/00/15/27/896001527.db2.gz LVPVLPSVFRWCIA-LEWJYISDSA-N 2 0 421.651 4.024 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000480645619 896014043 /nfs/dbraw/zinc/01/40/43/896014043.db2.gz SAUATXWGTFSBAT-MOPGFXCFSA-N 2 0 415.603 4.283 20 0 HIADRP Cc1ccccc1CN1CCC([NH2+][C@H](C)[C@H](c2ccccc2)N2CCOCC2)CC1 ZINC000480687283 896048952 /nfs/dbraw/zinc/04/89/52/896048952.db2.gz PWAGSTYISOKRTL-ATIYNZHBSA-N 2 0 407.602 4.011 20 0 HIADRP C[NH+]1CCN(c2cc(CN[C@H]3CCCc4c(Cl)sc(Cl)c43)ccn2)CC1 ZINC000480703782 896065108 /nfs/dbraw/zinc/06/51/08/896065108.db2.gz FKEGOWSPNVCTGX-HNNXBMFYSA-N 2 0 411.402 4.369 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCSc4c(Cl)cccc43)cn2)CC1 ZINC000480731622 896092271 /nfs/dbraw/zinc/09/22/71/896092271.db2.gz QWNHHBJKJLHAOY-IBGZPJMESA-N 2 0 402.995 4.204 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc4cc(OC)ccc4c3)cn2)CC1 ZINC000480732958 896093665 /nfs/dbraw/zinc/09/36/65/896093665.db2.gz FHQDOZQFELDDCR-LJQANCHMSA-N 2 0 404.558 4.236 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3ccc(OC(F)F)cc3)cc2)CC1 ZINC000480732899 896093973 /nfs/dbraw/zinc/09/39/73/896093973.db2.gz SUJFEUCFVJENMV-GOSISDBHSA-N 2 0 403.517 4.276 20 0 HIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]Cc1ccnc(N2CC[NH+](C)CC2)c1 ZINC000480735685 896097680 /nfs/dbraw/zinc/09/76/80/896097680.db2.gz YEPAFRLYMGEUFA-JKSUJKDBSA-N 2 0 423.388 4.086 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@@H](C)c2sc(Cc3ccccc3)nc2C)CC1 ZINC000480768199 896128958 /nfs/dbraw/zinc/12/89/58/896128958.db2.gz NGCHUSHYDPRBIK-IBGZPJMESA-N 2 0 400.636 4.111 20 0 HIADRP CC[NH+]1CCN(CCCC[NH2+][C@H](C)c2sc(Cc3ccccc3)nc2C)CC1 ZINC000480768205 896129543 /nfs/dbraw/zinc/12/95/43/896129543.db2.gz NGCHUSHYDPRBIK-LJQANCHMSA-N 2 0 400.636 4.111 20 0 HIADRP Cc1nn(C)cc1[C@H](C)[NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000480777785 896142819 /nfs/dbraw/zinc/14/28/19/896142819.db2.gz IOEBSKBRKLYLRX-KRWDZBQOSA-N 2 0 423.527 4.000 20 0 HIADRP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000481236258 896587268 /nfs/dbraw/zinc/58/72/68/896587268.db2.gz ACJWMZBGMKUDQF-NRFANRHFSA-N 2 0 416.569 4.263 20 0 HIADRP CCC[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000481255510 896605804 /nfs/dbraw/zinc/60/58/04/896605804.db2.gz IRASWQZDJNJPOQ-FQEVSTJZSA-N 2 0 406.496 4.483 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000481546490 896910398 /nfs/dbraw/zinc/91/03/98/896910398.db2.gz QSAFCPDYEWLNFI-LJQANCHMSA-N 2 0 415.603 4.011 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000481712025 897102288 /nfs/dbraw/zinc/10/22/88/897102288.db2.gz BFLOSVDZSCNGKG-GOSISDBHSA-N 2 0 418.578 4.456 20 0 HIADRP CCS(=O)(=O)Nc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1 ZINC000481718920 897112462 /nfs/dbraw/zinc/11/24/62/897112462.db2.gz BGJCWIKBOBEDBS-KRWDZBQOSA-N 2 0 421.632 4.073 20 0 HIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1Br ZINC000481719473 897114287 /nfs/dbraw/zinc/11/42/87/897114287.db2.gz DEACXXACZBSVRB-OAHLLOKOSA-N 2 0 407.352 4.249 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000481722835 897118397 /nfs/dbraw/zinc/11/83/97/897118397.db2.gz ZFLSQTQEOPILPC-LJQANCHMSA-N 3 0 401.620 4.251 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)[C@H](C)C1 ZINC000481736369 897131470 /nfs/dbraw/zinc/13/14/70/897131470.db2.gz NRCRMXPWPSQDJV-RDGATRHJSA-N 3 0 401.639 4.289 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCCOc4ccc(OC)cc43)CC2)cc1 ZINC000481737591 897131763 /nfs/dbraw/zinc/13/17/63/897131763.db2.gz PKYCXOMVRDARFZ-DEOSSOPVSA-N 2 0 410.558 4.419 20 0 HIADRP CC1(C)CC[C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c2ccccc21 ZINC000481931463 897315773 /nfs/dbraw/zinc/31/57/73/897315773.db2.gz JIAQJZWEXHASME-URXFXBBRSA-N 2 0 405.586 4.286 20 0 HIADRP Cc1cc(NC(=O)c2cccc(C[NH+]3CCCC3)c2)cc(N2CC[NH+](C(C)C)CC2)c1 ZINC000482031731 897441351 /nfs/dbraw/zinc/44/13/51/897441351.db2.gz NNAKVRPPZZDWBN-UHFFFAOYSA-N 2 0 420.601 4.374 20 0 HIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]CC1CC[NH+](CCN(C)C)CC1 ZINC000482332060 897836872 /nfs/dbraw/zinc/83/68/72/897836872.db2.gz KYPKWDPKSNRNOJ-JKSUJKDBSA-N 2 0 402.410 4.012 20 0 HIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CC1CC[NH+](CCN(C)C)CC1 ZINC000482364327 897882458 /nfs/dbraw/zinc/88/24/58/897882458.db2.gz VPLDPGUCXOJVHQ-MRXNPFEDSA-N 2 0 404.599 4.182 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CCN(C)C)CC1)c1ccc2ccccc2c1OC(F)F ZINC000482364655 897883755 /nfs/dbraw/zinc/88/37/55/897883755.db2.gz ZPVLPFSMSPTIMP-KRWDZBQOSA-N 2 0 405.533 4.365 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1ccc(-c2cccs2)cc1 ZINC000482433460 897991272 /nfs/dbraw/zinc/99/12/72/897991272.db2.gz CGLCCWQUSJEKSQ-FQEVSTJZSA-N 2 0 421.614 4.458 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ncccn2)CC1)c1cc(Cl)cc(Cl)c1 ZINC000482443124 898005272 /nfs/dbraw/zinc/00/52/72/898005272.db2.gz FLGTXQLTWREYFA-MRXNPFEDSA-N 2 0 408.377 4.036 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C[C@H](C)CN1CC[NH+](C)CC1 ZINC000482450541 898015150 /nfs/dbraw/zinc/01/51/50/898015150.db2.gz QQGITUSMTYSJAF-JKSUJKDBSA-N 2 0 407.027 4.306 20 0 HIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000482455311 898024725 /nfs/dbraw/zinc/02/47/25/898024725.db2.gz XZPZRTAUHYHPOO-TZIWHRDSSA-N 2 0 406.574 4.186 20 0 HIADRP CC(C)Cc1ccc([C@@H](CNC(=O)Nc2ccccc2CC[NH+](C)C)[NH+](C)C)cc1 ZINC000482505665 898087908 /nfs/dbraw/zinc/08/79/08/898087908.db2.gz ROZMZLSCNGSEHE-XMMPIXPASA-N 2 0 410.606 4.414 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000482513899 898099734 /nfs/dbraw/zinc/09/97/34/898099734.db2.gz UGRYVIGVCVJQPQ-NTKDMRAZSA-N 2 0 401.545 4.112 20 0 HIADRP Cc1c([C@@H](C)[NH2+]CCc2ccc(OCC[NH+](C)C)cc2)cnn1-c1ccc(F)cc1 ZINC000482539779 898128436 /nfs/dbraw/zinc/12/84/36/898128436.db2.gz SVSBYEZXQNZJCK-GOSISDBHSA-N 2 0 410.537 4.154 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cccc(OC(F)(F)F)c1 ZINC000482544020 898133126 /nfs/dbraw/zinc/13/31/26/898133126.db2.gz PLRGEBMJLNNTPC-MRXNPFEDSA-N 2 0 408.464 4.393 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccc(NS(C)(=O)=O)cc1 ZINC000482550230 898139929 /nfs/dbraw/zinc/13/99/29/898139929.db2.gz BHNBYQIERUBWRS-LJQANCHMSA-N 2 0 415.603 4.141 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccccc1OC(F)(F)F ZINC000482549765 898140172 /nfs/dbraw/zinc/14/01/72/898140172.db2.gz DUSPRBZUVFAFRQ-INIZCTEOSA-N 2 0 408.464 4.393 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cc(Br)ccc1F ZINC000482551142 898142241 /nfs/dbraw/zinc/14/22/41/898142241.db2.gz AWRCKJKSDOBSLE-HNNXBMFYSA-N 2 0 421.354 4.396 20 0 HIADRP O=C(NC1CC[NH+](C2CCCC2)CC1)N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000482613708 898215799 /nfs/dbraw/zinc/21/57/99/898215799.db2.gz DKYKMRFLXOKENE-DHLKQENFSA-N 2 0 424.633 4.090 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(-c2ccccc2Br)s1 ZINC000482633005 898237058 /nfs/dbraw/zinc/23/70/58/898237058.db2.gz GTHAFIUHTMJIQJ-HZPDHXFCSA-N 2 0 422.436 4.464 20 0 HIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(-c2ccc(Br)cc2)s1 ZINC000482637411 898242615 /nfs/dbraw/zinc/24/26/15/898242615.db2.gz OUAZPRRFIMCTOB-HZPDHXFCSA-N 2 0 422.436 4.464 20 0 HIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1 ZINC000482649900 898252477 /nfs/dbraw/zinc/25/24/77/898252477.db2.gz RZZXQOKHYHSVMT-GHTZIAJQSA-N 2 0 405.542 4.289 20 0 HIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccc(N2CCOCC2)c1 ZINC000482884737 898499176 /nfs/dbraw/zinc/49/91/76/898499176.db2.gz KRKISHSDDYNYFN-IVUDOQJQSA-N 2 0 405.586 4.369 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](N[C@H](C)c2ccc(F)cc2Br)[C@H](C)C1 ZINC000483131570 898813969 /nfs/dbraw/zinc/81/39/69/898813969.db2.gz RKCVKLTYNOMVPP-CLCXKQKWSA-N 2 0 401.364 4.376 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](N[C@@H](C)c2ccc(F)cc2Br)[C@@H](C)C1 ZINC000483131571 898814262 /nfs/dbraw/zinc/81/42/62/898814262.db2.gz RKCVKLTYNOMVPP-DOXZYTNZSA-N 2 0 401.364 4.376 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2sc(-c3cccnc3)nc2C)[C@@H](C)C1 ZINC000483141194 898820630 /nfs/dbraw/zinc/82/06/30/898820630.db2.gz RVZDOTQBNBIINL-QKLQHJQFSA-N 2 0 402.608 4.301 20 0 HIADRP C[C@@H]([NH2+][C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000483198825 898854503 /nfs/dbraw/zinc/85/45/03/898854503.db2.gz MBMMEDKDZVYCJW-MJGOQNOKSA-N 2 0 419.516 4.158 20 0 HIADRP C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000483207052 898859745 /nfs/dbraw/zinc/85/97/45/898859745.db2.gz VDBJRAXHPIBIDJ-HZPDHXFCSA-N 2 0 402.526 4.493 20 0 HIADRP CCOc1ccc([C@H](CC)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1OCC ZINC000483530606 899192322 /nfs/dbraw/zinc/19/23/22/899192322.db2.gz KDUTUEAFIMWCEE-QFIPXVFZSA-N 2 0 417.638 4.475 20 0 HIADRP C[NH+]1CCC(C[NH2+][C@H]2CCc3c2cc(Br)cc3F)(N2CCCCC2)CC1 ZINC000483544288 899204967 /nfs/dbraw/zinc/20/49/67/899204967.db2.gz NHNPVBCTVGQMMZ-FQEVSTJZSA-N 2 0 424.402 4.115 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC1CC[NH+](C2CCCC2)CC1 ZINC000483714360 899371209 /nfs/dbraw/zinc/37/12/09/899371209.db2.gz WEFDXGISZHERDR-HXUWFJFHSA-N 2 0 412.622 4.267 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2CCCC[C@@H]2C)C[C@H]1C ZINC000483715491 899372024 /nfs/dbraw/zinc/37/20/24/899372024.db2.gz YTLFKBDHNSRLCM-MZKRTTBSSA-N 2 0 400.611 4.075 20 0 HIADRP COc1ccccc1[C@@H](C)[NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1 ZINC000483730883 899391556 /nfs/dbraw/zinc/39/15/56/899391556.db2.gz OUGHIAMSZUBXPO-MRXNPFEDSA-N 2 0 407.480 4.317 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)C[C@H]1C ZINC000483739520 899401687 /nfs/dbraw/zinc/40/16/87/899401687.db2.gz GRECDSLJLFVUFU-NFBKMPQASA-N 2 0 400.611 4.077 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc(OCC[NH+](C)C)cc1 ZINC000483747139 899411273 /nfs/dbraw/zinc/41/12/73/899411273.db2.gz OQRFVWKNAQTIHJ-LAUBAEHRSA-N 2 0 415.965 4.127 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccccc2C[NH+]2CCCCCC2)C[C@H]1C ZINC000483811740 899489933 /nfs/dbraw/zinc/48/99/33/899489933.db2.gz AHXJDEYJZFVXLZ-OFNKIYASSA-N 2 0 400.611 4.077 20 0 HIADRP C[C@H]([NH2+]C1(CN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CCOCC1)c1ccccc1 ZINC000484135990 899756722 /nfs/dbraw/zinc/75/67/22/899756722.db2.gz BFEFYVZSDXPVJW-JCYRPKCISA-N 2 0 421.629 4.387 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCN(C(=O)c2ccccc2)CC1 ZINC000484165861 899785146 /nfs/dbraw/zinc/78/51/46/899785146.db2.gz VPGCGQPEGQLRFQ-BWKNWUBXSA-N 2 0 405.586 4.039 20 0 HIADRP COc1ccc2cc([C@@H](C)[NH2+]CC3CC[NH+](CC(=O)NC(C)(C)C)CC3)ccc2c1 ZINC000484275989 899846308 /nfs/dbraw/zinc/84/63/08/899846308.db2.gz JTZONDXADYMYAU-GOSISDBHSA-N 2 0 411.590 4.126 20 0 HIADRP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000484287092 899853072 /nfs/dbraw/zinc/85/30/72/899853072.db2.gz BMJSOYSYVPMMMU-INIZCTEOSA-N 2 0 410.002 4.016 20 0 HIADRP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1 ZINC000484294987 899859136 /nfs/dbraw/zinc/85/91/36/899859136.db2.gz CUDFRJZUEZMQRR-HNNXBMFYSA-N 2 0 408.656 4.026 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(-c2ccncc2)cc1 ZINC000484306625 899867865 /nfs/dbraw/zinc/86/78/65/899867865.db2.gz JSBKGUDOFQWDOS-LJQANCHMSA-N 2 0 408.590 4.026 20 0 HIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccc2c(c1)OCCO2 ZINC000484478893 899971655 /nfs/dbraw/zinc/97/16/55/899971655.db2.gz VNBKLBIHRDCWEX-FQEVSTJZSA-N 2 0 410.558 4.180 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1cccc(OC(F)(F)F)c1 ZINC000484482257 899974582 /nfs/dbraw/zinc/97/45/82/899974582.db2.gz YMFTZEZXILTLID-MRXNPFEDSA-N 2 0 408.464 4.393 20 0 HIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)c1 ZINC000484486475 899978441 /nfs/dbraw/zinc/97/84/41/899978441.db2.gz LHNXQLHFTPQTTO-KRWDZBQOSA-N 2 0 404.501 4.404 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1ccc(F)c(Br)c1 ZINC000484488726 899979602 /nfs/dbraw/zinc/97/96/02/899979602.db2.gz VFYRWQCYVVJTME-HNNXBMFYSA-N 2 0 421.354 4.396 20 0 HIADRP Cc1cc(C)c(NC(=O)CCC[NH+]2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c(C)c1 ZINC000485085458 900400148 /nfs/dbraw/zinc/40/01/48/900400148.db2.gz BWWSGFOLQGPJLA-FGZHOGPDSA-N 2 0 415.622 4.152 20 0 HIADRP Cc1cccc(C)c1NC(=O)CCC[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000485410305 900708441 /nfs/dbraw/zinc/70/84/41/900708441.db2.gz UPVFLRJYSMVTTA-FGZHOGPDSA-N 2 0 415.622 4.233 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@@H](C)[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000486240742 901423206 /nfs/dbraw/zinc/42/32/06/901423206.db2.gz BCUAHZGWSMLSFE-XUZZJYLKSA-N 2 0 422.617 4.237 20 0 HIADRP CC[NH+](CC)CCN(C(=O)C1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000486444309 901603290 /nfs/dbraw/zinc/60/32/90/901603290.db2.gz JWAHMIJXZABGQN-UHFFFAOYSA-N 2 0 411.512 4.255 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)[C@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000488526561 902870228 /nfs/dbraw/zinc/87/02/28/902870228.db2.gz ZTXIFKALENLOCQ-JHMXWDHMSA-N 2 0 423.576 4.065 20 0 HIADRP O=C(Nc1ccccc1)c1ccc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)cc1 ZINC000506030026 914713527 /nfs/dbraw/zinc/71/35/27/914713527.db2.gz FBIRZLOMRQJMEZ-UHFFFAOYSA-N 2 0 421.585 4.263 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(Br)c(F)c1 ZINC000489530130 903441071 /nfs/dbraw/zinc/44/10/71/903441071.db2.gz CYHZGNDRIOIOQT-OAHLLOKOSA-N 2 0 421.354 4.396 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(Br)c(F)c1 ZINC000489530128 903441540 /nfs/dbraw/zinc/44/15/40/903441540.db2.gz CYHZGNDRIOIOQT-HNNXBMFYSA-N 2 0 421.354 4.396 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCC(=O)N[C@@H]2CCCc3ccccc32)CC1 ZINC000489650248 903514576 /nfs/dbraw/zinc/51/45/76/903514576.db2.gz QSEUUCQVRGZSKV-AREMUKBSSA-N 2 0 419.613 4.414 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@H](O)COc2cccc3ccccc32)CC1 ZINC000489680990 903539504 /nfs/dbraw/zinc/53/95/04/903539504.db2.gz DLYLBWOIUDKEHR-VWLOTQADSA-N 2 0 418.581 4.424 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2cccc(SC)c2)c2cc(F)ccc2F)CC1 ZINC000490119000 903775027 /nfs/dbraw/zinc/77/50/27/903775027.db2.gz MSOHTNRGTWJDSP-QHCPKHFHSA-N 2 0 419.585 4.393 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2ccccc2)c2ccccc2Br)CC1 ZINC000490118511 903775371 /nfs/dbraw/zinc/77/53/71/903775371.db2.gz KVFNKGDHPMAYPQ-QFIPXVFZSA-N 2 0 416.407 4.156 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3cnnn3Cc3ccccc3)cc2)C1 ZINC000490572955 904110355 /nfs/dbraw/zinc/11/03/55/904110355.db2.gz TVTHDLFIJWPIER-NHCUHLMSSA-N 2 0 403.574 4.094 20 0 HIADRP Cc1cc([C@@H]([NH2+]CCCN2CCC[N@@H+](C)CC2)c2ccccc2Cl)ccc1F ZINC000491006851 904366510 /nfs/dbraw/zinc/36/65/10/904366510.db2.gz NEEWSMDDRGPSON-HSZRJFAPSA-N 2 0 403.973 4.494 20 0 HIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@H](O)CO[C@H]2CCCc3ccccc32)CC1 ZINC000491029209 904380964 /nfs/dbraw/zinc/38/09/64/904380964.db2.gz QLWXEPMJSNFGON-BDYUSTAISA-N 2 0 422.613 4.286 20 0 HIADRP Cc1ccc([C@@H]([NH2+]CCCC[NH+]2CCN(c3ncccn3)CC2)c2ccccc2)cc1 ZINC000491035705 904388883 /nfs/dbraw/zinc/38/88/83/904388883.db2.gz JSQZHYLFTUNUDP-VWLOTQADSA-N 2 0 415.585 4.066 20 0 HIADRP Cc1ccc(C)c([C@@H]([NH2+]Cc2cccc(C(=O)NCC[NH+](C)C)c2)c2ccccc2)c1 ZINC000491054110 904397317 /nfs/dbraw/zinc/39/73/17/904397317.db2.gz PSQUAAPKZSHKNZ-SANMLTNESA-N 2 0 415.581 4.474 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1oc2ccccc2c1C[NH+](C)C ZINC000491055261 904398720 /nfs/dbraw/zinc/39/87/20/904398720.db2.gz YVABCRNUWJCKRU-OAQYLSRUSA-N 2 0 419.569 4.479 20 0 HIADRP CSc1cccc([C@@H]([NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491058953 904402584 /nfs/dbraw/zinc/40/25/84/904402584.db2.gz JEBRDPDKSAGAIU-UZUQRXQVSA-N 2 0 419.585 4.249 20 0 HIADRP CSc1cccc([C@H]([NH2+]C[C@H](C)CN2CC[NH+](C)CC2)c2ccc(F)c(F)c2)c1 ZINC000491058951 904402920 /nfs/dbraw/zinc/40/29/20/904402920.db2.gz JEBRDPDKSAGAIU-SBUREZEXSA-N 2 0 419.585 4.249 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]C(c3ccccc3)c3ccccc3)c2)C1 ZINC000492211696 904815941 /nfs/dbraw/zinc/81/59/41/904815941.db2.gz VBGZDVXEZZKFFS-VWLOTQADSA-N 2 0 413.565 4.263 20 0 HIADRP C[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[N@H+](C)CCCN1CC[NH+](C)CC1 ZINC000492786228 904905761 /nfs/dbraw/zinc/90/57/61/904905761.db2.gz XPXQFOMICUQHRA-AWEZNQCLSA-N 2 0 411.434 4.355 20 0 HIADRP COc1cc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1OCc1ccncc1 ZINC000512388711 921124231 /nfs/dbraw/zinc/12/42/31/921124231.db2.gz YCNFMKPYSJLNLX-SIKLNZKXSA-N 2 0 409.574 4.412 20 0 HIADRP Cc1cc(Br)cc2c1[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)CC2 ZINC000493901701 905254619 /nfs/dbraw/zinc/25/46/19/905254619.db2.gz WLGIIUDGDBPVED-FQEVSTJZSA-N 2 0 403.364 4.475 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1cc(Br)cs1 ZINC000493929460 905282216 /nfs/dbraw/zinc/28/22/16/905282216.db2.gz YOLMJJJSIRIOCF-AWEZNQCLSA-N 2 0 409.393 4.318 20 0 HIADRP C[C@H](c1ccccc1Cl)[NH+]1CCC(C(=O)NCC[N@H+](C)Cc2ccccc2)CC1 ZINC000494560538 905836053 /nfs/dbraw/zinc/83/60/53/905836053.db2.gz GUIDHJVHEFFZAN-LJQANCHMSA-N 2 0 413.993 4.361 20 0 HIADRP Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000495415540 906437552 /nfs/dbraw/zinc/43/75/52/906437552.db2.gz RBWVKKSOBYAQDP-LSDHHAIUSA-N 2 0 412.500 4.414 20 0 HIADRP Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000495415537 906437568 /nfs/dbraw/zinc/43/75/68/906437568.db2.gz RBWVKKSOBYAQDP-CABCVRRESA-N 2 0 412.500 4.414 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1)c1ccc(F)c(Cl)c1 ZINC000495460916 906464964 /nfs/dbraw/zinc/46/49/64/906464964.db2.gz NUVAUJMOQXUYMN-DNVCBOLYSA-N 2 0 403.929 4.027 20 0 HIADRP C[C@H](c1ccncc1)N1CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000512613308 921260899 /nfs/dbraw/zinc/26/08/99/921260899.db2.gz RNTCBOSOJSSRQO-UFLJZRJVSA-N 2 0 418.629 4.497 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000497310733 906829646 /nfs/dbraw/zinc/82/96/46/906829646.db2.gz KOPQGKMQGYYMOZ-OAHLLOKOSA-N 2 0 402.917 4.157 20 0 HIADRP c1cn(Cc2ccc(C[NH2+][C@@H]3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)cc2)cn1 ZINC000512648530 921274089 /nfs/dbraw/zinc/27/40/89/921274089.db2.gz NZFPGTZPFHKNBP-KKUQBAQOSA-N 2 0 400.570 4.322 20 0 HIADRP O=C(CCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)N1Cc2ccccc2C1 ZINC000512659664 921278287 /nfs/dbraw/zinc/27/82/87/921278287.db2.gz JCCZEDNEZFJQCL-UODIDJSMSA-N 2 0 417.597 4.199 20 0 HIADRP CN(C(=O)C[NH+]1CCC(CC[NH+](C)C)CC1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000497475563 906955465 /nfs/dbraw/zinc/95/54/65/906955465.db2.gz IDVKOYAMUGTZEB-VWLOTQADSA-N 2 0 411.565 4.037 20 0 HIADRP CN(CC[NH+]1CCCC1)C(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000497762643 907256658 /nfs/dbraw/zinc/25/66/58/907256658.db2.gz ZYVYAKMESSODBH-UHFFFAOYSA-N 2 0 420.601 4.187 20 0 HIADRP CCS[C@@H]1CCCC[NH+](CC2(C[N@H+]3CCCC[C@@H](SCC)C3)COC2)C1 ZINC000497849239 907329401 /nfs/dbraw/zinc/32/94/01/907329401.db2.gz WJRTZGPUBHOZEM-WOJBJXKFSA-N 2 0 400.698 4.218 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2F)cc1)C(C)C ZINC000497882099 907355564 /nfs/dbraw/zinc/35/55/64/907355564.db2.gz IFWCRMVGBOHZPA-UHFFFAOYSA-N 2 0 417.544 4.399 20 0 HIADRP CC[NH+](CC)CCOc1ccc(NC(=O)N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000512842721 921345737 /nfs/dbraw/zinc/34/57/37/921345737.db2.gz ASQOGSYOOFDKNT-WOJBJXKFSA-N 2 0 416.610 4.182 20 0 HIADRP C[NH+](C)CCOc1ccc(C[NH2+]C2CCN(Cc3ccc(Cl)cc3)CC2)cc1 ZINC000512848895 921353665 /nfs/dbraw/zinc/35/36/65/921353665.db2.gz LCSVZVAEQHLUEH-UHFFFAOYSA-N 2 0 401.982 4.035 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccco1 ZINC000498901003 908308283 /nfs/dbraw/zinc/30/82/83/908308283.db2.gz LALMKWKTABNGDC-YUVXSKOASA-N 2 0 412.578 4.061 20 0 HIADRP c1ccc(CC[N@@H+]2CC[C@@H](CN[C@H]3C[C@H]4CC[C@@H](C3)[NH+]4Cc3ccccc3)C2)cc1 ZINC000499156755 908513139 /nfs/dbraw/zinc/51/31/39/908513139.db2.gz MKTHMPWFBCPJTC-NFGXINMFSA-N 2 0 403.614 4.336 20 0 HIADRP C[C@@H](c1ccncc1)N1CCC([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000499176991 908531149 /nfs/dbraw/zinc/53/11/49/908531149.db2.gz NTYQMBOTTLMKCN-PCWWUVHHSA-N 2 0 404.602 4.392 20 0 HIADRP Fc1ccc(-n2ccc(CC[NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)n2)cc1 ZINC000499235816 908600028 /nfs/dbraw/zinc/60/00/28/908600028.db2.gz SGJJLSSFOBJNPI-RHHYMUMYSA-N 2 0 404.533 4.339 20 0 HIADRP Cc1ccc(NC(=O)[C@H]2C[N@H+](Cc3ccccc3)CCC2(F)F)c(C[NH+](C)C)c1 ZINC000512967816 921444735 /nfs/dbraw/zinc/44/47/35/921444735.db2.gz UABSEWCMLUFVHT-HXUWFJFHSA-N 2 0 401.501 4.153 20 0 HIADRP O[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2cccc(OCc3ccc(F)cc3)c2)CC1 ZINC000499686707 908877097 /nfs/dbraw/zinc/87/70/97/908877097.db2.gz VAAJVFNOOSKOBI-DQEYMECFSA-N 2 0 412.549 4.262 20 0 HIADRP OC[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Cc1cccc(OC(F)(F)F)c1 ZINC000512998881 921465510 /nfs/dbraw/zinc/46/55/10/921465510.db2.gz MDRXQBXFDDBNIG-SFHVURJKSA-N 2 0 414.512 4.123 20 0 HIADRP COc1ccc2c(c1)C[N@@H+](CCCN1CC[NH+](C(C)C)CC1)[C@H](c1ccccc1)C2 ZINC000500073910 909544524 /nfs/dbraw/zinc/54/45/24/909544524.db2.gz JOZDFQICAZGLLW-SANMLTNESA-N 2 0 407.602 4.211 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)NCc3ccc(C[NH+](C)C)cc3)cc2)C1 ZINC000500694314 910026083 /nfs/dbraw/zinc/02/60/83/910026083.db2.gz AWLQPYLUYJMOEZ-NHCUHLMSSA-N 2 0 422.617 4.226 20 0 HIADRP C[NH+](C)[C@H](CNC(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1ccsc1 ZINC000501027529 910244128 /nfs/dbraw/zinc/24/41/28/910244128.db2.gz ZVSXYUOTPCZQSP-WOJBJXKFSA-N 2 0 421.010 4.141 20 0 HIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCc3ccccc3[C@H](c3ccccc3)[C@@H]2C)CC1 ZINC000501033799 910250027 /nfs/dbraw/zinc/25/00/27/910250027.db2.gz VYTMGTLCSLUEPW-HOFKKMOUSA-N 2 0 405.630 4.481 20 0 HIADRP CCOc1ccc(CCC2CC[NH+](CCCN3CC[NH+](C(C)C)CC3)CC2)cc1 ZINC000501077912 910277798 /nfs/dbraw/zinc/27/77/98/910277798.db2.gz KIOGVHXQYNDZGD-UHFFFAOYSA-N 2 0 401.639 4.146 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N1CCC[N@H+](Cc2ccccc2)CC1)c1ccsc1 ZINC000501175026 910342809 /nfs/dbraw/zinc/34/28/09/910342809.db2.gz OLFUIFHYBDABDU-QFIPXVFZSA-N 2 0 414.619 4.049 20 0 HIADRP C[N@H+](C[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513147838 921585152 /nfs/dbraw/zinc/58/51/52/921585152.db2.gz CVZQDTMUXYPMDR-NPZNXQLHSA-N 2 0 422.613 4.309 20 0 HIADRP CSc1ccccc1[C@@H](C)[NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000501536297 910643138 /nfs/dbraw/zinc/64/31/38/910643138.db2.gz ZGEXJFUJWSDTLX-LJQANCHMSA-N 2 0 411.615 4.148 20 0 HIADRP COCC[N@H+](C)CCCC1CC[NH+]([C@H](C)c2nc(-c3ccc(F)c(C)c3)no2)CC1 ZINC000501777360 910832533 /nfs/dbraw/zinc/83/25/33/910832533.db2.gz QKBQUKNURQHJFV-GOSISDBHSA-N 2 0 418.557 4.316 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N2CCC([N@@H+]3CCc4ccccc4C3)CC2)cc1 ZINC000513229739 921643754 /nfs/dbraw/zinc/64/37/54/921643754.db2.gz DSPXGIVKCHGANA-UHFFFAOYSA-N 2 0 405.586 4.191 20 0 HIADRP C[C@@H]1C[NH+](CCOc2ccc(CC[NH2+][C@@H]3CCCC34CCOCC4)cc2)C[C@H]1C ZINC000502395396 911380669 /nfs/dbraw/zinc/38/06/69/911380669.db2.gz VJRQFQGHTYAABX-PQNGQFLHSA-N 2 0 400.607 4.135 20 0 HIADRP Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N(CCC[NH+](C)C)CCC[NH+](C)C ZINC000502607490 911616950 /nfs/dbraw/zinc/61/69/50/911616950.db2.gz KMCWRAQFKWXBDQ-UHFFFAOYSA-N 2 0 423.026 4.118 20 0 HIADRP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)NCC2([NH2+][C@H](C)c3ccccc3)CCCC2)C1 ZINC000502763270 911786315 /nfs/dbraw/zinc/78/63/15/911786315.db2.gz NUBRKLLKDVMSDS-RTWAWAEBSA-N 2 0 400.611 4.070 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)N3CCC[C@@H](C[N@@H+]4CCCC[C@H]4C)C3)CC2)CC1 ZINC000502807636 911824816 /nfs/dbraw/zinc/82/48/16/911824816.db2.gz GNZIZAFYQZRSQZ-CZKGODDJSA-N 2 0 418.670 4.326 20 0 HIADRP CN(C(=O)NCc1ccccc1C[NH+]1CCCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000502947313 911930752 /nfs/dbraw/zinc/93/07/52/911930752.db2.gz DVCIEIFHGOUHHO-UHFFFAOYSA-N 2 0 420.601 4.088 20 0 HIADRP CCC(CC)(CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000503037802 912007885 /nfs/dbraw/zinc/00/78/85/912007885.db2.gz IFSQFNFRAIADLO-LJQANCHMSA-N 2 0 402.627 4.458 20 0 HIADRP CN(C(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000503133932 912096182 /nfs/dbraw/zinc/09/61/82/912096182.db2.gz IOICDTOIEPUHRE-RUZDIDTESA-N 2 0 420.601 4.130 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000506469345 915066083 /nfs/dbraw/zinc/06/60/83/915066083.db2.gz HTWUCALDEPLBKC-ZWKOTPCHSA-N 2 0 422.411 4.364 20 0 HIADRP COc1ccccc1[C@@H](CNC(=O)c1cccc(C[NH+]2CCCC2)c1)[NH+]1CCCCC1 ZINC000513372813 921746065 /nfs/dbraw/zinc/74/60/65/921746065.db2.gz VSETXVIIKWZPPY-XMMPIXPASA-N 2 0 421.585 4.248 20 0 HIADRP CC(C)[NH+](CCN(C)C(=O)Nc1ccc(OCC[NH+]2CCCCC2)cc1)C(C)C ZINC000506758634 915457203 /nfs/dbraw/zinc/45/72/03/915457203.db2.gz IABLPZRNUWOXIN-UHFFFAOYSA-N 2 0 404.599 4.134 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506913744 915713500 /nfs/dbraw/zinc/71/35/00/915713500.db2.gz FQGVQMKUTZTZOX-YADHBBJMSA-N 2 0 414.638 4.323 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000506957649 915764075 /nfs/dbraw/zinc/76/40/75/915764075.db2.gz XDHOAJBXSURFDC-ZJSXRUAMSA-N 2 0 412.622 4.078 20 0 HIADRP COc1ccc(Cc2nc(C)c([C@@H](C)[NH2+]CC3(C)CC[NH+](C)CC3)s2)cc1OC ZINC000507419404 916188515 /nfs/dbraw/zinc/18/85/15/916188515.db2.gz HOCQFDDIGQXUAT-MRXNPFEDSA-N 2 0 417.619 4.442 20 0 HIADRP C[NH+]1CCC(C)(C[NH2+][C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)CC1 ZINC000507430272 916203247 /nfs/dbraw/zinc/20/32/47/916203247.db2.gz SBMYNBKMZBFDKM-NRFANRHFSA-N 2 0 421.006 4.154 20 0 HIADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 ZINC000507447516 916216693 /nfs/dbraw/zinc/21/66/93/916216693.db2.gz IJLCERHIGUMVPF-LJQANCHMSA-N 2 0 421.651 4.070 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)[C@@H]1CCCOC1 ZINC000507459675 916227455 /nfs/dbraw/zinc/22/74/55/916227455.db2.gz GKZOUDJKAQBXLL-RBUKOAKNSA-N 2 0 413.528 4.012 20 0 HIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CCN(CCC(F)(F)F)CC1 ZINC000507527078 916287609 /nfs/dbraw/zinc/28/76/09/916287609.db2.gz MLZKEQCNJWUHNX-UHFFFAOYSA-N 2 0 409.496 4.418 20 0 HIADRP O=C(Nc1ccc(-n2ccnc2)c(F)c1)[C@H]1C[N@H+](Cc2ccccc2)CCC1(F)F ZINC000507749773 916539127 /nfs/dbraw/zinc/53/91/27/916539127.db2.gz TZTPOKZNRMWUFI-GOSISDBHSA-N 2 0 414.431 4.107 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2ccc(OC(F)F)c(Br)c2)C[C@H](C)O1 ZINC000507920362 916800493 /nfs/dbraw/zinc/80/04/93/916800493.db2.gz UQZNLAJKWXBFHH-OKILXGFUSA-N 2 0 421.326 4.030 20 0 HIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2ccc(OC(F)F)c(Br)c2)C[C@@H](C)O1 ZINC000507920363 916800689 /nfs/dbraw/zinc/80/06/89/916800689.db2.gz UQZNLAJKWXBFHH-ZIAGYGMSSA-N 2 0 421.326 4.030 20 0 HIADRP CC[N@H+](Cc1ccc(OC)cc1OC)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000508659249 917423116 /nfs/dbraw/zinc/42/31/16/917423116.db2.gz DLOOATJNGXBQNQ-UHFFFAOYSA-N 2 0 411.590 4.256 20 0 HIADRP C[C@H]([NH2+]CCc1nc(-c2cccc(Cl)c2)no1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508718480 917480406 /nfs/dbraw/zinc/48/04/06/917480406.db2.gz NULGHKQIEUSAQF-PXNSSMCTSA-N 2 0 410.949 4.433 20 0 HIADRP COc1ccccc1[C@H](CN[C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCCC1 ZINC000508719490 917480711 /nfs/dbraw/zinc/48/07/11/917480711.db2.gz PYTOVLVQSFMWQS-PFATUAPWSA-N 2 0 407.602 4.332 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)N[C@@H](C)[C@H](c1ccccc1C)[NH+](C)C ZINC000508915794 917672269 /nfs/dbraw/zinc/67/22/69/917672269.db2.gz GKQOPWIKINKVSO-GBXCKJPGSA-N 2 0 410.606 4.280 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000509453473 918105688 /nfs/dbraw/zinc/10/56/88/918105688.db2.gz YLNPHGBFOWEWFG-RRPNLBNLSA-N 2 0 423.564 4.334 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CC[C@H](C)[N@H+](Cc2ccccc2)CC1)c1ccco1 ZINC000509592495 918241131 /nfs/dbraw/zinc/24/11/31/918241131.db2.gz UFDPMCWYZWLMPH-JAXLGGSGSA-N 2 0 412.578 4.015 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1)c1ccco1 ZINC000509595925 918246051 /nfs/dbraw/zinc/24/60/51/918246051.db2.gz LKLHIEUVMGJRLA-DOIPELPJSA-N 2 0 404.599 4.005 20 0 HIADRP C[C@@H]1C[C@@H](CCNC(=O)NCCCC[N@@H+]2CCCC[C@H]2C)C[NH+]1Cc1ccccc1 ZINC000509793915 918401179 /nfs/dbraw/zinc/40/11/79/918401179.db2.gz YJZZZFDLOZFTTO-CQOQZXRMSA-N 2 0 414.638 4.241 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000510388666 918867636 /nfs/dbraw/zinc/86/76/36/918867636.db2.gz KGOIJXCGBFWOMK-QGZVFWFLSA-N 2 0 411.571 4.198 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCc2ccccc2C[N@@H+](C)C(C)C)[NH+]2CCCC2)o1 ZINC000510457399 918912436 /nfs/dbraw/zinc/91/24/36/918912436.db2.gz DRMSNZSSOGTKKQ-JOCHJYFZSA-N 2 0 412.578 4.065 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccsc1 ZINC000510535605 918980487 /nfs/dbraw/zinc/98/04/87/918980487.db2.gz FDBAJZRRXPMROX-DBXWQHBBSA-N 2 0 406.640 4.083 20 0 HIADRP O=C(Cc1ccccc1)N1CCC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000511003899 919562762 /nfs/dbraw/zinc/56/27/62/919562762.db2.gz XFHLEPWFLDDBCL-SSUZURRFSA-N 2 0 417.597 4.005 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C(=O)N1CCc2sccc2C1 ZINC000511022464 919593417 /nfs/dbraw/zinc/59/34/17/919593417.db2.gz PMGHMFGTFMVAGA-RBUKOAKNSA-N 2 0 411.615 4.186 20 0 HIADRP O=C(Nc1ccccc1)N1CC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000511025790 919598770 /nfs/dbraw/zinc/59/87/70/919598770.db2.gz FXDHREUFJXMSMA-VLYJIQRVSA-N 2 0 418.585 4.183 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000511375896 919975987 /nfs/dbraw/zinc/97/59/87/919975987.db2.gz FVCJVALODMVCMG-DNQXCXABSA-N 2 0 416.009 4.342 20 0 HIADRP C[C@H]([NH2+]C1CCC(C(=O)OC(C)(C)C)CC1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000511381237 919983703 /nfs/dbraw/zinc/98/37/03/919983703.db2.gz IKCOJVNVDHAZQB-ZJRDLVKKSA-N 2 0 419.585 4.129 20 0 HIADRP C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000512148767 920890547 /nfs/dbraw/zinc/89/05/47/920890547.db2.gz YNLKEGMOHDJCOE-CHWSQXEVSA-N 2 0 403.876 4.150 20 0 HIADRP C[C@H]1C[NH+](CC2CC[NH+](Cc3cn(C)nc3-c3ccccc3Cl)CC2)C[C@H](C)O1 ZINC000512176846 920915413 /nfs/dbraw/zinc/91/54/13/920915413.db2.gz DZJACBMFZORFKO-ROUUACIJSA-N 2 0 416.997 4.062 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccccc2N(C)C2CC[NH+](C)CC2)C1 ZINC000512199803 920945560 /nfs/dbraw/zinc/94/55/60/920945560.db2.gz DOSINKSQXKZCIK-DHIUTWEWSA-N 2 0 412.666 4.303 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](CC(=O)N2CCC[C@@H]2c2ccc(OCC)cc2)CC1 ZINC000512264214 921022053 /nfs/dbraw/zinc/02/20/53/921022053.db2.gz LRYFAPDKIZNYIF-XMMPIXPASA-N 2 0 415.622 4.193 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](CC(=O)N(Cc2cccc(F)c2)C(C)(C)C)CC1 ZINC000512263704 921022340 /nfs/dbraw/zinc/02/23/40/921022340.db2.gz JRJFKYVVZYAVGS-UHFFFAOYSA-N 2 0 405.602 4.397 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512337858 921082765 /nfs/dbraw/zinc/08/27/65/921082765.db2.gz UZRCHEVCKTXFCG-HIUFNZKISA-N 2 0 423.601 4.227 20 0 HIADRP Cc1nc(COc2ccc(C[NH2+]CC[C@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)cc2)no1 ZINC000513546022 921883780 /nfs/dbraw/zinc/88/37/80/921883780.db2.gz VIYHXQVSSUEQCB-CVDCTZTESA-N 2 0 420.557 4.347 20 0 HIADRP FC(F)(F)CN1CCC([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000513665844 921988676 /nfs/dbraw/zinc/98/86/76/921988676.db2.gz HSPHEWHCGSNUJW-KSEOMHKRSA-N 2 0 409.540 4.294 20 0 HIADRP FC(F)(F)CN1CCC([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000513665839 921988707 /nfs/dbraw/zinc/98/87/07/921988707.db2.gz HSPHEWHCGSNUJW-BAGYTPMASA-N 2 0 409.540 4.294 20 0 HIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000513915817 922239777 /nfs/dbraw/zinc/23/97/77/922239777.db2.gz XRHHCNIMHDZPOF-XMMPIXPASA-N 2 0 405.586 4.313 20 0 HIADRP Cc1ccccc1[C@@H](OC[C@H](O)C[N@@H+](C)C1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000514005201 922330179 /nfs/dbraw/zinc/33/01/79/922330179.db2.gz DHJYFCVMTGQKBW-RSXGOPAZSA-N 2 0 410.602 4.267 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCc2ccccc2C[NH+]2CCCCC2)[NH+](C)C)cc1 ZINC000514012250 922337549 /nfs/dbraw/zinc/33/75/49/922337549.db2.gz ZRFHATATEBFURO-XMMPIXPASA-N 2 0 408.590 4.083 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)N[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000514023325 922345250 /nfs/dbraw/zinc/34/52/50/922345250.db2.gz WMLNOOSSHQKKDU-GBXCKJPGSA-N 2 0 408.590 4.163 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)[NH+](C)C)cc1 ZINC000514031706 922353986 /nfs/dbraw/zinc/35/39/86/922353986.db2.gz WTGKYHCPVVTVRM-XMMPIXPASA-N 2 0 408.590 4.083 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2nnc3ccc(C(F)(F)F)cn32)CC1 ZINC000514099179 922423847 /nfs/dbraw/zinc/42/38/47/922423847.db2.gz LZZNTPFMKNLLEK-UHFFFAOYSA-N 2 0 417.479 4.281 20 0 HIADRP COc1ccc(C[C@@H]([NH2+]CC2(SC)CC[NH+](C)CC2)c2ccc(OC)cc2)cc1 ZINC000515097153 922910595 /nfs/dbraw/zinc/91/05/95/922910595.db2.gz FKHRDOKJKPLOJN-HSZRJFAPSA-N 2 0 414.615 4.405 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c2cccs2)CC1 ZINC000515290952 923037070 /nfs/dbraw/zinc/03/70/70/923037070.db2.gz NISVRPVYAJGEQP-SFHVURJKSA-N 2 0 406.640 4.130 20 0 HIADRP CCOc1ccc(NC(=O)[C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000515521762 923151737 /nfs/dbraw/zinc/15/17/37/923151737.db2.gz UUBATNOLASUJMC-UXHICEINSA-N 2 0 409.574 4.434 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C(=O)Nc1ccc(F)cc1F ZINC000515756205 923329136 /nfs/dbraw/zinc/32/91/36/923329136.db2.gz QPBTZOIEFPYKOP-SJORKVTESA-N 2 0 401.501 4.314 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)N2CCC(CC[NH+](C)C)CC2)C1 ZINC000515802596 923360931 /nfs/dbraw/zinc/36/09/31/923360931.db2.gz YAMZGTUSPNJGBI-SFTDATJTSA-N 2 0 414.638 4.038 20 0 HIADRP C[NH+](C)Cc1ccc(-c2noc([C@@]34CCC[C@@H]3C[N@H+](Cc3ccccc3)C4)n2)cc1 ZINC000516212829 923604518 /nfs/dbraw/zinc/60/45/18/923604518.db2.gz PUOMGXDQDMZZPZ-RCZVLFRGSA-N 2 0 402.542 4.352 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2CC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000516790935 923888658 /nfs/dbraw/zinc/88/86/58/923888658.db2.gz WMLGIKUCAIHMBU-GMKZXUHWSA-N 2 0 400.513 4.280 20 0 HIADRP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2CC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000516790936 923888870 /nfs/dbraw/zinc/88/88/70/923888870.db2.gz WMLGIKUCAIHMBU-JRFVFWCSSA-N 2 0 400.513 4.280 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)NCC[N@H+](C)C2CCCC2)cc1 ZINC000517084199 923988821 /nfs/dbraw/zinc/98/88/21/923988821.db2.gz KHQFMDVTJMGEJH-UHFFFAOYSA-N 2 0 408.590 4.089 20 0 HIADRP CCCOc1c(Br)cc(Br)cc1C[NH2+]CCCC[NH+](C)C ZINC000517552554 924261302 /nfs/dbraw/zinc/26/13/02/924261302.db2.gz LJRMTJOJIXQKDU-UHFFFAOYSA-N 2 0 422.205 4.432 20 0 HIADRP CN1CC[NH+](CC2CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)CC2)CC1 ZINC000517789925 926837140 /nfs/dbraw/zinc/83/71/40/926837140.db2.gz LNRVYYKMAAOIJH-UHFFFAOYSA-N 2 0 405.630 4.047 20 0 HIADRP CC[NH+]1CCC(NC(=O)C[N@H+](Cc2ccc(-c3ccccc3F)s2)C(C)C)CC1 ZINC000517862370 926867489 /nfs/dbraw/zinc/86/74/89/926867489.db2.gz UDHDNTIQYXHRDV-UHFFFAOYSA-N 2 0 417.594 4.365 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3csc(C(C)(C)C)n3)CC2)c1 ZINC000518271542 927130850 /nfs/dbraw/zinc/13/08/50/927130850.db2.gz YNAMWYDQZCPEOI-UHFFFAOYSA-N 2 0 400.636 4.441 20 0 HIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+]Cc1ccc(-c2ccc(Br)cc2)o1 ZINC000518981152 927672640 /nfs/dbraw/zinc/67/26/40/927672640.db2.gz LRRPPGWOVGKXPF-GOSISDBHSA-N 2 0 407.352 4.036 20 0 HIADRP CC[NH+](CC)CCN(Cc1ccccc1)C(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000519414969 927932928 /nfs/dbraw/zinc/93/29/28/927932928.db2.gz SKOUHUIXXLTDBO-UHFFFAOYSA-N 2 0 407.602 4.269 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)[C@@H]2CCC[N@H+](Cc3cccc(F)c3)C2)c1 ZINC000519445624 927952655 /nfs/dbraw/zinc/95/26/55/927952655.db2.gz PTFYRDUKIRLCAB-HSZRJFAPSA-N 2 0 411.565 4.196 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)[C@H]1CCC[NH+](Cc2cccc(F)c2)C1 ZINC000520112702 928318703 /nfs/dbraw/zinc/31/87/03/928318703.db2.gz MNDNMIDHGHHYGG-QHCPKHFHSA-N 2 0 411.565 4.194 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(OC)c4ccccc34)cc2)CC1 ZINC000521817909 929476499 /nfs/dbraw/zinc/47/64/99/929476499.db2.gz YCHDOWJZOWZZLB-UHFFFAOYSA-N 2 0 403.570 4.276 20 0 HIADRP CC[N@@H+]1CCCC[C@H]1C(=O)N1CCC([NH+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000524594996 929705205 /nfs/dbraw/zinc/70/52/05/929705205.db2.gz DBVTXRJWOCCRPJ-FQEVSTJZSA-N 2 0 411.512 4.003 20 0 HIADRP C[N@H+](C[C@@H](O)COc1ccc2ccccc2c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525269549 930120797 /nfs/dbraw/zinc/12/07/97/930120797.db2.gz AQZFKSREXUNAID-WIOPSUGQSA-N 2 0 404.554 4.033 20 0 HIADRP COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000525709148 930411830 /nfs/dbraw/zinc/41/18/30/930411830.db2.gz WARWUMDQUYYUES-AZUAARDMSA-N 2 0 420.557 4.129 20 0 HIADRP COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000525709150 930412197 /nfs/dbraw/zinc/41/21/97/930412197.db2.gz WARWUMDQUYYUES-QUCCMNQESA-N 2 0 420.557 4.129 20 0 HIADRP CN1CC[NH+](CCCC[NH2+][C@@H](c2ccc(Br)cc2Cl)C2CC2)CC1 ZINC000525857923 930469260 /nfs/dbraw/zinc/46/92/60/930469260.db2.gz GSQXDMZZAUOVOV-LJQANCHMSA-N 2 0 414.819 4.171 20 0 HIADRP C[C@H](Sc1ccccc1)c1ccc(NC(=O)N(CC[NH+](C)C)CC[NH+](C)C)cc1 ZINC000526156093 930542860 /nfs/dbraw/zinc/54/28/60/930542860.db2.gz IZXGPQKKQTUKID-IBGZPJMESA-N 2 0 414.619 4.497 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)N1CC[C@H](C[NH+]2CCCC2)C1)c1cccc(C(F)(F)F)c1 ZINC000530582516 930758419 /nfs/dbraw/zinc/75/84/19/930758419.db2.gz JKZAUZIHVBOAAB-YLJYHZDGSA-N 2 0 411.512 4.033 20 0 HIADRP Cc1nn(-c2ccccc2)cc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000530664811 930792298 /nfs/dbraw/zinc/79/22/98/930792298.db2.gz KUPZLXIAWJUWIA-UHFFFAOYSA-N 2 0 418.585 4.342 20 0 HIADRP Cc1cc(F)ccc1-c1ccc(C[NH2+]CC2CC[NH+](CC(=O)NC(C)(C)C)CC2)o1 ZINC000530714028 930805684 /nfs/dbraw/zinc/80/56/84/930805684.db2.gz LIXDYBRRRDAJSX-UHFFFAOYSA-N 2 0 415.553 4.110 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCc2ccccc2C[N@H+]2CCCC[C@H]2C)CC1 ZINC000530727777 930810066 /nfs/dbraw/zinc/81/00/66/930810066.db2.gz RFQBXIPOPREVSX-OAQYLSRUSA-N 2 0 420.601 4.297 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@H](C)CC(=O)Nc2ccccc2)CC1 ZINC000530906668 930855284 /nfs/dbraw/zinc/85/52/84/930855284.db2.gz ZCQPGTUOAICIFT-MOPGFXCFSA-N 2 0 412.553 4.036 20 0 HIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3ccc(OCc4ccccn4)cc3)CC2)C[C@H](C)O1 ZINC000530939605 930863134 /nfs/dbraw/zinc/86/31/34/930863134.db2.gz CYJLJWYFZLPEGW-VXKWHMMOSA-N 2 0 423.601 4.372 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NC[C@@H](CC(C)C)[NH2+][C@H](C)c2ccccc2)CC1 ZINC000531460438 931066046 /nfs/dbraw/zinc/06/60/46/931066046.db2.gz OXXJVHYAULMFOZ-ZJSXRUAMSA-N 2 0 422.617 4.488 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531682355 931150897 /nfs/dbraw/zinc/15/08/97/931150897.db2.gz MWQGODATWYXEQO-AQNXPRMDSA-N 2 0 414.615 4.419 20 0 HIADRP C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000531692058 931156114 /nfs/dbraw/zinc/15/61/14/931156114.db2.gz DCLLEGAQCKYGLA-QGZVFWFLSA-N 2 0 410.400 4.268 20 0 HIADRP C[C@@H](CC(=O)Nc1cccc(Br)c1)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531711454 931170166 /nfs/dbraw/zinc/17/01/66/931170166.db2.gz DUAMHKSASDSWTN-AWEZNQCLSA-N 2 0 422.342 4.157 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]Cc2ccc(F)cc2Cl)c1)C1CCOCC1 ZINC000531754407 931183125 /nfs/dbraw/zinc/18/31/25/931183125.db2.gz DJNXPXVXSGWMJS-UHFFFAOYSA-N 2 0 406.929 4.259 20 0 HIADRP CN(c1ccccc1C[NH2+]Cc1csc(Br)c1)C1CC[NH+](C)CC1 ZINC000531848962 931218718 /nfs/dbraw/zinc/21/87/18/931218718.db2.gz JOJXRATXGPRRBN-UHFFFAOYSA-N 2 0 408.409 4.331 20 0 HIADRP CN(c1ccccc1CNC1CC[NH+](CCc2ccccc2)CC1)C1CC[NH+](C)CC1 ZINC000531851202 931220632 /nfs/dbraw/zinc/22/06/32/931220632.db2.gz KANNQJWSYVXPBD-UHFFFAOYSA-N 2 0 420.645 4.014 20 0 HIADRP Cc1nccn1-c1ccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1F ZINC000531851322 931220988 /nfs/dbraw/zinc/22/09/88/931220988.db2.gz CGZWHKBKSFGYOS-UHFFFAOYSA-N 2 0 421.564 4.140 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000531945159 931257907 /nfs/dbraw/zinc/25/79/07/931257907.db2.gz CAXSSXCGORGYPT-QRVBRYPASA-N 2 0 407.558 4.031 20 0 HIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1 ZINC000531959354 931265481 /nfs/dbraw/zinc/26/54/81/931265481.db2.gz YTQBTUWUKDTGMZ-MOPGFXCFSA-N 2 0 421.564 4.483 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000532193083 931343458 /nfs/dbraw/zinc/34/34/58/931343458.db2.gz OBTUIAMRMMMJMX-DQYPLSBCSA-N 2 0 403.876 4.292 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc4c(c3)CCC(=O)N4)CC2)cc1 ZINC000532205508 931350244 /nfs/dbraw/zinc/35/02/44/931350244.db2.gz ASXDSWPLDJJSCS-SFHVURJKSA-N 2 0 407.558 4.143 20 0 HIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)c1 ZINC000532358484 931407625 /nfs/dbraw/zinc/40/76/25/931407625.db2.gz HQVFUMZAHLHZOV-UHFFFAOYSA-N 3 0 408.634 4.347 20 0 HIADRP C[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)Oc1ccccc1Cl ZINC000532358712 931407824 /nfs/dbraw/zinc/40/78/24/931407824.db2.gz XNJONTCXVBZWCJ-SFHVURJKSA-N 2 0 401.982 4.428 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccc(-n3ccnc3C)cc2)CC1 ZINC000532447216 931438284 /nfs/dbraw/zinc/43/82/84/931438284.db2.gz XOLMLCVXUDWROK-OAQYLSRUSA-N 2 0 417.601 4.169 20 0 HIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]Cc3ccc(N4CC[NH+](C)CC4)nc3)cs2)cs1 ZINC000532451523 931439466 /nfs/dbraw/zinc/43/94/66/931439466.db2.gz BKYSIOAMRRDMDF-OAHLLOKOSA-N 2 0 413.616 4.178 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(SCC(F)F)cc1 ZINC000532452163 931440369 /nfs/dbraw/zinc/44/03/69/931440369.db2.gz YBQFWIDMGXKVAE-INIZCTEOSA-N 2 0 406.546 4.041 20 0 HIADRP CCC[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1cccc(C(F)(F)F)c1 ZINC000532451724 931440541 /nfs/dbraw/zinc/44/05/41/931440541.db2.gz IVHHKSLTDGOGLT-FQEVSTJZSA-N 2 0 406.496 4.483 20 0 HIADRP O=C(c1ccccc1Cl)N1CCC([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)CC1 ZINC000532451843 931440876 /nfs/dbraw/zinc/44/08/76/931440876.db2.gz FODSZLXUNZMGSA-UHFFFAOYSA-N 2 0 411.977 4.330 20 0 HIADRP C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000532454257 931441421 /nfs/dbraw/zinc/44/14/21/931441421.db2.gz GYTPPJPAUYSJGO-IBGZPJMESA-N 2 0 413.993 4.463 20 0 HIADRP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)C[NH2+]C2CCN(C(=O)c3ccccc3Cl)CC2)C1 ZINC000532478440 931454947 /nfs/dbraw/zinc/45/49/47/931454947.db2.gz BLEWFUFLSMNSGK-HDICACEKSA-N 2 0 406.014 4.291 20 0 HIADRP CC[C@@H]([NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccccc1OC(F)F ZINC000532481119 931455442 /nfs/dbraw/zinc/45/54/42/931455442.db2.gz OXLKUMSYHOTUKE-NHCUHLMSSA-N 2 0 403.517 4.317 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccc(S(C)(=O)=O)cc1 ZINC000532514905 931470893 /nfs/dbraw/zinc/47/08/93/931470893.db2.gz VYQSSLKZBFWRLG-QGZVFWFLSA-N 2 0 421.006 4.306 20 0 HIADRP C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000532551144 931519393 /nfs/dbraw/zinc/51/93/93/931519393.db2.gz XXPCMJLNFPVIGW-OAHLLOKOSA-N 2 0 408.384 4.163 20 0 HIADRP COc1ccc2cc(CN(C)C(=O)[C@@H](C)N3CCC[C@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000532586097 931542074 /nfs/dbraw/zinc/54/20/74/931542074.db2.gz UDGBYEBMNUELKC-YKSBVNFPSA-N 2 0 423.601 4.146 20 0 HIADRP Cc1ccn(-c2ccccc2C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)n1 ZINC000532628515 931560208 /nfs/dbraw/zinc/56/02/08/931560208.db2.gz MHDSKAZOADLPRS-UHFFFAOYSA-N 2 0 403.574 4.001 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NC1CCC(C[NH+](C)C)CC1)c1cccc(C(F)(F)F)c1 ZINC000532754656 931623269 /nfs/dbraw/zinc/62/32/69/931623269.db2.gz LOZHFQNFFLCPJT-RRWXTXHCSA-N 2 0 413.528 4.325 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000532794484 931632945 /nfs/dbraw/zinc/63/29/45/931632945.db2.gz OMYCBHDXBTWSDF-GMAHTHKFSA-N 2 0 420.601 4.023 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NCC2(CC)CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC000533133567 931777944 /nfs/dbraw/zinc/77/79/44/931777944.db2.gz WXYZCNXBERFGHU-GMAHTHKFSA-N 2 0 414.638 4.193 20 0 HIADRP C[N@H+](CCc1ccc2c(c1)CCO2)[C@@H]1CCC[NH+](CCc2ccc3c(c2)CCO3)CC1 ZINC000533147356 931785239 /nfs/dbraw/zinc/78/52/39/931785239.db2.gz MZPYRDDSGKYHDZ-RUZDIDTESA-N 2 0 420.597 4.128 20 0 HIADRP C[C@H](c1ccccc1)N(C)C(=O)C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534230595 932350209 /nfs/dbraw/zinc/35/02/09/932350209.db2.gz QMJOIAKUUUPIIT-JOCHJYFZSA-N 2 0 405.586 4.194 20 0 HIADRP C[N@@H+]1CC[C@@H](CNC(=O)NCC(C)(C)[NH+]2CCCCC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000534234217 932353968 /nfs/dbraw/zinc/35/39/68/932353968.db2.gz BRIWIJDDLPVZTP-FXAWDEMLSA-N 2 0 424.992 4.036 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)NCC(C)(C)[NH+]2CCCCC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000534234221 932354194 /nfs/dbraw/zinc/35/41/94/932354194.db2.gz BRIWIJDDLPVZTP-XLIONFOSSA-N 2 0 424.992 4.036 20 0 HIADRP C[NH+](C)Cc1ccc(CNC(=O)Nc2ccc(CC[NH+]3CCCCC3)cc2)cc1F ZINC000534968609 932867466 /nfs/dbraw/zinc/86/74/66/932867466.db2.gz YUWVOSONYMWHPF-UHFFFAOYSA-N 2 0 412.553 4.237 20 0 HIADRP C[NH+](C)[C@@H](CNC(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1)Cc1ccccc1 ZINC000535256521 933039832 /nfs/dbraw/zinc/03/98/32/933039832.db2.gz ASONFRURFUXACL-XMMPIXPASA-N 2 0 408.590 4.009 20 0 HIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cc(F)cc(Br)c1 ZINC000537306399 933707731 /nfs/dbraw/zinc/70/77/31/933707731.db2.gz GUIUMSRLNRYFCT-UFYCRDLUSA-N 2 0 413.375 4.397 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cnc(C4CCCC4)s3)CC2)CC1 ZINC000537621472 938336411 /nfs/dbraw/zinc/33/64/11/938336411.db2.gz RUHHMDASPPFFBJ-UHFFFAOYSA-N 2 0 404.668 4.429 20 0 HIADRP CC[N@@H+](Cc1c[nH]nc1-c1ccc(OC)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000537660478 938349009 /nfs/dbraw/zinc/34/90/09/938349009.db2.gz GAHOHBRHVUHRTD-NRFANRHFSA-N 2 0 404.558 4.429 20 0 HIADRP CSc1cccc(NC(=O)[C@@H](C)[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000537845386 938388440 /nfs/dbraw/zinc/38/84/40/938388440.db2.gz JJUGWLSPTGGJGZ-GOSISDBHSA-N 2 0 412.603 4.369 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000537955455 938432452 /nfs/dbraw/zinc/43/24/52/938432452.db2.gz WWQAUBXDMBJCMY-WDNCENIBSA-N 2 0 412.549 4.433 20 0 HIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1F ZINC000537962437 938436399 /nfs/dbraw/zinc/43/63/99/938436399.db2.gz ZKWXDXKQWCTZHQ-UDIDDNNKSA-N 2 0 404.570 4.218 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc2cc(OC)ccc2c1 ZINC000537969590 938439490 /nfs/dbraw/zinc/43/94/90/938439490.db2.gz GYNWZKQRSJZHAI-VWLOTQADSA-N 2 0 419.569 4.381 20 0 HIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1 ZINC000537969262 938439638 /nfs/dbraw/zinc/43/96/38/938439638.db2.gz RMBOJTPPXKQVRI-HOYKHHGWSA-N 2 0 409.549 4.065 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H]2CCSc3ccc(Br)cc32)C[C@H](C)O1 ZINC000537973552 938442601 /nfs/dbraw/zinc/44/26/01/938442601.db2.gz PGXRRXMCGGLINY-DAYGRLMNSA-N 2 0 413.425 4.465 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000537990765 938452187 /nfs/dbraw/zinc/45/21/87/938452187.db2.gz LWOLGYAHKJRDSB-FQEVSTJZSA-N 2 0 409.574 4.104 20 0 HIADRP C[C@@H](CCc1ccc2c(c1)OCO2)[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538275578 938581078 /nfs/dbraw/zinc/58/10/78/938581078.db2.gz HKSVJVPWVYNNGR-RXVVDRJESA-N 2 0 408.542 4.314 20 0 HIADRP COc1ccc(C[C@@H](C)[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1OC ZINC000538299316 938586667 /nfs/dbraw/zinc/58/66/67/938586667.db2.gz TXNWNXCOTVMVAQ-NQIIRXRSSA-N 2 0 410.558 4.213 20 0 HIADRP COCCCOc1cccc(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c1 ZINC000538307532 938588752 /nfs/dbraw/zinc/58/87/52/938588752.db2.gz BIFACAWMGKYFMO-HSZRJFAPSA-N 2 0 410.558 4.180 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(Br)c(OC(F)F)c(OC)c2)[C@H](C)C1 ZINC000538718318 938689589 /nfs/dbraw/zinc/68/95/89/938689589.db2.gz JXHGSZUAYFAGRF-IUODEOHRSA-N 2 0 421.326 4.221 20 0 HIADRP CC[N@@H+](Cc1ccc(OCc2noc(C)n2)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538763787 938705044 /nfs/dbraw/zinc/70/50/44/938705044.db2.gz VHFZGNLRLURVJQ-QHCPKHFHSA-N 2 0 420.557 4.301 20 0 HIADRP COCCc1nc(C)c([C@H](C)[NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)s1 ZINC000538867693 938728165 /nfs/dbraw/zinc/72/81/65/938728165.db2.gz OUALCVMLQPNPMV-KRWDZBQOSA-N 2 0 417.619 4.212 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)c2ccc(Nc3cc[nH+]cc3)cc2)CC1)CC1CC1 ZINC000538916060 938737468 /nfs/dbraw/zinc/73/74/68/938737468.db2.gz GXLQKEWHFNSUQJ-UHFFFAOYSA-N 2 0 406.574 4.221 20 0 HIADRP Clc1ccc(OC[C@H]2CCCO2)c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000538969243 938754769 /nfs/dbraw/zinc/75/47/69/938754769.db2.gz MFBPHXOPVKZUNV-JOCHJYFZSA-N 2 0 415.965 4.299 20 0 HIADRP CC[C@H]([NH2+][C@H](C)c1ccc(S(=O)(=O)NCCC[NH+](C)C)cc1)c1ccc(C)cc1 ZINC000539041149 938778127 /nfs/dbraw/zinc/77/81/27/938778127.db2.gz SOYDDGNNIJMYBA-XXBNENTESA-N 2 0 417.619 4.027 20 0 HIADRP CCC1(C[NH2+][C@H](C)c2ccc(S(C)(=O)=O)cc2)CC[NH+](Cc2ccccc2)CC1 ZINC000539042000 938778701 /nfs/dbraw/zinc/77/87/01/938778701.db2.gz ADOGEYQSXUBNJS-HXUWFJFHSA-N 2 0 414.615 4.433 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000539044062 938780125 /nfs/dbraw/zinc/78/01/25/938780125.db2.gz IKYILMVSHVQYDF-FNVCAUGXSA-N 2 0 403.517 4.001 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)CC(=O)Nc2ccc(Br)cc2)C1 ZINC000539052679 938784138 /nfs/dbraw/zinc/78/41/38/938784138.db2.gz KJIXMIRHPCYUFE-IAGOWNOFSA-N 2 0 410.400 4.124 20 0 HIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C2CC[NH+]([C@@H]4CCC[C@@H]4O)CC2)CCC3)cc1 ZINC000539059616 938787256 /nfs/dbraw/zinc/78/72/56/938787256.db2.gz KIKSCJHJJSDHLO-FCEUIQTBSA-N 2 0 411.615 4.463 20 0 HIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000539063476 938788908 /nfs/dbraw/zinc/78/89/08/938788908.db2.gz GWOWBBUPBVHVHM-YXUGBTPSSA-N 2 0 401.378 4.117 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc(Cl)s1 ZINC000539069844 938793196 /nfs/dbraw/zinc/79/31/96/938793196.db2.gz AWNNDOGHHSKSQH-GOSISDBHSA-N 2 0 405.995 4.468 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1nc2ccc(Cl)cc2n1C ZINC000539201231 938818506 /nfs/dbraw/zinc/81/85/06/938818506.db2.gz SBJGACXAIJCPIY-INIZCTEOSA-N 2 0 412.965 4.034 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H](c3ccc(Cl)cc3)C3CC3)c2)C1 ZINC000539201396 938818847 /nfs/dbraw/zinc/81/88/47/938818847.db2.gz YOBHRNNNROEBJP-GMAHTHKFSA-N 2 0 411.977 4.278 20 0 HIADRP C[C@H]([NH2+][C@@H](C)C(C)(C)c1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000539254161 938827005 /nfs/dbraw/zinc/82/70/05/938827005.db2.gz NEUAAEZWILLRCF-SFTDATJTSA-N 2 0 407.602 4.112 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]Cc1ccccc1Cn1cccn1)c1ccccc1O2 ZINC000539370434 938850492 /nfs/dbraw/zinc/85/04/92/938850492.db2.gz VEGFMHVRXQZFBY-QHCPKHFHSA-N 2 0 402.542 4.009 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@H]1CCN(c3cccc(Cl)c3)C1)c1ccccc1O2 ZINC000539400506 938854882 /nfs/dbraw/zinc/85/48/82/938854882.db2.gz LXTZMALDTMEYLP-SIKLNZKXSA-N 2 0 411.977 4.497 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(F)c(NC2CC[NH+](C(C)(C)C)CC2)c1 ZINC000539645075 938893069 /nfs/dbraw/zinc/89/30/69/938893069.db2.gz FUQDMYZNIHRBSS-QGZVFWFLSA-N 2 0 404.574 4.313 20 0 HIADRP COc1cccc(NC2CC[NH+](Cc3ccccc3N(C)C3CC[NH+](C)CC3)CC2)c1 ZINC000539828806 938949078 /nfs/dbraw/zinc/94/90/78/938949078.db2.gz RFVQOTUASBKNJX-UHFFFAOYSA-N 2 0 422.617 4.302 20 0 HIADRP CCn1c2ccccc2c2cc(C[N@@H+]3CC[C@@H](N4CC[NH+](C(C)C)CC4)C3)ccc21 ZINC000539861695 938959766 /nfs/dbraw/zinc/95/97/66/938959766.db2.gz IHKYEVJBWSEPTM-JOCHJYFZSA-N 2 0 404.602 4.415 20 0 HIADRP CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)[C@@H](C)C1 ZINC000539874126 938963166 /nfs/dbraw/zinc/96/31/66/938963166.db2.gz KMHBFWDZMSWTSL-NZQKXSOJSA-N 2 0 400.611 4.155 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)[C@@H](C)C1 ZINC000539874128 938963256 /nfs/dbraw/zinc/96/32/56/938963256.db2.gz KMHBFWDZMSWTSL-REWPJTCUSA-N 2 0 400.611 4.155 20 0 HIADRP Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540043721 939046933 /nfs/dbraw/zinc/04/69/33/939046933.db2.gz HBKBZSAEKJVZRL-LEWJYISDSA-N 2 0 408.590 4.194 20 0 HIADRP Cc1cc(-c2noc(C[N@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)n2)ccc1F ZINC000540044050 939047176 /nfs/dbraw/zinc/04/71/76/939047176.db2.gz NAZMBUSONXAZBR-UHFFFAOYSA-N 2 0 409.509 4.318 20 0 HIADRP C[N@@H+](CCC(=O)N[C@H]1CCCc2ccccc21)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540045653 939048470 /nfs/dbraw/zinc/04/84/70/939048470.db2.gz TXUSIHVRJADXIX-VWLOTQADSA-N 2 0 420.601 4.204 20 0 HIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CCN(C(=O)CCc3ccccc3)CC2)CC1 ZINC000540119227 939079823 /nfs/dbraw/zinc/07/98/23/939079823.db2.gz LZGOYNUPSLWUJR-BWKNWUBXSA-N 2 0 411.634 4.243 20 0 HIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C3CCN([C@@H]4CCC[C@H]4O)CC3)s2)cc1 ZINC000540160140 939096198 /nfs/dbraw/zinc/09/61/98/939096198.db2.gz JVLGMNKPZRFOCF-IWMITWMQSA-N 2 0 415.603 4.156 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1cc(F)ccc1F ZINC000540169107 939100449 /nfs/dbraw/zinc/10/04/49/939100449.db2.gz KHHJWJMFBOMDOF-JOCHJYFZSA-N 2 0 401.501 4.031 20 0 HIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1 ZINC000540169022 939100810 /nfs/dbraw/zinc/10/08/10/939100810.db2.gz BOSLSHMJWVSYBO-KRWDZBQOSA-N 2 0 422.598 4.261 20 0 HIADRP CC[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1cc(C)ccc1OC ZINC000540171357 939102398 /nfs/dbraw/zinc/10/23/98/939102398.db2.gz UEKWQSDEMWHGIZ-QHCPKHFHSA-N 2 0 409.574 4.070 20 0 HIADRP CC(C)[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000540302739 939187782 /nfs/dbraw/zinc/18/77/82/939187782.db2.gz SJUSDZCISMBTPP-HXUWFJFHSA-N 2 0 406.496 4.339 20 0 HIADRP COc1ccccc1[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)C1CCCC1 ZINC000540315254 939191475 /nfs/dbraw/zinc/19/14/75/939191475.db2.gz DXRAQLYTLLCHFQ-DEOSSOPVSA-N 2 0 409.574 4.008 20 0 HIADRP Cc1cc([C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C2CC2)ccc1F ZINC000540317659 939192112 /nfs/dbraw/zinc/19/21/12/939192112.db2.gz ADJYCXDKVXAYTB-XMMPIXPASA-N 2 0 409.549 4.201 20 0 HIADRP CCSc1ccc([C@@H](C)[NH2+]CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000540401646 939235684 /nfs/dbraw/zinc/23/56/84/939235684.db2.gz NPLJIQPBBCBAML-LJQANCHMSA-N 2 0 411.615 4.361 20 0 HIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)CN1Cc1ccccc1 ZINC000540494352 939274441 /nfs/dbraw/zinc/27/44/41/939274441.db2.gz XSDPYBDZBDYTMQ-SFLYRZDNSA-N 2 0 405.586 4.227 20 0 HIADRP CCC[C@H]1CN(C(=O)C2CCN(c3cc[nH+]cc3C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000540533734 939293793 /nfs/dbraw/zinc/29/37/93/939293793.db2.gz ZVUZFDGUTJSJHS-DEOSSOPVSA-N 2 0 420.601 4.120 20 0 HIADRP CC(C)[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+]2CCCC2)cc1)c1ccc(F)c(F)c1 ZINC000540987049 939425119 /nfs/dbraw/zinc/42/51/19/939425119.db2.gz QTMNOZGLUMJTAZ-QHCPKHFHSA-N 2 0 415.528 4.277 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccc(Br)c(F)c1 ZINC000540990875 939426580 /nfs/dbraw/zinc/42/65/80/939426580.db2.gz XJFMRZBBAMLONX-BEFAXECRSA-N 2 0 421.354 4.396 20 0 HIADRP CC[NH+](CC)CCCC1CCN(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC000541151274 939477198 /nfs/dbraw/zinc/47/71/98/939477198.db2.gz UNVWVNNYDZAPBH-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)N(C[C@H]1CC[N@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000541573543 939558370 /nfs/dbraw/zinc/55/83/70/939558370.db2.gz NCKHXQGVBGINTF-HKUYNNGSSA-N 2 0 413.528 4.066 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(Oc4ccccc4)c(F)c3)CC2)CC1 ZINC000541667685 939596368 /nfs/dbraw/zinc/59/63/68/939596368.db2.gz WIEVVDUQFNZVSA-UHFFFAOYSA-N 2 0 411.565 4.468 20 0 HIADRP C[C@@H]1[NH+](Cc2ccc(C[N@@H+]3CCC4(CCOCC4)[C@@H]3C)cc2)CCC12CCOCC2 ZINC000541719096 939613795 /nfs/dbraw/zinc/61/37/95/939613795.db2.gz YONICPZIYWNLKB-VXKWHMMOSA-N 2 0 412.618 4.469 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3ccc(-c4nc5ccccc5s4)o3)CC2)CC1 ZINC000541759854 939622958 /nfs/dbraw/zinc/62/29/58/939622958.db2.gz UUJLPUWKUXNZIF-UHFFFAOYSA-N 2 0 424.614 4.406 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cccc(Br)c1 ZINC000541918050 939653750 /nfs/dbraw/zinc/65/37/50/939653750.db2.gz MBEGQWCUCWFSQK-IIBYNOLFSA-N 2 0 403.364 4.257 20 0 HIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO)c1ccccc1OC(F)F ZINC000541918974 939653919 /nfs/dbraw/zinc/65/39/19/939653919.db2.gz QWWYFKCMTNEHHS-FPOVZHCZSA-N 2 0 404.501 4.486 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1ccccc1Cl)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000542144325 939729284 /nfs/dbraw/zinc/72/92/84/939729284.db2.gz HZAYQYSJQBYMMY-GOSISDBHSA-N 2 0 406.014 4.321 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1CNc1cccc(NC(=O)C[NH+]2CCCCCC2)c1 ZINC000542311847 939795279 /nfs/dbraw/zinc/79/52/79/939795279.db2.gz XYPNECFQFFXIDU-UHFFFAOYSA-N 2 0 418.545 4.002 20 0 HIADRP Fc1ccc([C@@H]([NH2+]CCCN2CC[NH+](Cc3ccccc3)CC2)c2ccccc2)nc1 ZINC000542479552 939830130 /nfs/dbraw/zinc/83/01/30/939830130.db2.gz QNKYURAWLGSWHO-SANMLTNESA-N 2 0 418.560 4.108 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+]([C@@H]3CCCc4ccc(Br)cc43)CC2)CC1 ZINC000542591812 939847050 /nfs/dbraw/zinc/84/70/50/939847050.db2.gz NGJPBXBMMLKAHP-OAQYLSRUSA-N 2 0 420.439 4.176 20 0 HIADRP CCC1(C[NH2+][C@H](C)CS(=O)(=O)c2ccccc2)CC[NH+](Cc2ccccc2)CC1 ZINC000542707140 939855770 /nfs/dbraw/zinc/85/57/70/939855770.db2.gz HUHHTIDHYHFISK-OAQYLSRUSA-N 2 0 414.615 4.131 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(C)[C@H](C)C1CC[NH+](C)CC1)c1ccccc1Cl ZINC000542726008 939857213 /nfs/dbraw/zinc/85/72/13/939857213.db2.gz HLBMBOJTPADVDW-UTKZUKDTSA-N 2 0 409.018 4.095 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N2CC[NH+](C)[C@H](C)[C@H]2C)cc1)C[C@H]1CCCCO1 ZINC000542731621 939857585 /nfs/dbraw/zinc/85/75/85/939857585.db2.gz UICQRWMHLJCLSI-TXTKFYIRSA-N 2 0 416.610 4.022 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)CCN(C)c2cc[nH+]cc2)cc1)C[C@@H]1CCCCO1 ZINC000542784343 939860610 /nfs/dbraw/zinc/86/06/10/939860610.db2.gz PXJFSFLGSYVVSI-DEOSSOPVSA-N 2 0 424.589 4.326 20 0 HIADRP C[N@H+](Cc1ccccc1)Cc1cccc(C(=O)N2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000543118442 939955535 /nfs/dbraw/zinc/95/55/35/939955535.db2.gz HFHPKXLUOQINSW-VWLOTQADSA-N 2 0 405.586 4.409 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cc(-n3ccnc3)cs2)CC1 ZINC000543177520 939986114 /nfs/dbraw/zinc/98/61/14/939986114.db2.gz UVHOQGCLMHQTRC-QGZVFWFLSA-N 2 0 413.566 4.066 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC([C@@H]2C(=O)Nc3cc(Cl)ccc32)CC1 ZINC000543393388 940050178 /nfs/dbraw/zinc/05/01/78/940050178.db2.gz CKPHKYXFWPPIJA-QFIPXVFZSA-N 2 0 421.932 4.177 20 0 HIADRP COc1ccc(Oc2ccc(C[N@@H+]3CC[C@H](N4CC[NH+](C(C)C)CC4)C3)cc2)cc1 ZINC000543397359 940050738 /nfs/dbraw/zinc/05/07/38/940050738.db2.gz JEQLSHZXMJSZPU-QFIPXVFZSA-N 2 0 409.574 4.088 20 0 HIADRP CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000543405319 940054018 /nfs/dbraw/zinc/05/40/18/940054018.db2.gz XBYQTBGVHZPENE-CLOONOSVSA-N 2 0 406.549 4.079 20 0 HIADRP COC(=O)COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000543408218 940055397 /nfs/dbraw/zinc/05/53/97/940055397.db2.gz AHEFAPUYOAMNOB-WOJBJXKFSA-N 2 0 410.558 4.464 20 0 HIADRP CC1CC[NH+](C[C@@H]2CCCN(C(=O)C3(C)CC[NH+](Cc4ccccc4)CC3)C2)CC1 ZINC000543431648 940062339 /nfs/dbraw/zinc/06/23/39/940062339.db2.gz OOURSCBBLLETPX-DEOSSOPVSA-N 2 0 411.634 4.259 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cnn1-c1cccc(Cl)c1 ZINC000543775821 940182622 /nfs/dbraw/zinc/18/26/22/940182622.db2.gz KXPHAGMTVUESGS-HXOBKFHXSA-N 2 0 424.976 4.252 20 0 HIADRP O[C@@H]1CC[N@H+](Cc2ccccc2C[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000543776864 940183303 /nfs/dbraw/zinc/18/33/03/940183303.db2.gz PGPXBLNFFGJUQQ-XMMPIXPASA-N 2 0 408.492 4.411 20 0 HIADRP O=C(C[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000543989241 940285059 /nfs/dbraw/zinc/28/50/59/940285059.db2.gz AQMMMDODQHKTPS-XMMPIXPASA-N 2 0 411.977 4.293 20 0 HIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000543998486 940291353 /nfs/dbraw/zinc/29/13/53/940291353.db2.gz LRSMYSQYOJSIPK-KGLIPLIRSA-N 2 0 405.892 4.397 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000563849167 945314193 /nfs/dbraw/zinc/31/41/93/945314193.db2.gz LRWQGYOFGYWJGN-PBEJRMEISA-N 2 0 423.384 4.233 20 0 HIADRP C[NH+](C)C1CCN(CC[NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000544355624 940399226 /nfs/dbraw/zinc/39/92/26/940399226.db2.gz WZVYCUAHWJATSU-RUZDIDTESA-N 2 0 406.549 4.079 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+][C@H]2CCO[C@H](c3ccc(F)cc3)C2)CC1 ZINC000544596901 940487248 /nfs/dbraw/zinc/48/72/48/940487248.db2.gz ZKWQWQPQLOWAPL-ZCYQVOJMSA-N 2 0 411.565 4.368 20 0 HIADRP CC(C)C[C@H](CNC(=O)N(C)[C@H](C)C1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000544650515 940498426 /nfs/dbraw/zinc/49/84/26/940498426.db2.gz PBVICVUCJGAXKF-MIZPHKNDSA-N 2 0 402.627 4.124 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)CC1 ZINC000545459412 940570893 /nfs/dbraw/zinc/57/08/93/940570893.db2.gz VPIMEPZHPNKHOH-WXFUMESZSA-N 2 0 413.993 4.376 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(c2nc(-c3ccccc3C[NH+]3CCCC3)no2)CC1 ZINC000545530728 940573477 /nfs/dbraw/zinc/57/34/77/940573477.db2.gz FHGPSYCZDIXCRR-UHFFFAOYSA-N 2 0 403.530 4.420 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccc(-c3nc(-c4ccc(F)c(C[NH+](C)C)c4)no3)cc2)C[C@H](C)O1 ZINC000545751918 940583780 /nfs/dbraw/zinc/58/37/80/940583780.db2.gz NNEPOGLLNPEHGP-CALCHBBNSA-N 2 0 424.520 4.214 20 0 HIADRP C[C@H]1C[NH+](Cc2ccc(-c3nc(-c4ccc(F)c(C[NH+](C)C)c4)no3)cc2)C[C@H](C)O1 ZINC000545751926 940583821 /nfs/dbraw/zinc/58/38/21/940583821.db2.gz NNEPOGLLNPEHGP-IRXDYDNUSA-N 2 0 424.520 4.214 20 0 HIADRP Cc1ccc2[nH+]ccc(NCc3cccc(OCC[N@@H+](C)C4CCOCC4)c3)c2c1 ZINC000546888288 940901510 /nfs/dbraw/zinc/90/15/10/940901510.db2.gz CGBPPYXTKRJTFY-UHFFFAOYSA-N 2 0 405.542 4.067 20 0 HIADRP C[NH+](C)CCOc1ccc(-c2noc([C@H]3CCC[N@H+](Cc4ccccc4)C3)n2)cc1 ZINC000546993765 940946540 /nfs/dbraw/zinc/94/65/40/940946540.db2.gz DKQSSPVNPMLWBZ-NRFANRHFSA-N 2 0 406.530 4.057 20 0 HIADRP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000547395945 941060322 /nfs/dbraw/zinc/06/03/22/941060322.db2.gz ZLQZYWVZYWBWAY-PGRDOPGGSA-N 2 0 405.508 4.215 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000547505038 941066022 /nfs/dbraw/zinc/06/60/22/941066022.db2.gz POBMDQAPNVTKPP-NVQXNPDNSA-N 3 0 421.629 4.407 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000547505037 941066073 /nfs/dbraw/zinc/06/60/73/941066073.db2.gz POBMDQAPNVTKPP-GJZUVCINSA-N 3 0 421.629 4.407 20 0 HIADRP Cc1nc(-c2ccc([C@H](C)[NH2+]CC(=O)NC[C@@H](c3ccccc3)[NH+](C)C)cc2)cs1 ZINC000548442492 941104414 /nfs/dbraw/zinc/10/44/14/941104414.db2.gz DZERXWBDOTURAT-SBUREZEXSA-N 2 0 422.598 4.188 20 0 HIADRP O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000549037954 941147150 /nfs/dbraw/zinc/14/71/50/941147150.db2.gz LAJYCOFSNQGUFB-FTJBHMTQSA-N 2 0 417.597 4.409 20 0 HIADRP COc1ccc(C[N@H+](Cc2cn(-c3cc[nH+]cc3)nc2C)[C@H](C)C2CC2)c(OC)c1 ZINC000549821456 941208541 /nfs/dbraw/zinc/20/85/41/941208541.db2.gz XAUXOXVWQIFHPJ-GOSISDBHSA-N 2 0 406.530 4.394 20 0 HIADRP Cc1ccc([C@H](OC[C@@H](O)C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc2)cc1 ZINC000550328530 941315648 /nfs/dbraw/zinc/31/56/48/941315648.db2.gz UUZISJHGEZEMHR-BJKOFHAPSA-N 2 0 410.602 4.361 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)cc1 ZINC000550835263 941372602 /nfs/dbraw/zinc/37/26/02/941372602.db2.gz HDSAIGSPOIJTPS-JOCHJYFZSA-N 2 0 418.585 4.427 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCN(C(=O)Nc3ccccc3)C2)CC1 ZINC000550933566 941383290 /nfs/dbraw/zinc/38/32/90/941383290.db2.gz LERNTNBCVDSCNB-NSQNTRMNSA-N 2 0 406.574 4.326 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCc1cccc(C(F)(F)F)n1)c1ccccc1O2 ZINC000551240992 941434018 /nfs/dbraw/zinc/43/40/18/941434018.db2.gz PKXAFJIJOXFEFC-SFHVURJKSA-N 2 0 405.464 4.221 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H](Cc2ccccc2)C(=O)N2CCCC2)CC1 ZINC000551271798 941440819 /nfs/dbraw/zinc/44/08/19/941440819.db2.gz ZWFRVWYTIOWUNJ-WNMGUVTHSA-N 2 0 419.613 4.253 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000551273339 941441136 /nfs/dbraw/zinc/44/11/36/941441136.db2.gz VXSJCGKBJOFMJR-WXAIXHMISA-N 2 0 423.576 4.378 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC[C@@H]1C[N@H+](Cc2ccccc2)CCCO1 ZINC000551397032 941469512 /nfs/dbraw/zinc/46/95/12/941469512.db2.gz YHHLXHGYSIICCN-JQYIIUTOSA-N 2 0 421.629 4.024 20 0 HIADRP c1ncn(Cc2ccccc2C[NH2+][C@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000552033820 941571132 /nfs/dbraw/zinc/57/11/32/941571132.db2.gz UHLPNMCNVJLXIZ-GSDHBNRESA-N 2 0 415.585 4.107 20 0 HIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC1 ZINC000552063950 941577324 /nfs/dbraw/zinc/57/73/24/941577324.db2.gz SMHZIJABNLRBDN-PWRODBHTSA-N 2 0 412.496 4.394 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000552332047 941634051 /nfs/dbraw/zinc/63/40/51/941634051.db2.gz ZGMGITULLPQLHC-URXFXBBRSA-N 2 0 412.622 4.221 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)[C@@H]1C[N@@H+](C(C)(C)C)C[C@H]1C(F)(F)F ZINC000553211043 941849793 /nfs/dbraw/zinc/84/97/93/941849793.db2.gz BNCCTARTQWYXJT-RTBURBONSA-N 2 0 413.528 4.053 20 0 HIADRP CC[NH+](CC)CC(=O)Nc1cccc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000554388751 942122676 /nfs/dbraw/zinc/12/26/76/942122676.db2.gz DIBAXEUHENVZGS-RDPSFJRHSA-N 2 0 408.590 4.289 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000554809787 942252213 /nfs/dbraw/zinc/25/22/13/942252213.db2.gz DDCQTMWLTYJNBC-QZTJIDSGSA-N 2 0 422.411 4.364 20 0 HIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000555000497 942350213 /nfs/dbraw/zinc/35/02/13/942350213.db2.gz YYLDQICHPDNFQU-XNMGPUDCSA-N 2 0 416.565 4.335 20 0 HIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1F ZINC000556234190 942824129 /nfs/dbraw/zinc/82/41/29/942824129.db2.gz VMOGMJHNHNLPGY-SIKLNZKXSA-N 2 0 412.549 4.414 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H]3CCC[C@H]3c3cccc(C(F)(F)F)c3)ccn2)CC1 ZINC000556587146 942907448 /nfs/dbraw/zinc/90/74/48/942907448.db2.gz OKXXYLYXAJFJDH-SFTDATJTSA-N 2 0 418.507 4.278 20 0 HIADRP COc1ccc([C@@H](CNC(=O)c2ccc(C[NH+]3CCCC3)cc2)[NH+]2CCCCC2)cc1 ZINC000556975220 942986002 /nfs/dbraw/zinc/98/60/02/942986002.db2.gz YSQMTFDLCFFNRV-RUZDIDTESA-N 2 0 421.585 4.248 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000558703081 943630901 /nfs/dbraw/zinc/63/09/01/943630901.db2.gz KUONRMHRQUYCNP-XMMPIXPASA-N 2 0 420.601 4.023 20 0 HIADRP CNC(=O)c1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000558790472 943664167 /nfs/dbraw/zinc/66/41/67/943664167.db2.gz ONIPQMVNWSVHTK-XGBAPZKQSA-N 2 0 411.977 4.403 20 0 HIADRP CC[N@@H+]1CCC[C@H]1CNC(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000558893237 943725520 /nfs/dbraw/zinc/72/55/20/943725520.db2.gz XUZRSARVIZDZSI-IGMZMZPDSA-N 2 0 419.013 4.037 20 0 HIADRP CCN(CC)C(=O)C[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000558967341 943774218 /nfs/dbraw/zinc/77/42/18/943774218.db2.gz JABPOKFHEWITNM-MQETWORXSA-N 2 0 406.014 4.491 20 0 HIADRP CCOC(=O)[C@@H]1CC[C@H]([NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c2ccccc21 ZINC000558976887 943780480 /nfs/dbraw/zinc/78/04/80/943780480.db2.gz YIZXPLZYMXWHPJ-GPUOULLFSA-N 2 0 406.570 4.322 20 0 HIADRP C[N@H+](Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)c2ccc3c[nH+]cn3c2)CC1 ZINC000559515251 943990685 /nfs/dbraw/zinc/99/06/85/943990685.db2.gz OBUNTIFJKIBULG-UHFFFAOYSA-N 2 0 416.447 4.090 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCN(C)[C@H](c4ccccc4)C3)CC2)cc1 ZINC000559752350 944044295 /nfs/dbraw/zinc/04/42/95/944044295.db2.gz FYBRVGFNHUWUPH-RSXGOPAZSA-N 2 0 407.602 4.332 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@H]3CCCNc4ccccc43)C3(C2)CCOCC3)cc1 ZINC000559890721 944076578 /nfs/dbraw/zinc/07/65/78/944076578.db2.gz IKJKPMNLUTUITN-RDGATRHJSA-N 2 0 405.586 4.452 20 0 HIADRP O=C(NCc1ccccc1C[NH+]1CCCCCC1)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000562021067 944898074 /nfs/dbraw/zinc/89/80/74/944898074.db2.gz CWBMCFOQDREFAT-UHFFFAOYSA-N 2 0 412.622 4.223 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+]C[C@H](C)c3ccc(C(F)(F)F)cc3)cn2)CC1 ZINC000564298444 945505999 /nfs/dbraw/zinc/50/59/99/945505999.db2.gz JCRUJTIRFJYFOA-KRWDZBQOSA-N 2 0 406.496 4.136 20 0 HIADRP Cc1cccc(C)c1NC(=O)CCC[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC000564402564 945556818 /nfs/dbraw/zinc/55/68/18/945556818.db2.gz CPGFOBBHUAVUCR-DNQXCXABSA-N 2 0 405.586 4.476 20 0 HIADRP CN1CC[C@H]([NH2+]C[C@@H](c2ccc(Cl)cc2)N2CCOCC2)C[C@H]1c1ccccc1 ZINC000565097788 945773919 /nfs/dbraw/zinc/77/39/19/945773919.db2.gz SLCDDNRGPOFXFL-HJOGWXRNSA-N 2 0 413.993 4.138 20 0 HIADRP CCn1c2ccccc2c2cc(C[NH2+]Cc3ccncc3OCC[NH+](C)C)ccc21 ZINC000569150134 946824810 /nfs/dbraw/zinc/82/48/10/946824810.db2.gz UDJQBSOJDHNVDY-UHFFFAOYSA-N 2 0 402.542 4.440 20 0 HIADRP CC(C)Cc1ccc([C@H](CNC(=O)c2ccc(Cn3ccnc3)cc2)[NH+](C)C)cc1 ZINC000569163132 946829129 /nfs/dbraw/zinc/82/91/29/946829129.db2.gz BMXXSSCPBJOFES-DEOSSOPVSA-N 2 0 404.558 4.163 20 0 HIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000569627778 946899695 /nfs/dbraw/zinc/89/96/95/946899695.db2.gz WKPIUFILUUIPNU-CSODHUTKSA-N 2 0 419.491 4.135 20 0 HIADRP O=C(C1CC[NH+](C2CC2)CC1)N(CC[NH+]1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000570061283 947081100 /nfs/dbraw/zinc/08/11/00/947081100.db2.gz JHVFLRQIHZDHIM-UHFFFAOYSA-N 2 0 424.416 4.292 20 0 HIADRP CSC1(C[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000571923854 947813675 /nfs/dbraw/zinc/81/36/75/947813675.db2.gz GLAAUGZJHLSSNM-UHFFFAOYSA-N 2 0 401.542 4.093 20 0 HIADRP Cc1ccc(C[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)c(-c2cnn(C)c2)c1 ZINC000572609403 947956221 /nfs/dbraw/zinc/95/62/21/947956221.db2.gz OJCOWNMXDDEOGJ-NHCUHLMSSA-N 2 0 418.585 4.295 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccc(-c4ccc(Cl)cc4)cc3)cn2)CC1 ZINC000573012767 948056898 /nfs/dbraw/zinc/05/68/98/948056898.db2.gz RJSRMUFLAOLGGE-UHFFFAOYSA-N 2 0 406.961 4.444 20 0 HIADRP C[N@@H+]1CC[C@@H]2[C@H](CCCN2Cc2csc(-c3cccc(Br)c3)n2)C1 ZINC000574558972 948472939 /nfs/dbraw/zinc/47/29/39/948472939.db2.gz QFNQLYMKCAKHCL-CRAIPNDOSA-N 2 0 406.393 4.489 20 0 HIADRP CN1CC[C@@H]([NH2+]CCCCC[NH2+][C@H]2CCN(C)[C@@H]2c2ccccc2)[C@H]1c1ccccc1 ZINC000574945312 948561891 /nfs/dbraw/zinc/56/18/91/948561891.db2.gz BKQZDQKIIBDBIX-HVWQDESWSA-N 2 0 420.645 4.227 20 0 HIADRP COC[C@@]1(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)OCCc2ccccc21 ZINC000574946471 948562815 /nfs/dbraw/zinc/56/28/15/948562815.db2.gz IFFQUFAOHJEPLD-YIQFJJPYSA-N 2 0 408.586 4.134 20 0 HIADRP CC(=O)N1CC[C@@H]([NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c2ccccc2C1 ZINC000575031746 948579004 /nfs/dbraw/zinc/57/90/04/948579004.db2.gz WICHTXXKIJNVDY-ZEQKJWHPSA-N 2 0 405.586 4.372 20 0 HIADRP Cc1cccc([C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C(=O)NC[C@H]2CC[N@@H+](C(C)C)C2)c1 ZINC000575886508 948750661 /nfs/dbraw/zinc/75/06/61/948750661.db2.gz WRIIXWDFISHATF-ARMFNRFLSA-N 2 0 419.613 4.057 20 0 HIADRP CCC[N@@H+]1CCCC[C@H]1c1ccc(N2CCCn3cnc(C[NH2+]C4CCC4)c3C2)nc1 ZINC001164842479 720739621 /nfs/dbraw/zinc/73/96/21/720739621.db2.gz FJAKIQAUCZWBCW-QHCPKHFHSA-N 2 0 422.621 4.268 20 0 HIADRP Cc1ccc(C[NH+]2CCC3(CCN(c4cccc(N5CCOCC5)[nH+]4)CC3)CC2)cc1 ZINC001164758714 721045445 /nfs/dbraw/zinc/04/54/45/721045445.db2.gz AUYRADYKKAUEQH-UHFFFAOYSA-N 2 0 420.601 4.109 20 0 HIADRP Cc1ccc(C[NH+]2CCC3(CCN(c4cc(-n5ccnc5)cc[nH+]4)CC3)CC2)cc1 ZINC001164758742 721046611 /nfs/dbraw/zinc/04/66/11/721046611.db2.gz BEKHHMQWMDCFEV-UHFFFAOYSA-N 2 0 401.558 4.458 20 0 HIADRP CC[NH+]1CCC([NH2+]Cc2cn(Cc3ccccc3)nc2-c2ccc(OC)cc2)CC1 ZINC000017313628 846244549 /nfs/dbraw/zinc/24/45/49/846244549.db2.gz YDHNGFLNTUXTST-UHFFFAOYSA-N 2 0 404.558 4.181 20 0 HIADRP CC[NH+]1CCN(c2ccc(NC(=O)c3ccc(C[NH+]4CCCCC4)cc3)c(C)c2)CC1 ZINC000029928332 847652326 /nfs/dbraw/zinc/65/23/26/847652326.db2.gz ZGRRZQZLQYUEDM-UHFFFAOYSA-N 2 0 420.601 4.375 20 0 HIADRP CN1CC[C@@H](C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000436480893 861819764 /nfs/dbraw/zinc/81/97/64/861819764.db2.gz JJHSROGILXPSDI-JTSKRJEESA-N 2 0 402.945 4.126 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2csc(-c3ccc(O)c(OC)c3)n2)CC1 ZINC000436680210 861892645 /nfs/dbraw/zinc/89/26/45/861892645.db2.gz NFKMARNLOJPJKR-UHFFFAOYSA-N 2 0 403.592 4.468 20 0 HIADRP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000047777564 849109851 /nfs/dbraw/zinc/10/98/51/849109851.db2.gz PMKQBBFCPCYNNA-OALUTQOASA-N 2 0 416.591 4.004 20 0 HIADRP O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000047777563 849109985 /nfs/dbraw/zinc/10/99/85/849109985.db2.gz PMKQBBFCPCYNNA-MOPGFXCFSA-N 2 0 416.591 4.004 20 0 HIADRP CC(C)[N@H+](C)CC1CCN(C(=O)NCc2ccc(C[NH+]3CCCC[C@H]3C)cc2)CC1 ZINC000056846188 850499937 /nfs/dbraw/zinc/49/99/37/850499937.db2.gz GTVNMJOKYNRVJX-OAQYLSRUSA-N 2 0 414.638 4.323 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)cc1 ZINC000058467342 850832463 /nfs/dbraw/zinc/83/24/63/850832463.db2.gz BWTGLLFJVJZZKQ-QFIPXVFZSA-N 2 0 412.578 4.148 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCC[NH+](C(C)(C)C)CC2)cc1 ZINC000060545068 851141321 /nfs/dbraw/zinc/14/13/21/851141321.db2.gz SDZOETGRBGBWGR-HXUWFJFHSA-N 2 0 400.611 4.077 20 0 HIADRP CC(C)(C)[N@@H+]1CCCN(C(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC000060566809 851150573 /nfs/dbraw/zinc/15/05/73/851150573.db2.gz QJXDQBYVXCHIJG-UHFFFAOYSA-N 2 0 400.611 4.078 20 0 HIADRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2ccc3cc(OC)ccc3c2)CC1 ZINC000061070272 851287643 /nfs/dbraw/zinc/28/76/43/851287643.db2.gz KWZAUOQKWSNYQS-UHFFFAOYSA-N 2 0 403.570 4.276 20 0 HIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)NCc3ccc(C[NH+](C)C)cc3)cc2)C1 ZINC000061469650 851385346 /nfs/dbraw/zinc/38/53/46/851385346.db2.gz AWLQPYLUYJMOEZ-SFTDATJTSA-N 2 0 422.617 4.226 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCc2ccccc2C[NH+]2CCCC2)[NH+]2CCCC2)cc1 ZINC000064237714 851855543 /nfs/dbraw/zinc/85/55/43/851855543.db2.gz LGVFBRGLGOXAIQ-VWLOTQADSA-N 2 0 420.601 4.227 20 0 HIADRP Cc1ccc([C@H](CNC(=O)NCc2ccccc2C[NH+]2CCCCC2)[NH+](C)C)cc1 ZINC000065466960 852143724 /nfs/dbraw/zinc/14/37/24/852143724.db2.gz ZRFHATATEBFURO-DEOSSOPVSA-N 2 0 408.590 4.083 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)NCc1ccc(C[NH+]2CCCCC2)cc1)c1ccco1 ZINC000065481167 852151986 /nfs/dbraw/zinc/15/19/86/852151986.db2.gz PWSYEUAQXWKNDQ-JOCHJYFZSA-N 2 0 412.578 4.148 20 0 HIADRP CCc1ccc([C@H](CNC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)[NH+](C)C)cc1 ZINC000071913249 852429637 /nfs/dbraw/zinc/42/96/37/852429637.db2.gz MDOHLVQVPSJNLV-SFTDATJTSA-N 2 0 414.619 4.050 20 0 HIADRP C[C@@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000110429920 853099312 /nfs/dbraw/zinc/09/93/12/853099312.db2.gz LTINTSUNAQJXEK-ZACQAIPSSA-N 2 0 400.485 4.467 20 0 HIADRP C[C@@H](CNC(=O)[C@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC000110913344 853167223 /nfs/dbraw/zinc/16/72/23/853167223.db2.gz JNHJJGBENUSWFD-VXKWHMMOSA-N 2 0 407.602 4.139 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(N3CC[NH+](C)CC3)cc2C)cc1)C(C)C ZINC000116543653 853312135 /nfs/dbraw/zinc/31/21/35/853312135.db2.gz DYELXZQLXIEEQY-UHFFFAOYSA-N 2 0 408.590 4.229 20 0 HIADRP O=C(NC[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000140064332 853432111 /nfs/dbraw/zinc/43/21/11/853432111.db2.gz CXVYQQLPXBKRQH-OAQYLSRUSA-N 2 0 411.615 4.376 20 0 HIADRP O=C(NCC1CC[NH+](Cc2cccs2)CC1)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000145742651 853556167 /nfs/dbraw/zinc/55/61/67/853556167.db2.gz GADMISBZPDCLTK-UHFFFAOYSA-N 2 0 411.615 4.376 20 0 HIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000236613041 853902519 /nfs/dbraw/zinc/90/25/19/853902519.db2.gz JHRLQSKBHBPZTA-RUZDIDTESA-N 2 0 408.542 4.173 20 0 HIADRP CCOc1cc(C[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)ccc1OC ZINC000236904129 853934922 /nfs/dbraw/zinc/93/49/22/853934922.db2.gz AMKARLBAPPZCEF-GOSISDBHSA-N 2 0 415.553 4.226 20 0 HIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(OCc3c(C)noc3C)c(OC)c2)CC1 ZINC000236916252 853936894 /nfs/dbraw/zinc/93/68/94/853936894.db2.gz PRYPOYUDWQEDGW-UHFFFAOYSA-N 2 0 401.551 4.091 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 ZINC000236948984 853941625 /nfs/dbraw/zinc/94/16/25/853941625.db2.gz QAPYBUXEKLVJTR-KRWDZBQOSA-N 2 0 409.496 4.329 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+]Cc2cn(-c3ccccc3)nc2C(C)(C)C)c1 ZINC000236980747 853946461 /nfs/dbraw/zinc/94/64/61/853946461.db2.gz BIZBFSKAEKZIIX-UHFFFAOYSA-N 2 0 406.574 4.400 20 0 HIADRP COc1cc(C[NH2+]CC2CC[NH+](C)CC2)ccc1OCCOc1ccccc1Cl ZINC000237136050 853970569 /nfs/dbraw/zinc/97/05/69/853970569.db2.gz PBBKBGRBHABEMU-UHFFFAOYSA-N 2 0 418.965 4.238 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+]Cc2cccc(Oc3ccccc3)c2)cc1 ZINC000237177947 853976101 /nfs/dbraw/zinc/97/61/01/853976101.db2.gz YKEAUORFENPFHU-UHFFFAOYSA-N 2 0 403.526 4.060 20 0 HIADRP C[C@@H](C[NH2+]Cc1ccc(-c2ccc(C(F)(F)F)cc2)s1)CN1CC[NH+](C)CC1 ZINC000237408471 854025394 /nfs/dbraw/zinc/02/53/94/854025394.db2.gz SYJWHMNHZCFMED-INIZCTEOSA-N 2 0 411.537 4.407 20 0 HIADRP C[C@@H](C[NH2+]Cc1ccc(-c2cccc(Br)c2)s1)CN1CC[NH+](C)CC1 ZINC000237409819 854025486 /nfs/dbraw/zinc/02/54/86/854025486.db2.gz YQIZQISIROEXOB-INIZCTEOSA-N 2 0 422.436 4.151 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)c(Cl)c1OC ZINC000237440833 854033718 /nfs/dbraw/zinc/03/37/18/854033718.db2.gz UZTGHOONSDUUBM-IRXDYDNUSA-N 2 0 418.965 4.256 20 0 HIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+]Cc1cccc(Oc2cccc(C(F)(F)F)c2)c1 ZINC000237502285 854046229 /nfs/dbraw/zinc/04/62/29/854046229.db2.gz ZNNBVHQKKFNHBJ-KRWDZBQOSA-N 2 0 407.480 4.223 20 0 HIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCCC[N@@H+]2CCC[C@H]2CO)cc1 ZINC000237711266 854080576 /nfs/dbraw/zinc/08/05/76/854080576.db2.gz QZJIHHZXUCBVCY-VWLOTQADSA-N 2 0 418.585 4.174 20 0 HIADRP O=C(NCC[NH+]1CCCC1)c1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2)cc1 ZINC000237836867 854106624 /nfs/dbraw/zinc/10/66/24/854106624.db2.gz NYBOWLDINWYLIH-UHFFFAOYSA-N 2 0 406.357 4.109 20 0 HIADRP CCc1cc(NCc2cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c2)c2ccccc2[nH+]1 ZINC000301769083 854461842 /nfs/dbraw/zinc/46/18/42/854461842.db2.gz CSJREKFGJHTNBG-HXUWFJFHSA-N 2 0 402.542 4.107 20 0 HIADRP CC1CC[NH+]([C@H](CNC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)c2cccs2)CC1 ZINC000302977698 854705559 /nfs/dbraw/zinc/70/55/59/854705559.db2.gz ULOOTUYBJVGXNJ-LEWJYISDSA-N 2 0 414.619 4.123 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000303159097 854792204 /nfs/dbraw/zinc/79/22/04/854792204.db2.gz PAUCCEUKMUTNEB-AQNXPRMDSA-N 2 0 420.667 4.016 20 0 HIADRP CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NCC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000303524888 855012571 /nfs/dbraw/zinc/01/25/71/855012571.db2.gz ZWEGNJQHUOXJAW-LJQANCHMSA-N 2 0 420.667 4.160 20 0 HIADRP CC[NH+](CC)[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1 ZINC000303551091 855034776 /nfs/dbraw/zinc/03/47/76/855034776.db2.gz VWWPBTMKVLBUMD-WQYPUDFKSA-N 2 0 405.586 4.381 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2ccc(N3CCCCC3)cc2)CC1 ZINC000303580455 855054276 /nfs/dbraw/zinc/05/42/76/855054276.db2.gz OSMSMOLEISNINQ-UHFFFAOYSA-N 2 0 400.611 4.059 20 0 HIADRP CC[NH+]1CCN(c2ccc(C(=O)Nc3ccc(C[N@@H+]4CCCC[C@@H]4C)cc3)cc2)CC1 ZINC000303605040 855073134 /nfs/dbraw/zinc/07/31/34/855073134.db2.gz XXNRCTQQXVVXPM-NRFANRHFSA-N 2 0 420.601 4.455 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000303689603 855134887 /nfs/dbraw/zinc/13/48/87/855134887.db2.gz MGQIXLLWXMHNDH-QPPBQGQZSA-N 2 0 405.586 4.240 20 0 HIADRP C[C@]1(C[NH2+]Cc2cc3c(c(Br)c2)OCO3)CC[N@H+](Cc2ccccc2)C1 ZINC000388300668 855446660 /nfs/dbraw/zinc/44/66/60/855446660.db2.gz AQRKCQYYPPLGBE-OAQYLSRUSA-N 2 0 417.347 4.180 20 0 HIADRP CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390538410 855455120 /nfs/dbraw/zinc/45/51/20/855455120.db2.gz GSMGSDRYZSSJHZ-GQDBAEDSSA-N 2 0 413.606 4.465 20 0 HIADRP Cc1cc(C[NH2+]C[C@@H]2CN(Cc3ccccc3)CCCO2)ccc1Br ZINC000390860914 855457538 /nfs/dbraw/zinc/45/75/38/855457538.db2.gz LGVYNVBHDYDXOD-HXUWFJFHSA-N 2 0 403.364 4.138 20 0 HIADRP C[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1ccc(Br)cc1 ZINC000397504530 855472757 /nfs/dbraw/zinc/47/27/57/855472757.db2.gz BWFMSHBYIXQHBL-QGZVFWFLSA-N 2 0 403.364 4.127 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000410365477 855952511 /nfs/dbraw/zinc/95/25/11/855952511.db2.gz KTZUWKZDRCCERQ-NZQKXSOJSA-N 2 0 424.589 4.290 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NC[C@H](c2cccs2)[NH+](C)C)C1 ZINC000410364273 855952985 /nfs/dbraw/zinc/95/29/85/855952985.db2.gz LMQVXZOZNRNIJV-GHTZIAJQSA-N 2 0 414.619 4.082 20 0 HIADRP COc1ccc(CC[C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1O ZINC000426394886 856273676 /nfs/dbraw/zinc/27/36/76/856273676.db2.gz KRUKCFZIMZYGDW-SLFFLAALSA-N 2 0 412.574 4.121 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC000428369180 857178466 /nfs/dbraw/zinc/17/84/66/857178466.db2.gz HPZZFLVZZOHSFO-SQJMNOBHSA-N 2 0 422.617 4.379 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC000428620404 857279954 /nfs/dbraw/zinc/27/99/54/857279954.db2.gz PHBCFWNHGXVEOT-QHCPKHFHSA-N 2 0 419.613 4.412 20 0 HIADRP CN(C(=O)C1(C)CC[NH+](Cc2ccccc2)CC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000428743719 857315390 /nfs/dbraw/zinc/31/53/90/857315390.db2.gz KIQBQLHUAUZKIU-UHFFFAOYSA-N 2 0 419.613 4.412 20 0 HIADRP COc1ccc([C@@H](CNC(=O)C[C@H](c2ccccc2)[NH+](C)C)[NH+]2CCCCC2)cc1 ZINC000431570950 858673290 /nfs/dbraw/zinc/67/32/90/858673290.db2.gz OZJISBPVJHUQPT-DNQXCXABSA-N 2 0 409.574 4.031 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000431678964 858734725 /nfs/dbraw/zinc/73/47/25/858734725.db2.gz OBXOSDXPDWBDHR-ZODMCCGTSA-N 2 0 420.601 4.176 20 0 HIADRP COc1ccc(C[C@@H]([NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)c2ccc(OC)cc2)cc1 ZINC000432416210 859155579 /nfs/dbraw/zinc/15/55/79/859155579.db2.gz QAHFWYFMGFTGBV-CJFMBICVSA-N 2 0 412.574 4.078 20 0 HIADRP CCOc1ccccc1NC(=O)[C@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433192224 859560637 /nfs/dbraw/zinc/56/06/37/859560637.db2.gz KERCFRDEKJGLHM-NRFANRHFSA-N 2 0 421.585 4.400 20 0 HIADRP C[C@@H](c1ccc(F)cc1)N(C)C(=O)C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433214534 859570365 /nfs/dbraw/zinc/57/03/65/859570365.db2.gz UMMGMEQUDFCIPR-NRFANRHFSA-N 2 0 423.576 4.333 20 0 HIADRP FC(F)(F)c1cnc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000433311779 859632176 /nfs/dbraw/zinc/63/21/76/859632176.db2.gz NNMAEHWPGQWFTJ-UHFFFAOYSA-N 2 0 413.509 4.323 20 0 HIADRP CN1CCO[C@H]([C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c2ccc(Cl)cc2)C1 ZINC000467736043 881539238 /nfs/dbraw/zinc/53/92/38/881539238.db2.gz TWXGKSZDXZWXCS-ZEQRLZLVSA-N 2 0 413.993 4.097 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3ccc(Br)c(C)c3)cc2)CC1 ZINC000467779428 881599011 /nfs/dbraw/zinc/59/90/11/881599011.db2.gz ZTPVSXQWPRRYNR-UHFFFAOYSA-N 2 0 416.407 4.185 20 0 HIADRP COc1ccc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)cc1OC ZINC000467834672 881668462 /nfs/dbraw/zinc/66/84/62/881668462.db2.gz LVUDOJGMBQTVEI-NRFANRHFSA-N 2 0 411.590 4.265 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)c1)C1CCOCC1 ZINC000438196144 863625084 /nfs/dbraw/zinc/62/50/84/863625084.db2.gz CQAHWPSXBFMPGD-MOPGFXCFSA-N 2 0 414.512 4.387 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cccc(Br)c1 ZINC000467864432 881719259 /nfs/dbraw/zinc/71/92/59/881719259.db2.gz BCYLRXLKDHMIDP-MRXNPFEDSA-N 2 0 403.364 4.257 20 0 HIADRP C[NH+](C)[C@H](CNc1cncc(NC[C@H](c2cccs2)[NH+](C)C)n1)c1cccs1 ZINC000439132536 864567025 /nfs/dbraw/zinc/56/70/25/864567025.db2.gz OYQIGZSGJPFBRZ-HZPDHXFCSA-N 2 0 416.620 4.029 20 0 HIADRP c1cc(C[NH+]2CCC([C@@H]3CCCO3)CC2)ccc1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000439295062 864718916 /nfs/dbraw/zinc/71/89/16/864718916.db2.gz GLAQJQKIEAAYQX-UIOOFZCWSA-N 2 0 412.618 4.469 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N1c2ccccc2C[C@H]1C ZINC000439595412 864918520 /nfs/dbraw/zinc/91/85/20/864918520.db2.gz JXLQMAOBGNPIBC-UXHICEINSA-N 2 0 417.553 4.368 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C(=O)N(C)Cc1ccccc1 ZINC000439598297 864920758 /nfs/dbraw/zinc/92/07/58/864920758.db2.gz QGRQHGWDLSYSRM-FQEVSTJZSA-N 2 0 405.542 4.048 20 0 HIADRP CC(C)C[C@H](CNC(=O)NC1CC[NH+](C(C)(C)C)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000468016080 881854207 /nfs/dbraw/zinc/85/42/07/881854207.db2.gz HRAQGPCXKHRPSR-SIKLNZKXSA-N 2 0 402.627 4.314 20 0 HIADRP CC[N@@H+]1CC[C@H](N(C)C(=O)NC[C@H](CC(C)C)[NH2+][C@@H](C)c2ccccc2)C[C@H]1C ZINC000468025571 881859731 /nfs/dbraw/zinc/85/97/31/881859731.db2.gz IZUFQEQHUOIBMT-VAPSRWTKSA-N 2 0 402.627 4.266 20 0 HIADRP CC(C)C[C@@H](CNC(=O)N1CCC([NH+]2CCCCC2)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000468030717 881863728 /nfs/dbraw/zinc/86/37/28/881863728.db2.gz RBSYQYVFKQLLSZ-GMAHTHKFSA-N 2 0 414.638 4.412 20 0 HIADRP CC[N@@H+]1CCC[C@@H]1CN(CC[NH+](C)C)C(=O)Nc1ccc(CCC(F)(F)F)cc1 ZINC000440286712 865539348 /nfs/dbraw/zinc/53/93/48/865539348.db2.gz XNIAPPYOXXZJOI-LJQANCHMSA-N 2 0 414.516 4.061 20 0 HIADRP COc1ccc(C[NH+]2CCC(C[NH2+]Cc3cnc(-c4ccncc4)s3)CC2)cc1 ZINC000440323050 865591681 /nfs/dbraw/zinc/59/16/81/865591681.db2.gz BUGXVGRCJMVNIQ-UHFFFAOYSA-N 2 0 408.571 4.216 20 0 HIADRP O[C@H](COc1ccc(Oc2ccccc2)cc1)C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441412901 866485143 /nfs/dbraw/zinc/48/51/43/866485143.db2.gz PQWDMFDQNSXLFR-WDZJFXIESA-N 2 0 422.569 4.167 20 0 HIADRP COCCC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1ccc(F)cc1 ZINC000442781858 867672818 /nfs/dbraw/zinc/67/28/18/867672818.db2.gz KDAOCRYTNUJKSR-XMMPIXPASA-N 2 0 400.538 4.040 20 0 HIADRP CSc1cccc([C@@H]([NH2+]CCN2CC[N@H+](C)C(C)(C)C2)c2ccc(F)c(F)c2)c1 ZINC000442868554 867706228 /nfs/dbraw/zinc/70/62/28/867706228.db2.gz GQAZGZARXISOJH-JOCHJYFZSA-N 2 0 419.585 4.392 20 0 HIADRP C[C@H](c1nc(-c2ccc(N3CCC[N@H+](C)CC3)c(Cl)c2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000443199359 867871704 /nfs/dbraw/zinc/87/17/04/867871704.db2.gz DHVXCVCHGNLUKW-BRWVUGGUSA-N 2 0 417.985 4.466 20 0 HIADRP C[C@H](NC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)C(C)(C)C[NH+](C)C ZINC000443248860 867885337 /nfs/dbraw/zinc/88/53/37/867885337.db2.gz SAJKNZRRCCCAKP-IBGZPJMESA-N 2 0 410.606 4.191 20 0 HIADRP O=C(CC[NH+]1CCC(CCC[NH+]2CCCC2)CC1)Nc1ccccc1Br ZINC000443607959 868168616 /nfs/dbraw/zinc/16/86/16/868168616.db2.gz VEAUOBUBEYANRN-UHFFFAOYSA-N 2 0 422.411 4.366 20 0 HIADRP COc1ccc(C[NH2+]Cc2ccc(C[NH+](C)C)c(F)c2)c(OCc2cccnc2)c1 ZINC000443998566 868517953 /nfs/dbraw/zinc/51/79/53/868517953.db2.gz QJGGJPBWMSABPC-UHFFFAOYSA-N 2 0 409.505 4.160 20 0 HIADRP C[NH+](C)CCc1ccccc1NC(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000446572794 870485022 /nfs/dbraw/zinc/48/50/22/870485022.db2.gz LNKRAUNLGDZNMY-UHFFFAOYSA-N 2 0 414.981 4.230 20 0 HIADRP CC[C@@H]([NH2+]C[C@H](C)N1CC[NH+](CC)CC1)c1ccc(Br)cc1Cl ZINC000446757457 870671021 /nfs/dbraw/zinc/67/10/21/870671021.db2.gz UKYFERUBZKLOPY-KBXCAEBGSA-N 2 0 402.808 4.169 20 0 HIADRP C[C@@H](C[NH2+][C@@H](c1ccc(Br)cc1Cl)C1CC1)CN1CC[NH+](C)CC1 ZINC000446817928 870733258 /nfs/dbraw/zinc/73/32/58/870733258.db2.gz LEFSUENMLBQXCD-IFXJQAMLSA-N 2 0 414.819 4.027 20 0 HIADRP C[C@@H](C[NH2+][C@H](c1ccc(Br)cc1Cl)C1CC1)CN1CC[NH+](C)CC1 ZINC000446817983 870733295 /nfs/dbraw/zinc/73/32/95/870733295.db2.gz LEFSUENMLBQXCD-LIRRHRJNSA-N 2 0 414.819 4.027 20 0 HIADRP COc1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc(OC)c1OCc1ccccc1 ZINC000446882762 870803693 /nfs/dbraw/zinc/80/36/93/870803693.db2.gz BUQJZAGPHDRQOT-UHFFFAOYSA-N 2 0 410.558 4.247 20 0 HIADRP CC(C)(O)C[N@@H+]1CCc2c(cccc2N[C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC000447599836 871507930 /nfs/dbraw/zinc/50/79/30/871507930.db2.gz YWXMONYTOXBHNS-BKFWDETESA-N 2 0 419.613 4.423 20 0 HIADRP OC[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1cc(F)c(F)c(F)c1 ZINC000447608108 871515990 /nfs/dbraw/zinc/51/59/90/871515990.db2.gz UKUIIKQNDBZTKL-XSDIEEQYSA-N 2 0 418.503 4.040 20 0 HIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000468546640 882587310 /nfs/dbraw/zinc/58/73/10/882587310.db2.gz DOJUDCDFNWPJOG-GMAHTHKFSA-N 2 0 400.607 4.443 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)N(C)[C@H]1CC[N@H+](CC)C[C@H]1C)c1ccccc1Cl ZINC000448462323 872422733 /nfs/dbraw/zinc/42/27/33/872422733.db2.gz SGYGCGMOEQBDGW-QMMLZNLJSA-N 2 0 409.018 4.095 20 0 HIADRP CC(C)C[N@@H+]1CCC[C@H](CNC(=O)N(C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000448474353 872453881 /nfs/dbraw/zinc/45/38/81/872453881.db2.gz VVVBKTISIVXQKB-GMKZXUHWSA-N 2 0 414.638 4.049 20 0 HIADRP C[NH+]1CCN(Cc2cccc(C(=O)Nc3ccc(C[NH+]4CCCCCC4)cc3)c2)CC1 ZINC000468703793 882821448 /nfs/dbraw/zinc/82/14/48/882821448.db2.gz XMCFYPSTDVBYMI-UHFFFAOYSA-N 2 0 420.601 4.062 20 0 HIADRP C[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)N(C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000461723816 874871041 /nfs/dbraw/zinc/87/10/41/874871041.db2.gz JEWNCVUGFFRPFJ-TZBSWOFLSA-N 2 0 422.617 4.201 20 0 HIADRP COCCC[NH+]1CCC([NH2+]C(Cc2ccccc2F)Cc2ccccc2F)CC1 ZINC000462048413 875161270 /nfs/dbraw/zinc/16/12/70/875161270.db2.gz LCCJJJQJLGRQSH-UHFFFAOYSA-N 2 0 402.529 4.209 20 0 HIADRP CC[NH+](CC)[C@@H](CNC(=O)C1CC[NH+](C(C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000468877493 882911044 /nfs/dbraw/zinc/91/10/44/882911044.db2.gz HIFXOCIUGNIJRL-FQEVSTJZSA-N 2 0 413.528 4.325 20 0 HIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000462798016 875847104 /nfs/dbraw/zinc/84/71/04/875847104.db2.gz IIOJMJDAQZCRKY-UHFFFAOYSA-N 2 0 417.601 4.384 20 0 HIADRP C[C@@H](CCN1CCOCC1)[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000462817219 875859159 /nfs/dbraw/zinc/85/91/59/875859159.db2.gz NEPPSXLUEIXMCE-URXFXBBRSA-N 2 0 405.602 4.079 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(OC(C)(C)C)cc1 ZINC000463027039 876045189 /nfs/dbraw/zinc/04/51/89/876045189.db2.gz BTWNPUICHVKBJC-XXBNENTESA-N 2 0 423.601 4.412 20 0 HIADRP Cc1nc2ccccc2n1CCCCC[NH+]1CCN(CC[N@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000463072610 876102343 /nfs/dbraw/zinc/10/23/43/876102343.db2.gz QSIJTEIDQLWAQZ-SZPZYZBQSA-N 2 0 411.638 4.005 20 0 HIADRP COc1ccccc1[C@H](CN[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[NH+]1CCCC1 ZINC000463136380 876185566 /nfs/dbraw/zinc/18/55/66/876185566.db2.gz DJMDGDSBGUFQEW-PWWKTKHKSA-N 2 0 407.602 4.475 20 0 HIADRP Fc1ccc(CC[NH+]2CCC(NC3CC[NH+](CCc4ccccc4)CC3)CC2)cc1 ZINC000463144068 876196903 /nfs/dbraw/zinc/19/69/03/876196903.db2.gz JRGYTOUYQCCOJP-UHFFFAOYSA-N 2 0 409.593 4.129 20 0 HIADRP O[C@@H]1CCC[C@@]1(C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)Cc1ccc(F)cc1 ZINC000463235071 876289402 /nfs/dbraw/zinc/28/94/02/876289402.db2.gz FPBQKPMFHITXAM-FTJBHMTQSA-N 2 0 410.577 4.196 20 0 HIADRP CC[NH+]1CCC(CC[NH2+]Cc2cc(Br)cc(Br)c2N)CC1 ZINC000463237217 876293669 /nfs/dbraw/zinc/29/36/69/876293669.db2.gz UMYCYQHCLINXSE-UHFFFAOYSA-N 2 0 419.205 4.005 20 0 HIADRP C[NH+]1CCC(C[NH2+]Cc2cc(Cl)ccc2Br)(N2CCCCC2)CC1 ZINC000464048941 877190975 /nfs/dbraw/zinc/19/09/75/877190975.db2.gz OHVIENAZAOMECE-UHFFFAOYSA-N 2 0 414.819 4.142 20 0 HIADRP C[C@H]1CC[N@H+](CCOc2ccc(NC(=O)[C@H]3CCC[NH+]3Cc3ccccc3)cc2)C1 ZINC000465201255 878606687 /nfs/dbraw/zinc/60/66/87/878606687.db2.gz UJMZHGUUTALDRV-GBXCKJPGSA-N 2 0 407.558 4.010 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)N(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000465517954 878966839 /nfs/dbraw/zinc/96/68/39/878966839.db2.gz CSLLBLKEXGJHKC-RUZDIDTESA-N 2 0 422.617 4.192 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N1CC[C@@H](C)[NH+](Cc2ccccc2)CC1 ZINC000465564394 879037633 /nfs/dbraw/zinc/03/76/33/879037633.db2.gz HZASANDRZPADTD-JOCHJYFZSA-N 2 0 422.617 4.333 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)N(C)CC[C@H]1CCCC[NH+]1C ZINC000465571752 879046037 /nfs/dbraw/zinc/04/60/37/879046037.db2.gz OCUIPHMGPJWNMS-NZQKXSOJSA-N 2 0 400.611 4.077 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NCCCC[NH+]1CCCC[C@@H]1C ZINC000465602787 879092376 /nfs/dbraw/zinc/09/23/76/879092376.db2.gz PYJFKEHDKVAZCD-LADGPHEKSA-N 2 0 414.638 4.195 20 0 HIADRP C[NH+](C)C1(CNC(=O)NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)CCCCCC1 ZINC000465622990 879129887 /nfs/dbraw/zinc/12/98/87/879129887.db2.gz CGXHJVRVHTYFPL-AZUAARDMSA-N 2 0 406.640 4.085 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)C1 ZINC000503426250 912421424 /nfs/dbraw/zinc/42/14/24/912421424.db2.gz NAQXDKARDKYJQM-AKFKNWHVSA-N 2 0 412.622 4.120 20 0 HIADRP CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)NC[C@@]1([NH+](C)C)CCC[C@H](C)C1 ZINC000465715880 879287847 /nfs/dbraw/zinc/28/78/47/879287847.db2.gz VNOIYGUMXCJUJS-QQKQFIJSSA-N 2 0 414.638 4.051 20 0 HIADRP CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)NC[C@@H]1CCC[NH+](C)[C@@H]1c1cccs1 ZINC000465871811 879524227 /nfs/dbraw/zinc/52/42/27/879524227.db2.gz JHYWUTFUWASBOB-ZVDOUQERSA-N 2 0 406.640 4.085 20 0 HIADRP CC[NH+](CC)CCN(CC(C)C)C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000466071325 879772962 /nfs/dbraw/zinc/77/29/62/879772962.db2.gz ADIBDMHAKVBUDG-FPOVZHCZSA-N 2 0 408.656 4.140 20 0 HIADRP CCCC[N@H+](C)CC1CCN(C(=O)NC[C@@H]2CCC[NH+](C)[C@@H]2c2cccs2)CC1 ZINC000466087544 879807302 /nfs/dbraw/zinc/80/73/02/879807302.db2.gz YIQGCMGUCNLZFE-UNMCSNQZSA-N 2 0 420.667 4.285 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc(C)c(NC(=O)CC[NH+](C)C)c2)cc1)C1CC1 ZINC000466236693 879941409 /nfs/dbraw/zinc/94/14/09/879941409.db2.gz PQCMKHCHLLVGOF-UHFFFAOYSA-N 2 0 422.573 4.122 20 0 HIADRP O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000503505359 912554011 /nfs/dbraw/zinc/55/40/11/912554011.db2.gz TWXYLQJTACGLEE-RTWAWAEBSA-N 2 0 418.651 4.183 20 0 HIADRP Cc1nccn1CCCC[N@H+](Cc1cccc(Br)c1)C1CCOCC1 ZINC000467299922 881046938 /nfs/dbraw/zinc/04/69/38/881046938.db2.gz OBWNXUQXRUTPFV-UHFFFAOYSA-N 2 0 406.368 4.415 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccnn1-c1ccccc1 ZINC000467313044 881060376 /nfs/dbraw/zinc/06/03/76/881060376.db2.gz KZSXTRHDMBWGFB-QHAWAJNXSA-N 2 0 404.558 4.332 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccnn1-c1ccccc1 ZINC000467313043 881060463 /nfs/dbraw/zinc/06/04/63/881060463.db2.gz KZSXTRHDMBWGFB-NJYVYQBISA-N 2 0 404.558 4.332 20 0 HIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccnn1-c1ccccc1 ZINC000467333312 881082563 /nfs/dbraw/zinc/08/25/63/881082563.db2.gz SCUHQVSJCSZTHJ-JOCHJYFZSA-N 2 0 403.574 4.125 20 0 HIADRP C[NH+]1CCN(c2ccc(C(F)(F)F)cc2C[NH2+][C@@H](c2cncc(F)c2)C2CC2)CC1 ZINC000467337867 881088912 /nfs/dbraw/zinc/08/89/12/881088912.db2.gz GFLPNELUBAPEKX-OAQYLSRUSA-N 2 0 422.470 4.232 20 0 HIADRP CC[C@@H]1C[C@H](C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)CCO1 ZINC000503597983 912688177 /nfs/dbraw/zinc/68/81/77/912688177.db2.gz NUJOOYXEEUMSSA-ATIYNZHBSA-N 2 0 407.602 4.304 20 0 HIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(NC(=O)CCCOc3ccccc3)cc2)[C@@H](C)C1 ZINC000469232547 883330904 /nfs/dbraw/zinc/33/09/04/883330904.db2.gz UMPYULNFPRVXAS-GBXCKJPGSA-N 2 0 409.574 4.304 20 0 HIADRP CCS[C@@H]1CCCC[C@@H]1[NH2+]CC1(C[NH2+][C@@H]2CCCC[C@@H]2SCC)COC1 ZINC000469775992 883950873 /nfs/dbraw/zinc/95/08/73/883950873.db2.gz PCVJNZYUPCOGEF-JVSBHGNQSA-N 2 0 400.698 4.311 20 0 HIADRP C[NH+](C)CCOc1ccc(NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)cc1Cl ZINC000469918103 884108571 /nfs/dbraw/zinc/10/85/71/884108571.db2.gz NTYHRAVGQJJSNT-UHFFFAOYSA-N 2 0 410.905 4.093 20 0 HIADRP CCC(CC)(CNC(=O)N1CCC[C@H]([NH+]2CCCC2)C1)[NH2+][C@H](C)c1ccccc1 ZINC000503723997 912810258 /nfs/dbraw/zinc/81/02/58/912810258.db2.gz HQVJYAVOMHMCMS-IRLDBZIGSA-N 2 0 400.611 4.166 20 0 HIADRP C[C@@H]([NH2+]C(C)(C)CNC(=O)N1CCC[N@H+](Cc2ccccc2)CC1)c1ccccc1 ZINC000503729157 912811408 /nfs/dbraw/zinc/81/14/08/912811408.db2.gz QNQALLVDIOUNPF-OAQYLSRUSA-N 2 0 408.590 4.033 20 0 HIADRP OC[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)Cc1c(F)cccc1Cl ZINC000470248673 884582792 /nfs/dbraw/zinc/58/27/92/884582792.db2.gz QUQQFQSFPGSVBT-WVVQBRDUSA-N 2 0 416.968 4.415 20 0 HIADRP CC(C)[NH+](CCCNC(=O)N(C)[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000470493552 884880504 /nfs/dbraw/zinc/88/05/04/884880504.db2.gz LFFWKFNSDMSTPR-GGAORHGYSA-N 2 0 402.627 4.190 20 0 HIADRP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@H]1CCCC[NH+]1Cc1ccccc1 ZINC000470543712 884949543 /nfs/dbraw/zinc/94/95/43/884949543.db2.gz OCXQAJGHDIPCCN-LOSJGSFVSA-N 2 0 405.586 4.022 20 0 HIADRP CN(C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000470737113 885194075 /nfs/dbraw/zinc/19/40/75/885194075.db2.gz MVDOOOHUFUEYOI-GOTSBHOMSA-N 2 0 424.589 4.113 20 0 HIADRP C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](C2c3ccccc3-c3ccccc32)CC1 ZINC000471219076 885793645 /nfs/dbraw/zinc/79/36/45/885793645.db2.gz GDEJHNRSRSDVNF-UHFFFAOYSA-N 2 0 405.586 4.172 20 0 HIADRP C[N@H+](CCNC(=O)C1CC[NH+]([C@H]2CCCc3ccccc32)CC1)Cc1ccccc1 ZINC000471231128 885804927 /nfs/dbraw/zinc/80/49/27/885804927.db2.gz YQDFQCISTTZNPP-VWLOTQADSA-N 2 0 405.586 4.024 20 0 HIADRP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000472131422 886923459 /nfs/dbraw/zinc/92/34/59/886923459.db2.gz YPZXQBBYUCYOHB-UHFFFAOYSA-N 2 0 416.009 4.425 20 0 HIADRP C[NH+]1CCN(CCC(C)(C)[NH2+]Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000472156217 886954526 /nfs/dbraw/zinc/95/45/26/886954526.db2.gz MYRUVHPZZPYGSX-UHFFFAOYSA-N 2 0 420.395 4.215 20 0 HIADRP Cc1cc(C[N@@H+](C)CCCN2CC[NH+](C(C)C)CC2)cc(C)c1OCC(F)(F)F ZINC000472755834 887600840 /nfs/dbraw/zinc/60/08/40/887600840.db2.gz UOPKLFGJBCNSMG-UHFFFAOYSA-N 2 0 415.544 4.092 20 0 HIADRP C[NH+](C)CC1CCN(c2ccccc2NC(=O)c2cccc(C[NH+]3CCCC3)c2)CC1 ZINC000473240533 888010498 /nfs/dbraw/zinc/01/04/98/888010498.db2.gz DJZAJKQLAHAYSO-UHFFFAOYSA-N 2 0 420.601 4.313 20 0 HIADRP CN(CC[N@H+](C)C1CC1)C(=O)NCc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000473886557 888756322 /nfs/dbraw/zinc/75/63/22/888756322.db2.gz PXAJEXMOPCFZAS-UHFFFAOYSA-N 2 0 420.601 4.185 20 0 HIADRP Cc1ccccc1-n1nccc1C[NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000474468281 889331964 /nfs/dbraw/zinc/33/19/64/889331964.db2.gz JZPXLVQBIFSGMD-SFTDATJTSA-N 2 0 404.558 4.080 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)[C@@H](C)c3nc4ccccc4s3)cn2)CC1 ZINC000474483209 889342925 /nfs/dbraw/zinc/34/29/25/889342925.db2.gz UCAWZVSMNOHFAM-MSOLQXFVSA-N 2 0 409.603 4.115 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474806571 889658781 /nfs/dbraw/zinc/65/87/81/889658781.db2.gz FJGWMTYMNPIHKM-BHYGNILZSA-N 2 0 412.043 4.110 20 0 HIADRP CN(C(=O)NCc1ccccc1C[NH+]1CCCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475013895 889867043 /nfs/dbraw/zinc/86/70/43/889867043.db2.gz NGLPEJYDNVCYDP-RUZDIDTESA-N 2 0 420.601 4.088 20 0 HIADRP C[C@H](CC[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1)OCc1ccccc1 ZINC000475038906 889890820 /nfs/dbraw/zinc/89/08/20/889890820.db2.gz MZCBGJIZLRYZEP-JOCHJYFZSA-N 2 0 401.639 4.110 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000475133314 889998487 /nfs/dbraw/zinc/99/84/87/889998487.db2.gz BKQCYJHNTRTGGH-UHFFFAOYSA-N 2 0 400.611 4.125 20 0 HIADRP CC[NH+](CC)Cc1ccccc1CNC(=O)NC1CC[NH+](C2CCCCC2)CC1 ZINC000475140212 890007755 /nfs/dbraw/zinc/00/77/55/890007755.db2.gz PPMYSKWVPRMPTD-UHFFFAOYSA-N 2 0 400.611 4.125 20 0 HIADRP CCN(C(=O)NCc1cccc(C[NH+]2CCCC2)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475175108 890043706 /nfs/dbraw/zinc/04/37/06/890043706.db2.gz PUTGWSVRHAEKHP-VWLOTQADSA-N 2 0 420.601 4.088 20 0 HIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)CC1 ZINC000475333883 890253735 /nfs/dbraw/zinc/25/37/35/890253735.db2.gz JQQRXUMGHXKBOM-JPXCIIHESA-N 2 0 401.561 4.424 20 0 HIADRP C[NH+](C)[C@@H](CNc1cc(NC[C@H](c2ccsc2)[NH+](C)C)ncn1)c1ccsc1 ZINC000475451939 890367813 /nfs/dbraw/zinc/36/78/13/890367813.db2.gz LFWJLYHKHIUMFJ-HDICACEKSA-N 2 0 416.620 4.029 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000476008135 890937260 /nfs/dbraw/zinc/93/72/60/890937260.db2.gz PWXSNRNZPSOWRR-LEWJYISDSA-N 2 0 404.643 4.080 20 0 HIADRP Cc1[nH+]c2ccc(Br)cc2c(N2CCC(OCC[NH+](C)C)CC2)c1C ZINC000476209654 891140484 /nfs/dbraw/zinc/14/04/84/891140484.db2.gz VBLWLKLOJCXDQJ-UHFFFAOYSA-N 2 0 406.368 4.161 20 0 HIADRP C[N@@H+]1CC[C@H](CNC(=O)[C@@H]2CC[NH+](C3CCCCC3)C2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000476977602 891904308 /nfs/dbraw/zinc/90/43/08/891904308.db2.gz ASKXHEPWSUOTAN-HMFYCAOWSA-N 2 0 421.988 4.243 20 0 HIADRP COc1cc([C@@H](C)[NH2+]Cc2cccc(OCC[N@H+](C)C3CCOCC3)c2)ccc1F ZINC000504928017 913667969 /nfs/dbraw/zinc/66/79/69/913667969.db2.gz XXFLUOQRLCSVFI-GOSISDBHSA-N 2 0 416.537 4.175 20 0 HIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)CC1 ZINC000477615786 892712270 /nfs/dbraw/zinc/71/22/70/892712270.db2.gz ZYSWIPLLOYRGSZ-IFMALSPDSA-N 2 0 416.610 4.103 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)Nc2cccc(C[NH+]3CCC(CO)CC3)c2)cc1)C1CC1 ZINC000477717501 892824313 /nfs/dbraw/zinc/82/43/13/892824313.db2.gz XCLIRKXMPGSXFO-UHFFFAOYSA-N 2 0 421.585 4.128 20 0 HIADRP COC(=O)c1csc(-c2cccc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)c2)n1 ZINC000477854590 892913185 /nfs/dbraw/zinc/91/31/85/892913185.db2.gz VVEYUXIKQUGFPG-UHFFFAOYSA-N 2 0 413.587 4.483 20 0 HIADRP C[C@H](C[NH2+][C@H](C)c1ccc(Br)cc1C(F)(F)F)CN1CC[NH+](C)CC1 ZINC000479276590 894552923 /nfs/dbraw/zinc/55/29/23/894552923.db2.gz XPPJUXUAKRCDHO-ZIAGYGMSSA-N 2 0 422.333 4.002 20 0 HIADRP C[N@@H+]1CCCN(CCC[NH2+][C@@H](c2ccccc2)c2ccc(Br)cc2)CC1 ZINC000479286238 894565129 /nfs/dbraw/zinc/56/51/29/894565129.db2.gz MVQQMLXBVJSDEM-QFIPXVFZSA-N 2 0 416.407 4.156 20 0 HIADRP COc1cc2c(cc1OC)[C@H]([NH2+]Cc1ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc1)CC2 ZINC000479360652 894660286 /nfs/dbraw/zinc/66/02/86/894660286.db2.gz MRZLVVXORPHWBI-IEGUWTFLSA-N 2 0 410.558 4.090 20 0 HIADRP C[C@@H]1CCCC[NH+]1CCC1CCN(C(=O)NCCCC[N@H+]2CCCC[C@H]2C)CC1 ZINC000479436158 894750252 /nfs/dbraw/zinc/75/02/52/894750252.db2.gz IYDLCJYQENUQPG-FGZHOGPDSA-N 2 0 406.659 4.327 20 0 HIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000479748940 895047501 /nfs/dbraw/zinc/04/75/01/895047501.db2.gz TWKKPCUYKINGIU-PMACEKPBSA-N 2 0 409.640 4.022 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H](NC[C@@H](c2cccs2)[NH+]2CCC(C)CC2)[C@@H](C)C1 ZINC000479848537 895179702 /nfs/dbraw/zinc/17/97/02/895179702.db2.gz FSPCAPAQRGOMPP-FKBYEOEOSA-N 2 0 407.668 4.248 20 0 HIADRP C[NH+]1CCN(CCC[NH2+][C@@H](CCSc2ccccc2)c2ccc(F)cc2)CC1 ZINC000480169233 895558519 /nfs/dbraw/zinc/55/85/19/895558519.db2.gz WRVCYWYUXHQLQM-QHCPKHFHSA-N 2 0 401.595 4.276 20 0 HIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C)c3)CC2)c1 ZINC000480215189 895617921 /nfs/dbraw/zinc/61/79/21/895617921.db2.gz FPLGPWFGEVSJEH-OAQYLSRUSA-N 2 0 408.590 4.206 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(OCC[N@H+](C)C2CCOCC2)c1)c1ccc(Cl)cn1 ZINC000480225015 895628734 /nfs/dbraw/zinc/62/87/34/895628734.db2.gz MWHRSVOEWGEFES-QGZVFWFLSA-N 2 0 403.954 4.075 20 0 HIADRP COc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)cc1OC ZINC000480241866 895650720 /nfs/dbraw/zinc/65/07/20/895650720.db2.gz QLXWJFMGFWXDQE-AQNXPRMDSA-N 2 0 412.574 4.472 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc(N(C)C(C)C)nc2)CC1 ZINC000480387649 895794096 /nfs/dbraw/zinc/79/40/96/895794096.db2.gz WXXTURABQGZJNT-IBGZPJMESA-N 2 0 413.585 4.058 20 0 HIADRP Cc1nn(Cc2ccccc2)c(C)c1C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000480469914 895852149 /nfs/dbraw/zinc/85/21/49/895852149.db2.gz PZLNRQKGTBKCSW-IBGZPJMESA-N 2 0 406.574 4.339 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@@H](C)C1 ZINC000480473050 895854499 /nfs/dbraw/zinc/85/44/99/895854499.db2.gz RDRIMDXQJBFSHJ-QFBILLFUSA-N 2 0 407.649 4.449 20 0 HIADRP CC(C)[C@H](C[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21)N1CC[NH+](C)CC1 ZINC000480523440 895887329 /nfs/dbraw/zinc/88/73/29/895887329.db2.gz HHKJPEOCWMLXQK-FPOVZHCZSA-N 2 0 416.610 4.188 20 0 HIADRP CC(C)[C@@H](C[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)N1CC[NH+](C)CC1 ZINC000480559803 895920496 /nfs/dbraw/zinc/92/04/96/895920496.db2.gz UFHGZOSWUWKFNL-TZIWHRDSSA-N 2 0 416.610 4.188 20 0 HIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H](c1ccc(Cl)cc1)N1CCc2sccc2C1 ZINC000480618087 895985534 /nfs/dbraw/zinc/98/55/34/895985534.db2.gz OJZBYAUAYCDTDX-CZAAIQMYSA-N 2 0 404.023 4.431 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@@H]3CCCc4nc(-c5ccccc5)sc43)ccn2)CC1 ZINC000480691472 896054154 /nfs/dbraw/zinc/05/41/54/896054154.db2.gz BTIANDFJWLXRPN-HXUWFJFHSA-N 2 0 419.598 4.124 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)c3ccc(OC)c4ccccc43)cn2)CC1 ZINC000480714519 896075646 /nfs/dbraw/zinc/07/56/46/896075646.db2.gz ZGQZRNCEXGFJTE-LJQANCHMSA-N 2 0 404.558 4.236 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCN(c3ccccc3C(F)(F)F)C2)[C@@H](C)C1 ZINC000480722060 896082647 /nfs/dbraw/zinc/08/26/47/896082647.db2.gz ADFNZAZLNDZGDF-BJLQDIEVSA-N 2 0 413.528 4.011 20 0 HIADRP C[NH+]1CCN(c2cc(C[NH2+][C@H](CCc3ccccc3)c3ccccc3)ccn2)CC1 ZINC000480728694 896090130 /nfs/dbraw/zinc/09/01/30/896090130.db2.gz GLADJMMAOOCLGQ-RUZDIDTESA-N 2 0 400.570 4.297 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1ccccc1Br ZINC000480735427 896095431 /nfs/dbraw/zinc/09/54/31/896095431.db2.gz FPCDGBULXCPVPZ-HXUWFJFHSA-N 2 0 417.395 4.227 20 0 HIADRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3cc(OC)c(OC)cc3C)cc2)CC1 ZINC000480739162 896100018 /nfs/dbraw/zinc/10/00/18/896100018.db2.gz MAFCETYLDOYXPR-FQEVSTJZSA-N 2 0 411.590 4.001 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(NC(=O)NC(C)C)cc2)[C@@H](C)C1 ZINC000480739817 896100863 /nfs/dbraw/zinc/10/08/63/896100863.db2.gz KCMUBYOGAAKFGZ-IPJJNNNSSA-N 2 0 404.599 4.004 20 0 HIADRP C[C@@H](COc1ccc2cc(Br)ccc2c1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000480749890 896111166 /nfs/dbraw/zinc/11/11/66/896111166.db2.gz QJOWJSLZZYWBCG-JKSUJKDBSA-N 2 0 403.364 4.444 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H](C)c2sc(-c3ccc(C)cc3)nc2C)CC1 ZINC000480754289 896114928 /nfs/dbraw/zinc/11/49/28/896114928.db2.gz DBOJAUSZSUHDKJ-LJQANCHMSA-N 2 0 400.636 4.495 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](c2cccc(Cl)c2)N2CCCC2)[C@@H](C)C1 ZINC000480762776 896125005 /nfs/dbraw/zinc/12/50/05/896125005.db2.gz LFVGIRLUHBDFHF-VJBMBRPKSA-N 2 0 408.030 4.204 20 0 HIADRP CCN1CC[NH+](CCCC[NH2+][C@H](C)[C@@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000480776524 896140831 /nfs/dbraw/zinc/14/08/31/896140831.db2.gz CICRUSBNZDIQHX-IAGOWNOFSA-N 2 0 402.410 4.157 20 0 HIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1cncs1 ZINC000480777388 896142554 /nfs/dbraw/zinc/14/25/54/896142554.db2.gz IKKWVRGTPABFMX-INIZCTEOSA-N 2 0 412.525 4.415 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC2(c3cccc(Cl)c3)CCOCC2)[C@@H](C)C1 ZINC000481053914 896375934 /nfs/dbraw/zinc/37/59/34/896375934.db2.gz QMZISANPASQLTL-SIKLNZKXSA-N 2 0 409.014 4.115 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCCc3nc(C)sc32)cc1OC ZINC000481312347 896659932 /nfs/dbraw/zinc/65/99/32/896659932.db2.gz XHFDMDSICQICNK-SFHVURJKSA-N 2 0 403.592 4.348 20 0 HIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCc3c2cc(Br)cc3F)c1 ZINC000481316087 896667545 /nfs/dbraw/zinc/66/75/45/896667545.db2.gz XDHABMYDPHNYME-FQEVSTJZSA-N 2 0 407.327 4.306 20 0 HIADRP COc1ccc(C2(C[NH2+][C@H](C)c3cccc(OCC[NH+](C)C)c3)CCOCC2)cc1 ZINC000481560016 896932795 /nfs/dbraw/zinc/93/27/95/896932795.db2.gz UTVDTISRHIMXPY-HXUWFJFHSA-N 2 0 412.574 4.035 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccc(NS(C)(=O)=O)cc1 ZINC000481729909 897123615 /nfs/dbraw/zinc/12/36/15/897123615.db2.gz YPHFRLWSWBBTRM-IBGZPJMESA-N 2 0 415.603 4.285 20 0 HIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1cccc(NS(C)(=O)=O)c1 ZINC000481731198 897125271 /nfs/dbraw/zinc/12/52/71/897125271.db2.gz BWLZKQDBPQYKMJ-IBGZPJMESA-N 2 0 415.603 4.285 20 0 HIADRP COc1ccc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1Br ZINC000482032345 897443265 /nfs/dbraw/zinc/44/32/65/897443265.db2.gz KXGHZKBDSUJPPE-HNNXBMFYSA-N 2 0 407.352 4.249 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCN(c3cc(Cl)ccc3C)C2)[C@H](C)C1 ZINC000482090959 897533960 /nfs/dbraw/zinc/53/39/60/897533960.db2.gz TXVOIWDGTHBMOS-SJBKTWHCSA-N 2 0 408.030 4.201 20 0 HIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1 ZINC000482251161 897732536 /nfs/dbraw/zinc/73/25/36/897732536.db2.gz BSCOSEIAXABBEN-QHCPKHFHSA-N 2 0 421.610 4.422 20 0 HIADRP Cc1c([C@@H](C)[NH2+]C[C@@H](C)CN2CC[NH+](C)CC2)cnn1-c1ccc(Cl)cc1Cl ZINC000482459893 898033017 /nfs/dbraw/zinc/03/30/17/898033017.db2.gz CGFGXTUAWGREDZ-HZPDHXFCSA-N 2 0 424.420 4.022 20 0 HIADRP C[C@@H](C[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)CN1CC[NH+](C)CC1 ZINC000482502267 898085331 /nfs/dbraw/zinc/08/53/31/898085331.db2.gz COSYQZWMJRJDQL-LPHOPBHVSA-N 2 0 419.038 4.314 20 0 HIADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)c(OC)c1 ZINC000482551206 898141346 /nfs/dbraw/zinc/14/13/46/898141346.db2.gz QOSCVKHTIMUYMC-SJORKVTESA-N 2 0 401.526 4.007 20 0 HIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1 ZINC000482569963 898163384 /nfs/dbraw/zinc/16/33/84/898163384.db2.gz RMSZAYKWRBZTBK-PBHICJAKSA-N 2 0 421.010 4.010 20 0 HIADRP C[C@@H](C[NH2+][C@H](CCSc1ccc(F)cc1)c1ccc(F)cc1)N1CC[NH+](C)CC1 ZINC000482569723 898163549 /nfs/dbraw/zinc/16/35/49/898163549.db2.gz PVHJBPPTTDWGEK-FDDCHVKYSA-N 2 0 419.585 4.414 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H]2CCCc3nc(C)sc32)CC1 ZINC000482568636 898163927 /nfs/dbraw/zinc/16/39/27/898163927.db2.gz HYAVBDOGOCKCML-HNAYVOBHSA-N 2 0 402.583 4.461 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2ccc([S@](C)=O)cc2)CC1 ZINC000482568988 898164125 /nfs/dbraw/zinc/16/41/25/898164125.db2.gz KVXLVQNDVKRYSN-FOLRYPLNSA-N 2 0 417.594 4.117 20 0 HIADRP Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@]1(C(F)(F)F)CC[N@H+](Cc2ccccc2)C1 ZINC000482593511 898192778 /nfs/dbraw/zinc/19/27/78/898192778.db2.gz OZDQBSCDPKHZBZ-QFIPXVFZSA-N 2 0 419.491 4.450 20 0 HIADRP O=C(NC1CC[NH+](C2CCCC2)CC1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000482613714 898214936 /nfs/dbraw/zinc/21/49/36/898214936.db2.gz DKYKMRFLXOKENE-WIOPSUGQSA-N 2 0 424.633 4.090 20 0 HIADRP Cc1cc2c(cc1C)[C@H]([NH2+]Cc1cccc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c1)CCCO2 ZINC000482620265 898222856 /nfs/dbraw/zinc/22/28/56/898222856.db2.gz ONQNPFSNZAYGIQ-ISKFKSNPSA-N 2 0 421.585 4.004 20 0 HIADRP CC(C)COc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)cc1 ZINC000482627443 898229470 /nfs/dbraw/zinc/22/94/70/898229470.db2.gz HJLCZWMWNXFMDP-RDPSFJRHSA-N 2 0 423.601 4.270 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccc(C(F)(F)F)c1 ZINC000482630015 898233430 /nfs/dbraw/zinc/23/34/30/898233430.db2.gz MDUHYENVUAEBHJ-UZLBHIALSA-N 2 0 419.491 4.254 20 0 HIADRP CCC[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1ccc(OC)cc1 ZINC000482642482 898246941 /nfs/dbraw/zinc/24/69/41/898246941.db2.gz MQYGVJGRBGYKAM-LADGPHEKSA-N 2 0 409.574 4.024 20 0 HIADRP C[C@H]1C[C@H]([NH2+]Cc2cccc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c2)c2ccsc2S1 ZINC000482652376 898254229 /nfs/dbraw/zinc/25/42/29/898254229.db2.gz RCCWFWWUXLWJMR-QSFXBCCZSA-N 2 0 415.628 4.161 20 0 HIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccc(OCC[NH+](C)C)c1 ZINC000482866734 898479959 /nfs/dbraw/zinc/47/99/59/898479959.db2.gz MPYNKBHNJSFPTG-QLKXDWOZSA-N 3 0 407.602 4.473 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)[C@@H](C)C1 ZINC000482948831 898576202 /nfs/dbraw/zinc/57/62/02/898576202.db2.gz SOKDEPYJDGAIQI-DHLKQENFSA-N 3 0 401.639 4.289 20 0 HIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3nc4ccccc4[nH]3)cc2)[C@H](C)C1 ZINC000482949970 898578103 /nfs/dbraw/zinc/57/81/03/898578103.db2.gz WOQREZSGNAVTEP-DENIHFKCSA-N 2 0 406.574 4.457 20 0 HIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000482953367 898582082 /nfs/dbraw/zinc/58/20/82/898582082.db2.gz WQIGWHMVEVWUNQ-OAQYLSRUSA-N 2 0 421.651 4.168 20 0 HIADRP CC1(C(=O)NC[C@H]2CCC[N@@H+]2Cc2ccccc2)CC[NH+](Cc2ccccc2)CC1 ZINC000483054245 898728406 /nfs/dbraw/zinc/72/84/06/898728406.db2.gz KBMABEGKNZKHON-XMMPIXPASA-N 2 0 405.586 4.070 20 0 HIADRP C[N@@H+]1CCC[C@@H](CNC(=O)NC(C)(C)CC[NH+]2CCCCCC2)[C@H]1c1cccs1 ZINC000483105116 898798214 /nfs/dbraw/zinc/79/82/14/898798214.db2.gz XUZYDBBNOQTVCW-FPOVZHCZSA-N 2 0 420.667 4.475 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3c2cc(Br)cc3F)[C@@H](C)C1 ZINC000483129403 898813193 /nfs/dbraw/zinc/81/31/93/898813193.db2.gz SOOOOSWLRZKPMS-PNHOKKKMSA-N 2 0 413.375 4.302 20 0 HIADRP C[C@H]([NH2+][C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483191371 898849247 /nfs/dbraw/zinc/84/92/47/898849247.db2.gz FJGZZQUCYMBCCV-PKOBYXMFSA-N 2 0 419.516 4.158 20 0 HIADRP COc1ccc(C[C@@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)c2ccc(OC)cc2)cc1 ZINC000483214481 898862725 /nfs/dbraw/zinc/86/27/25/898862725.db2.gz NYCFWQMNECSKCV-QFQXNSOFSA-N 2 0 424.585 4.078 20 0 HIADRP Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000483214318 898863168 /nfs/dbraw/zinc/86/31/68/898863168.db2.gz XUVIKWPKHHMYQY-FQEVSTJZSA-N 2 0 401.620 4.137 20 0 HIADRP COc1ccc([C@H](C)[NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)cc1Br ZINC000483511172 899173374 /nfs/dbraw/zinc/17/33/74/899173374.db2.gz CESIDCMIMBVKSU-KRWDZBQOSA-N 2 0 424.427 4.059 20 0 HIADRP C[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccc(F)c(Br)c1 ZINC000483540584 899202252 /nfs/dbraw/zinc/20/22/52/899202252.db2.gz RFFSXMGWFLBNLQ-MRXNPFEDSA-N 2 0 412.391 4.189 20 0 HIADRP CC(C)[NH+]1CCC(NC(=O)C[N@@H+]2C[C@H](C)C[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000483635735 899288613 /nfs/dbraw/zinc/28/86/13/899288613.db2.gz LFYVJMWCTQGDQV-OXQOHEQNSA-N 2 0 411.512 4.077 20 0 HIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1)CC2 ZINC000483720431 899379315 /nfs/dbraw/zinc/37/93/15/899379315.db2.gz DTVCKHQLKFMWHF-OAQYLSRUSA-N 2 0 419.491 4.243 20 0 HIADRP CC[C@@H]1Oc2cc([C@@H](C)[NH2+][C@H](C)c3ccc(OCC[NH+](C)C)cc3)ccc2NC1=O ZINC000483846975 899528115 /nfs/dbraw/zinc/52/81/15/899528115.db2.gz CTNQWZZSRITOMC-YVHKJVDXSA-N 2 0 411.546 4.148 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000484031256 899662580 /nfs/dbraw/zinc/66/25/80/899662580.db2.gz IBVXAVNOTXSLAY-OFVILXPXSA-N 2 0 422.617 4.238 20 0 HIADRP COc1ccc(C[C@@H]([NH2+]CC2(O)CC[NH+](C)CC2)c2cc(Cl)ccc2Cl)cc1 ZINC000484174113 899792566 /nfs/dbraw/zinc/79/25/66/899792566.db2.gz KOUOCNOYOVGUBE-OAQYLSRUSA-N 2 0 423.384 4.332 20 0 HIADRP CC[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(Br)cc1 ZINC000484273346 899845141 /nfs/dbraw/zinc/84/51/41/899845141.db2.gz AIBRKXXNPAAEJA-IBGZPJMESA-N 2 0 424.427 4.117 20 0 HIADRP C[C@@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cc(Cl)cc(Cl)c1 ZINC000484277769 899847473 /nfs/dbraw/zinc/84/74/73/899847473.db2.gz SAPJDADQAGLBAW-CQSZACIVSA-N 2 0 400.394 4.271 20 0 HIADRP C[C@H]([NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1cccc(Cl)c1Cl ZINC000484290683 899855244 /nfs/dbraw/zinc/85/52/44/899855244.db2.gz LFXPZLOSAYKRTF-AWEZNQCLSA-N 2 0 400.394 4.271 20 0 HIADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CC(=O)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000484350779 899899235 /nfs/dbraw/zinc/89/92/35/899899235.db2.gz MUJPOGBNIVLDFD-HXUWFJFHSA-N 2 0 419.569 4.481 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000484465212 899959853 /nfs/dbraw/zinc/95/98/53/899959853.db2.gz GYUULWWTBAVACB-KRWDZBQOSA-N 2 0 422.598 4.321 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1cccc(OC(F)(F)F)c1 ZINC000484482256 899974141 /nfs/dbraw/zinc/97/41/41/899974141.db2.gz YMFTZEZXILTLID-INIZCTEOSA-N 2 0 408.464 4.393 20 0 HIADRP CCC[NH+]1CCC([N@H+](C)C[C@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)CC1 ZINC000484911341 900288708 /nfs/dbraw/zinc/28/87/08/900288708.db2.gz QPUOCUHEVWAIOE-AHWVRZQESA-N 2 0 410.602 4.268 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc1 ZINC000485295319 900573047 /nfs/dbraw/zinc/57/30/47/900573047.db2.gz PFYYHORMVAXLCZ-NOZRDPDXSA-N 2 0 420.601 4.041 20 0 HIADRP CCC(CC)(CNC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1)[NH2+][C@H](C)c1ccccc1 ZINC000485781533 901036761 /nfs/dbraw/zinc/03/67/61/901036761.db2.gz YORFPRVLDQZCPP-CEMLEFRQSA-N 2 0 400.611 4.022 20 0 HIADRP CN(C(=O)c1ccc(C[NH+]2CCCCC2)cc1)c1ccc(OCC[NH+]2CCCC2)cc1 ZINC000486292462 901473142 /nfs/dbraw/zinc/47/31/42/901473142.db2.gz LNYJRDAMZOGDCS-UHFFFAOYSA-N 2 0 421.585 4.424 20 0 HIADRP C[C@@H](c1ccc(OC(F)F)cc1)[NH+]1CCC(C(=O)NCCC[NH+]2CCCCC2)CC1 ZINC000487740197 902332368 /nfs/dbraw/zinc/33/23/68/902332368.db2.gz PEEFESAQOWHXPE-SFHVURJKSA-N 2 0 423.548 4.053 20 0 HIADRP O=C([C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000487870172 902416389 /nfs/dbraw/zinc/41/63/89/902416389.db2.gz FKGQLPKVTMDROC-PKTZIBPZSA-N 2 0 415.597 4.152 20 0 HIADRP CC(C)(C)[NH+]1CCC(Nc2ncc(Cl)c(NC3CC[NH+](C(C)(C)C)CC3)n2)CC1 ZINC000488373650 902786892 /nfs/dbraw/zinc/78/68/92/902786892.db2.gz OAHQXFPTORPIJZ-UHFFFAOYSA-N 2 0 423.049 4.480 20 0 HIADRP O[C@@H](COc1ccc(Oc2ccccc2)cc1)C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488423477 902820541 /nfs/dbraw/zinc/82/05/41/902820541.db2.gz XBRFNGUOZBGWLS-JOCHJYFZSA-N 2 0 410.558 4.026 20 0 HIADRP c1cc(C[NH+]2CCC[C@]3(CCCOC3)C2)cc(C[N@@H+]2CCC[C@]3(CCCOC3)C2)c1 ZINC000489400191 903368935 /nfs/dbraw/zinc/36/89/35/903368935.db2.gz ZGNKHSVQYRRUIH-UIOOFZCWSA-N 2 0 412.618 4.472 20 0 HIADRP Cc1ccc([C@@H](NC(=O)C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)C2CC2)cc1 ZINC000489656789 903521637 /nfs/dbraw/zinc/52/16/37/903521637.db2.gz DFEOXWPPZHKKFV-HHHXNRCGSA-N 2 0 419.613 4.406 20 0 HIADRP CC(C)[C@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)[NH+]1CCC(C)CC1 ZINC000489864054 903638668 /nfs/dbraw/zinc/63/86/68/903638668.db2.gz JVBLDKZROJKPIK-DEOSSOPVSA-N 2 0 414.638 4.049 20 0 HIADRP CC[NH+]1CCN(CCC[NH2+][C@@H](c2ccc(OC)cc2)c2ccccc2Cl)CC1 ZINC000490120425 903777068 /nfs/dbraw/zinc/77/70/68/903777068.db2.gz UJLIVWULYWALBS-QHCPKHFHSA-N 2 0 401.982 4.055 20 0 HIADRP Cc1ccc(C)c([C@@H]([NH2+]Cc2ccnc(N3CC[NH+](C)CC3)c2)c2ccccc2)c1 ZINC000490128850 903781735 /nfs/dbraw/zinc/78/17/35/903781735.db2.gz ATUNQPQMPIMVTC-SANMLTNESA-N 2 0 400.570 4.329 20 0 HIADRP Brc1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c2ncccc12 ZINC000490400444 903985510 /nfs/dbraw/zinc/98/55/10/903985510.db2.gz NKEZNHRFEWAHNH-UHFFFAOYSA-N 2 0 418.379 4.074 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N[C@H](C)[C@H]2CC[NH+](Cc3ccccc3)C2)cc1)C1CC1 ZINC000490792893 904238243 /nfs/dbraw/zinc/23/82/43/904238243.db2.gz IBGZMXWAXVJRBV-YKSBVNFPSA-N 2 0 405.586 4.311 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 ZINC000491019796 904371046 /nfs/dbraw/zinc/37/10/46/904371046.db2.gz LRDYMCWAJLXKEY-WZONZLPQSA-N 2 0 403.973 4.432 20 0 HIADRP C[C@H](C[NH2+][C@@H](c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1)N1CC[NH+](C)CC1 ZINC000491034759 904387384 /nfs/dbraw/zinc/38/73/84/904387384.db2.gz TZKOIWDJQGRMAA-IERDGZPVSA-N 2 0 423.935 4.256 20 0 HIADRP CSc1cccc([C@@H]([NH2+]CC2CC[NH+](CCO)CC2)c2ccc(F)c(F)c2)c1 ZINC000491034525 904387788 /nfs/dbraw/zinc/38/77/88/904387788.db2.gz HCTCCJKIFDEUPK-JOCHJYFZSA-N 2 0 406.542 4.070 20 0 HIADRP COc1ccc([C@@H]([NH2+]CC2CC[NH+](CCO)CC2)c2ccccc2Cl)c(C)c1 ZINC000491046544 904393427 /nfs/dbraw/zinc/39/34/27/904393427.db2.gz ADKPACINLVCQPI-HSZRJFAPSA-N 2 0 402.966 4.040 20 0 HIADRP CCN(Cc1ccccc1)C(=O)[C@H](C)[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000491059992 904402201 /nfs/dbraw/zinc/40/22/01/904402201.db2.gz UTNMPOIDUKUHML-QFIPXVFZSA-N 2 0 407.602 4.268 20 0 HIADRP COc1ccccc1-c1ncc(CNC2CC[NH+]([C@@H](C)c3ccccc3)CC2)cn1 ZINC000491234066 904494230 /nfs/dbraw/zinc/49/42/30/904494230.db2.gz DVETWUHLIIAPSM-IBGZPJMESA-N 2 0 402.542 4.467 20 0 HIADRP CCOc1ccc([C@H]([NH2+]CCCN2CC[NH+](C)CC2)c2ccccc2Cl)cc1 ZINC000491330717 904541521 /nfs/dbraw/zinc/54/15/21/904541521.db2.gz VFOFWHJRFUGDAA-QHCPKHFHSA-N 2 0 401.982 4.055 20 0 HIADRP C[NH+]1CCN(CCC[NH2+][C@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CC1 ZINC000491356317 904552198 /nfs/dbraw/zinc/55/21/98/904552198.db2.gz LOYJACKRKKXLGN-OAQYLSRUSA-N 2 0 423.935 4.258 20 0 HIADRP COc1ccc([C@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2ccccc2Cl)cc1 ZINC000493064360 905008637 /nfs/dbraw/zinc/00/86/37/905008637.db2.gz ZMUXGYOJXRRMSZ-QHCPKHFHSA-N 2 0 401.982 4.054 20 0 HIADRP CSc1cccc([C@@H]([NH2+]CCN2CCC([NH+](C)C)CC2)c2cc(F)ccc2F)c1 ZINC000493077890 905012526 /nfs/dbraw/zinc/01/25/26/905012526.db2.gz IQBMEZDBDCZSJT-HSZRJFAPSA-N 2 0 419.585 4.392 20 0 HIADRP O=C(C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1)Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000493503044 905141686 /nfs/dbraw/zinc/14/16/86/905141686.db2.gz MHNHATJFRCUVAS-VWNXMTODSA-N 2 0 423.626 4.175 20 0 HIADRP COc1cc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1OCC(F)(F)F ZINC000512390325 921126105 /nfs/dbraw/zinc/12/61/05/921126105.db2.gz CHYAJZHAFOOKLN-RDJZCZTQSA-N 2 0 400.485 4.379 20 0 HIADRP Cc1cc(Br)cc2c1[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)CC2 ZINC000493901702 905255157 /nfs/dbraw/zinc/25/51/57/905255157.db2.gz WLGIIUDGDBPVED-HXUWFJFHSA-N 2 0 403.364 4.475 20 0 HIADRP C[C@@H]([NH2+]CC1=Cc2cc(Br)ccc2OC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512397050 921132688 /nfs/dbraw/zinc/13/26/88/921132688.db2.gz ZJAQNQRAUMOKAY-WBVHZDCISA-N 2 0 405.380 4.468 20 0 HIADRP O[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CC(c3ccc(Br)cc3)C2)CC1 ZINC000494649138 905882277 /nfs/dbraw/zinc/88/22/77/905882277.db2.gz QANHOAHXNATEKW-OLBNFPALSA-N 2 0 407.396 4.053 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]C2CCC(c3nc(C)no3)CC2)CC1 ZINC000495080616 906227173 /nfs/dbraw/zinc/22/71/73/906227173.db2.gz RTVRKGLJBXIFFZ-VQSBYGRUSA-N 2 0 415.557 4.036 20 0 HIADRP C[C@@H]([NH2+]C1CCC2(CC1)c1ccccc1NC2=O)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495421109 906441403 /nfs/dbraw/zinc/44/14/03/906441403.db2.gz NVBZSWHCZAVWQF-HIGDPMPISA-N 2 0 403.570 4.319 20 0 HIADRP C[C@@H]([NH2+]Cc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1)c1cccc2ccccc21 ZINC000495460704 906465270 /nfs/dbraw/zinc/46/52/70/906465270.db2.gz LLFWXDWVCSUTFV-XXBNENTESA-N 2 0 401.554 4.388 20 0 HIADRP C[C@H](NC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H](c1ccccc1)[NH+](C)C ZINC000496652424 906730681 /nfs/dbraw/zinc/73/06/81/906730681.db2.gz RYYSPQBIQCBFAE-UYKAOJFJSA-N 2 0 420.601 4.173 20 0 HIADRP O=C1CCCN1Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000512619271 921264356 /nfs/dbraw/zinc/26/43/56/921264356.db2.gz LPWNQTWCSODHNM-UODIDJSMSA-N 2 0 417.597 4.199 20 0 HIADRP Cc1cc(C)n(-c2ccc(C[NH2+][C@@H]3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)cn2)n1 ZINC000512625380 921267045 /nfs/dbraw/zinc/26/70/45/921267045.db2.gz NVRQIPLCPLQQTE-CCDWMCETSA-N 2 0 415.585 4.274 20 0 HIADRP C[N@H+](Cc1ccccc1CNC(=O)N1CCC[C@@H]2C[NH+](C)CC[C@@H]21)C1CCCCC1 ZINC000497401564 906881612 /nfs/dbraw/zinc/88/16/12/906881612.db2.gz PEHXYEKUUXYYBU-VWNXMTODSA-N 2 0 412.622 4.077 20 0 HIADRP CCS[C@@H]1CC[C@H]([NH+](C)CC2(C[N@@H+](C)[C@H]3CC[C@H](SCC)C3)COC2)C1 ZINC000497848941 907327857 /nfs/dbraw/zinc/32/78/57/907327857.db2.gz SRLQQGLUZIJMEZ-LWYYNNOASA-N 2 0 400.698 4.215 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2F)cc1)C1CC1 ZINC000497873244 907349411 /nfs/dbraw/zinc/34/94/11/907349411.db2.gz CRKVFTUXKZKARC-UHFFFAOYSA-N 2 0 415.528 4.153 20 0 HIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OCc3ccccc3)c(Br)c2)C1 ZINC000512825507 921328887 /nfs/dbraw/zinc/32/88/87/921328887.db2.gz BWRJBCNKTKRGAY-IBGZPJMESA-N 2 0 403.364 4.460 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccco1 ZINC000498049160 907560238 /nfs/dbraw/zinc/56/02/38/907560238.db2.gz RMHJHTZYGRZGBN-LXGFNABISA-N 2 0 418.607 4.153 20 0 HIADRP Cc1ccccc1[C@@H]([C@H](C)NC(=O)NC1CC[NH+](C2CCCCC2)CC1)[NH+](C)C ZINC000498613841 908061870 /nfs/dbraw/zinc/06/18/70/908061870.db2.gz GWVITIOHRPIJSJ-WMZHIEFXSA-N 2 0 400.611 4.083 20 0 HIADRP Cc1ccccc1[C@H]([C@@H](C)NC(=O)NC1CC[NH+](C2CCCCC2)CC1)[NH+](C)C ZINC000498613843 908062158 /nfs/dbraw/zinc/06/21/58/908062158.db2.gz GWVITIOHRPIJSJ-XXBNENTESA-N 2 0 400.611 4.083 20 0 HIADRP CC[NH+](CC)Cc1cccc(CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)c1 ZINC000500120197 909601070 /nfs/dbraw/zinc/60/10/70/909601070.db2.gz DCVWBLRABPZHGP-JOCHJYFZSA-N 2 0 412.578 4.148 20 0 HIADRP C[C@@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000500441879 909860808 /nfs/dbraw/zinc/86/08/08/909860808.db2.gz ZKJRKKNMUPHYSG-FCHUYYIVSA-N 2 0 405.586 4.020 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)NCc2cccc(C[NH+](C)C)c2)C1 ZINC000500697085 910030304 /nfs/dbraw/zinc/03/03/04/910030304.db2.gz HYFQSKLTMRFYCB-NHCUHLMSSA-N 2 0 422.617 4.226 20 0 HIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)N2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000500816726 910097592 /nfs/dbraw/zinc/09/75/92/910097592.db2.gz HWTVNXPRARDVCN-NRFANRHFSA-N 2 0 414.638 4.324 20 0 HIADRP C[C@@H](C(=O)N1CCC[C@@H]1c1cccs1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501019868 910236814 /nfs/dbraw/zinc/23/68/14/910236814.db2.gz AYGNYVUEBFXJLA-GHTZIAJQSA-N 2 0 412.603 4.044 20 0 HIADRP C[N@@H+](Cc1cccc(C(=O)N2CCCCC2)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501029896 910246662 /nfs/dbraw/zinc/24/66/62/910246662.db2.gz UQBSQEJNLAZCOP-UHFFFAOYSA-N 2 0 406.574 4.056 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)CC1 ZINC000501031046 910247734 /nfs/dbraw/zinc/24/77/34/910247734.db2.gz JDYPARWSWZKVGD-QFIPXVFZSA-N 2 0 421.029 4.240 20 0 HIADRP C[C@H](CNC(=O)NCc1ccccc1-c1ccc(C[NH+](C)C)cc1)[N@@H+]1CCCC[C@H]1C ZINC000501547297 910650787 /nfs/dbraw/zinc/65/07/87/910650787.db2.gz ASFAHOQZGYVSMZ-NHCUHLMSSA-N 2 0 422.617 4.477 20 0 HIADRP COc1ccc([C@H]2CCCCCN2C(=O)C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1 ZINC000501768229 910823446 /nfs/dbraw/zinc/82/34/46/910823446.db2.gz AUWDAKXIPOMLAL-XMMPIXPASA-N 2 0 415.622 4.193 20 0 HIADRP CSc1nnc(CCC[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)n1CC(C)C ZINC000513208699 921624481 /nfs/dbraw/zinc/62/44/81/921624481.db2.gz XJXJNJCNOFAAQZ-AZUAARDMSA-N 2 0 407.672 4.221 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)N[C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000513209545 921626007 /nfs/dbraw/zinc/62/60/07/921626007.db2.gz DHTXTJGGKDBIKJ-QHCPKHFHSA-N 2 0 421.585 4.246 20 0 HIADRP CCC[NH+]1CCN(c2ccccc2C[N@@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)CC1 ZINC000502320819 911295736 /nfs/dbraw/zinc/29/57/36/911295736.db2.gz MNJIDZBVAZVJNM-HSZRJFAPSA-N 2 0 421.633 4.131 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)C1 ZINC000502509580 911514504 /nfs/dbraw/zinc/51/45/04/911514504.db2.gz LJZBHAGFKAALAK-QIMTYXLQSA-N 2 0 412.622 4.164 20 0 HIADRP Cc1cc([C@H](C)[NH2+]CCCC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)nn1C ZINC000502696003 911733286 /nfs/dbraw/zinc/73/32/86/911733286.db2.gz IGFPYIRDPLESFA-SFHVURJKSA-N 2 0 423.527 4.000 20 0 HIADRP COCC[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1 ZINC000502710404 911743448 /nfs/dbraw/zinc/74/34/48/911743448.db2.gz CKDVPONBUNHRJA-ATIYNZHBSA-N 2 0 407.602 4.304 20 0 HIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000502766752 911790298 /nfs/dbraw/zinc/79/02/98/911790298.db2.gz IINYHHWXHPJNOE-UHFFFAOYSA-N 2 0 414.638 4.323 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)NC[C@H](c3ccccc3)[NH+]3CCCC3)CC2)CC1 ZINC000502774000 911798684 /nfs/dbraw/zinc/79/86/84/911798684.db2.gz XDVAAWJJGUSHQG-KXTRFFEISA-N 2 0 412.622 4.166 20 0 HIADRP CC1CC[NH+](C2CCC(NC(=O)N3CCC[C@@H](C[N@@H+]4CCCC[C@@H]4C)C3)CC2)CC1 ZINC000502807638 911824875 /nfs/dbraw/zinc/82/48/75/911824875.db2.gz GNZIZAFYQZRSQZ-WOLZVPSQSA-N 2 0 418.670 4.326 20 0 HIADRP C[C@H]([NH2+]C1(CNC(=O)NCc2cccc(C[NH+](C)C)c2)CCCC1)c1ccccc1 ZINC000502910398 911897398 /nfs/dbraw/zinc/89/73/98/911897398.db2.gz BBAWOZUVZCMAKD-FQEVSTJZSA-N 2 0 408.590 4.211 20 0 HIADRP CC(C)[C@@H](CNC(=O)N(C)C1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCC(C)CC1 ZINC000502919035 911905926 /nfs/dbraw/zinc/90/59/26/911905926.db2.gz OAHQSEAHAGKDLF-XMMPIXPASA-N 2 0 414.638 4.049 20 0 HIADRP CN(C(=O)NCc1cccc(C[NH+]2CCCC2)c1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000502962354 911942361 /nfs/dbraw/zinc/94/23/61/911942361.db2.gz VXYFIFGNIXKUJX-UHFFFAOYSA-N 2 0 420.601 4.088 20 0 HIADRP CCC(CC)(CNC(=O)NC1CC[NH+](CC2CC2)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000503038436 912007252 /nfs/dbraw/zinc/00/72/52/912007252.db2.gz KWIHVPNQMLYFLD-LJQANCHMSA-N 2 0 400.611 4.070 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)C1 ZINC000503090214 912060756 /nfs/dbraw/zinc/06/07/56/912060756.db2.gz ODSIIRJNSNSVNK-MZKRTTBSSA-N 2 0 408.590 4.251 20 0 HIADRP CN(C(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000503133933 912095548 /nfs/dbraw/zinc/09/55/48/912095548.db2.gz IOICDTOIEPUHRE-VWLOTQADSA-N 2 0 420.601 4.130 20 0 HIADRP c1c(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c(-c2ccncc2)nn1-c1ccccc1 ZINC000506860364 915647300 /nfs/dbraw/zinc/64/73/00/915647300.db2.gz HQJOKLCUUGMKMW-UHFFFAOYSA-N 2 0 401.558 4.242 20 0 HIADRP COc1ccc(-c2nn(Cc3ccccc3)cc2C[NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000506906725 915705634 /nfs/dbraw/zinc/70/56/34/915705634.db2.gz CLZVGAGQFZPCNC-UHFFFAOYSA-N 2 0 418.585 4.381 20 0 HIADRP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)N2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC000506940396 915745950 /nfs/dbraw/zinc/74/59/50/915745950.db2.gz OCVAOTNCYVJPAA-VCHRRKICSA-N 2 0 412.622 4.118 20 0 HIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)NCc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000506957647 915763884 /nfs/dbraw/zinc/76/38/84/915763884.db2.gz XDHOAJBXSURFDC-URXFXBBRSA-N 2 0 412.622 4.078 20 0 HIADRP CCOc1cc(C[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)cc(Cl)c1O ZINC000507407165 916175639 /nfs/dbraw/zinc/17/56/39/916175639.db2.gz SKIDXRNKBWFDMS-IRXDYDNUSA-N 2 0 418.965 4.343 20 0 HIADRP c1sc(CC[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)nc1-c1ccncc1 ZINC000507464745 916232185 /nfs/dbraw/zinc/23/21/85/916232185.db2.gz YNVVLMYTDQNQLB-FDFHNCONSA-N 2 0 404.583 4.248 20 0 HIADRP FC(F)n1c2ccccc2nc1CC[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000507469397 916237172 /nfs/dbraw/zinc/23/71/72/916237172.db2.gz KAIRUQKKFFUBEF-VAMGGRTRSA-N 2 0 410.512 4.474 20 0 HIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCc4nnc(-c5ccc(F)cc5)n4C3)CC2)C1 ZINC000507604845 916360021 /nfs/dbraw/zinc/36/00/21/916360021.db2.gz IVLCEXFRDKHGMF-YHYVQYDKSA-N 2 0 411.569 4.032 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1 ZINC000507872142 916710143 /nfs/dbraw/zinc/71/01/43/916710143.db2.gz DZOCNDRLJNBNRC-SSPASSIJSA-N 2 0 416.606 4.286 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+]C3CCC(C(=O)OC(C)(C)C)CC3)cc2)C[C@@H](C)O1 ZINC000507936324 916807538 /nfs/dbraw/zinc/80/75/38/916807538.db2.gz PTFHLOMRGMCCOP-WSUXWNOTSA-N 2 0 416.606 4.286 20 0 HIADRP CCOc1cc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc(Br)c1O ZINC000508328314 917131480 /nfs/dbraw/zinc/13/14/80/917131480.db2.gz ZUGUMIXGFARVLX-UHFFFAOYSA-N 2 0 419.363 4.439 20 0 HIADRP Cc1ccc(C(=O)N2CCC([NH2+][C@H](C)[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000508700987 917462167 /nfs/dbraw/zinc/46/21/67/917462167.db2.gz VNQAMUFMZPRGTA-ZJSXRUAMSA-N 2 0 405.586 4.100 20 0 HIADRP Cc1ccccc1[C@H]([C@@H](C)NC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+](C)C ZINC000508882002 917636657 /nfs/dbraw/zinc/63/66/57/917636657.db2.gz OWJGWFGTGLNGHW-PFATUAPWSA-N 2 0 422.617 4.150 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(-c3cnn(C)c3)s2)C[C@@H](C)O1 ZINC000509487799 918133256 /nfs/dbraw/zinc/13/32/56/918133256.db2.gz SUFBBWCYXYXPNB-QZTJIDSGSA-N 2 0 410.587 4.048 20 0 HIADRP CC[C@H](C)[NH2+][C@H](CNC(=O)N(Cc1ccccc1)C1CC[NH+](C)CC1)c1ccco1 ZINC000509568469 918217759 /nfs/dbraw/zinc/21/77/59/918217759.db2.gz LNGUYBIFSIHLLE-SIKLNZKXSA-N 2 0 412.578 4.015 20 0 HIADRP C[C@@H]1C[C@@H](CCNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)C[N@@H+]1Cc1ccccc1 ZINC000509569326 918219101 /nfs/dbraw/zinc/21/91/01/918219101.db2.gz CMAVPXZVTPSGRR-MZYLBHOOSA-N 2 0 424.589 4.016 20 0 HIADRP CC[C@H](C)[NH2+][C@@H](CNC(=O)N1CCC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccco1 ZINC000509586654 918235941 /nfs/dbraw/zinc/23/59/41/918235941.db2.gz ICJSLGRAMUHYKM-VWPQPMDRSA-N 2 0 412.578 4.015 20 0 HIADRP CCCC[N@H+](C)CC1CC[NH+](CCC(=O)Nc2ccc(Br)cc2)CC1 ZINC000510095091 918659985 /nfs/dbraw/zinc/65/99/85/918659985.db2.gz GTLGVYDJGZYIKN-UHFFFAOYSA-N 2 0 410.400 4.222 20 0 HIADRP C[NH+](C)Cc1ccc(CNC(=O)NCc2ccc(C[NH+]3CCCCCC3)cc2)cc1 ZINC000510198481 918747459 /nfs/dbraw/zinc/74/74/59/918747459.db2.gz PLMYLHGLQXCLHQ-UHFFFAOYSA-N 2 0 408.590 4.124 20 0 HIADRP CC[NH+]1CCN(c2ccccc2C[NH+]2CCC(OCCc3ccccc3)CC2)CC1 ZINC000510364870 918855396 /nfs/dbraw/zinc/85/53/96/918855396.db2.gz QVGVTEUOPOJWLA-UHFFFAOYSA-N 2 0 407.602 4.052 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNC(=O)NC[C@@H](c2ccc(C)o2)[NH+]2CCCC2)cc1 ZINC000510465535 918921950 /nfs/dbraw/zinc/92/19/50/918921950.db2.gz QHTCERXZERJBNY-QFIPXVFZSA-N 2 0 412.578 4.066 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000510523579 918968985 /nfs/dbraw/zinc/96/89/85/918968985.db2.gz MFXLELBRYFVYOD-IEIRFRATSA-N 2 0 400.611 4.022 20 0 HIADRP NC(=O)[C@H]1CCC[N@H+](Cc2cccc(C[NH2+]C3CC(c4ccccc4Cl)C3)c2)C1 ZINC000510954080 919486777 /nfs/dbraw/zinc/48/67/77/919486777.db2.gz SNAXWHQSFJRPSG-MWXLCCTBSA-N 2 0 411.977 4.073 20 0 HIADRP O=C(Nc1ccccc1)N1CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000511030422 919609084 /nfs/dbraw/zinc/60/90/84/919609084.db2.gz LGYAWUNXQBXKNG-YCAMKHIRSA-N 2 0 404.558 4.078 20 0 HIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2ccc(Br)cc2)c1 ZINC000511031033 919609193 /nfs/dbraw/zinc/60/91/93/919609193.db2.gz SRHWUWUASKGUMZ-MRXNPFEDSA-N 2 0 418.379 4.408 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccc(CCN3CCOCC3)cc2)cc1 ZINC000511648771 920314454 /nfs/dbraw/zinc/31/44/54/920314454.db2.gz UIDNXRMHESLPPO-UHFFFAOYSA-N 2 0 409.574 4.046 20 0 HIADRP CCC[N@H+](CC)Cc1ccc(C(=O)NC2CC[NH+](Cc3ccc(F)cc3)CC2)cc1 ZINC000511834732 920541858 /nfs/dbraw/zinc/54/18/58/920541858.db2.gz LDBNXLOUQPZSCV-UHFFFAOYSA-N 2 0 411.565 4.452 20 0 HIADRP Cc1ccc([C@H](CNC(=O)c2ccc(C[NH+]3CCSCC3)cc2)[NH+]2CCCC2)cc1 ZINC000512091318 920853947 /nfs/dbraw/zinc/85/39/47/920853947.db2.gz KWWJTGWXBLERFS-DEOSSOPVSA-N 2 0 423.626 4.111 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+]C/C=C/c2ccc(F)c(F)c2)c1)C1CCOCC1 ZINC000512127335 920876434 /nfs/dbraw/zinc/87/64/34/920876434.db2.gz BKFKZPVZGZLFEW-HWKANZROSA-N 2 0 416.512 4.257 20 0 HIADRP CSc1ccccc1NC(=O)CC[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512260782 921018799 /nfs/dbraw/zinc/01/87/99/921018799.db2.gz LZGTTWMMZADQLO-DEOSSOPVSA-N 2 0 409.599 4.335 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCOCC2)cc1 ZINC000513474881 921833796 /nfs/dbraw/zinc/83/37/96/921833796.db2.gz DJHQBSPEQJROIH-NRFANRHFSA-N 2 0 423.601 4.158 20 0 HIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)cc1OC ZINC000513531062 921873122 /nfs/dbraw/zinc/87/31/22/921873122.db2.gz DQTSDPBKBMNVIY-HXUWFJFHSA-N 2 0 404.501 4.471 20 0 HIADRP Cc1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000513588094 921919872 /nfs/dbraw/zinc/91/98/72/921919872.db2.gz HTDHRCJPVQRDEO-PCCBWWKXSA-N 2 0 409.574 4.111 20 0 HIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cccc(CN3CCCC3=O)c2)CC1 ZINC000513661750 921985079 /nfs/dbraw/zinc/98/50/79/921985079.db2.gz QFLYISKKUIBINO-UHFFFAOYSA-N 2 0 405.586 4.342 20 0 HIADRP COc1ccc(-c2nn(-c3ccccc3)cc2C[N@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC000513742434 922063650 /nfs/dbraw/zinc/06/36/50/922063650.db2.gz XHXRCUDZHLHPHC-UHFFFAOYSA-N 2 0 404.558 4.322 20 0 HIADRP Cc1ccccc1[C@H](OC[C@H](O)C[N@@H+](C)C1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000514005199 922328300 /nfs/dbraw/zinc/32/83/00/922328300.db2.gz DHJYFCVMTGQKBW-AOYPEHQESA-N 2 0 410.602 4.267 20 0 HIADRP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC000514033849 922355174 /nfs/dbraw/zinc/35/51/74/922355174.db2.gz ZNTSZGXYCONFGT-PXDATVDWSA-N 2 0 420.601 4.307 20 0 HIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)c(C)c1OC ZINC000514089361 922412720 /nfs/dbraw/zinc/41/27/20/922412720.db2.gz PARYZQDSJKYRER-GGPKGHCWSA-N 2 0 412.574 4.472 20 0 HIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)NC[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000514107715 922437006 /nfs/dbraw/zinc/43/70/06/922437006.db2.gz PKVKSRRCYYFARU-NJDAHSKKSA-N 2 0 420.667 4.017 20 0 HIADRP C[C@@H]1CCCC[NH+]1C[C@@H]1CCCN(CCN2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)C1 ZINC000514111677 922442855 /nfs/dbraw/zinc/44/28/55/922442855.db2.gz AQIDVMZHNHUORA-POYMRFPPSA-N 2 0 418.714 4.159 20 0 HIADRP Cc1ccc([C@@H](CNC(=O)NCCCC[N@H+]2CCCC[C@@H]2C)[NH+]2CCCC2)cc1 ZINC000514122619 922454246 /nfs/dbraw/zinc/45/42/46/922454246.db2.gz LSMLVTVJDRFYGZ-JTHBVZDNSA-N 2 0 400.611 4.086 20 0 HIADRP CC[NH+]1CCN(C[C@H](C)C[NH2+]Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1 ZINC000514229381 922566328 /nfs/dbraw/zinc/56/63/28/922566328.db2.gz DCDPYYBJUGQBSN-QGZVFWFLSA-N 2 0 409.496 4.329 20 0 HIADRP CSC1(C[NH2+][C@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)CC[NH+](C)CC1 ZINC000514821214 922814881 /nfs/dbraw/zinc/81/48/81/922814881.db2.gz UMWOBTMDHPIUDO-IEBWSBKVSA-N 2 0 410.599 4.252 20 0 HIADRP COc1ccc([C@H](CNC(=O)C[N@@H+]2CCC[C@H]2c2ccccc2)[NH+]2CCCCC2)cc1 ZINC000514918687 922843882 /nfs/dbraw/zinc/84/38/82/922843882.db2.gz SMQCZVHIRFGYEW-DQEYMECFSA-N 2 0 421.585 4.176 20 0 HIADRP C[C@@H](CNC(=O)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC000515521740 923151886 /nfs/dbraw/zinc/15/18/86/923151886.db2.gz UBSUNOOZJZCZSX-FSSWDIPSSA-N 2 0 407.602 4.317 20 0 HIADRP CC(C)[N@H+](C)Cc1ccccc1CNC(=O)N[C@H]1CC[NH+]([C@@H](C)c2ccccc2)C1 ZINC000516579809 923800161 /nfs/dbraw/zinc/80/01/61/923800161.db2.gz TUGJSJGMGSRAOC-RDPSFJRHSA-N 2 0 408.590 4.162 20 0 HIADRP CN(CC[N@H+](C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1CC[NH+](C)CC1 ZINC000517203318 924051957 /nfs/dbraw/zinc/05/19/57/924051957.db2.gz QQLJDNMCXGVYNP-UHFFFAOYSA-N 2 0 411.434 4.182 20 0 HIADRP CC[NH+]1CCN(C[C@@H](C)C[NH2+]Cc2ccc(-c3ccc(Br)cc3)o2)CC1 ZINC000517547776 924258804 /nfs/dbraw/zinc/25/88/04/924258804.db2.gz OGWWOPGHGCLIBK-KRWDZBQOSA-N 2 0 420.395 4.072 20 0 HIADRP CN1CC[NH+](CCCC[NH2+]Cc2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000518265044 927123094 /nfs/dbraw/zinc/12/30/94/927123094.db2.gz OTTDFKONMQQFQA-UHFFFAOYSA-N 2 0 401.982 4.036 20 0 HIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2c(Br)cncc2Br)C1 ZINC000518268789 927126385 /nfs/dbraw/zinc/12/63/85/927126385.db2.gz YAHOICONCNJPFL-CYBMUJFWSA-N 2 0 419.205 4.208 20 0 HIADRP CC[NH+](CC)[C@H](CNC(=O)N[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1)c1ccsc1 ZINC000518406855 927247732 /nfs/dbraw/zinc/24/77/32/927247732.db2.gz IIPOHVXPLKJFSS-YUXAGFNASA-N 2 0 414.619 4.266 20 0 HIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NCCCCC[NH+]2CCCCC2)C1 ZINC000518454125 927285628 /nfs/dbraw/zinc/28/56/28/927285628.db2.gz ZIOTYCOKISJHJZ-QFIPXVFZSA-N 2 0 414.638 4.374 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)NCCCCC[NH+]2CCCCC2)C1 ZINC000518454124 927286480 /nfs/dbraw/zinc/28/64/80/927286480.db2.gz ZIOTYCOKISJHJZ-JOCHJYFZSA-N 2 0 414.638 4.374 20 0 HIADRP O=C(NC[C@H](c1ccccc1Cl)[NH+]1CCCC1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000518631547 927391370 /nfs/dbraw/zinc/39/13/70/927391370.db2.gz CWXUOXXBIMHCLM-SIKLNZKXSA-N 2 0 419.013 4.137 20 0 HIADRP O=C(NC[C@H](c1ccccc1Cl)[NH+]1CCCC1)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000518631545 927391693 /nfs/dbraw/zinc/39/16/93/927391693.db2.gz CWXUOXXBIMHCLM-DENIHFKCSA-N 2 0 419.013 4.137 20 0 HIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000518888668 927600313 /nfs/dbraw/zinc/60/03/13/927600313.db2.gz LWKMPZMNJZHWHI-DQEYMECFSA-N 2 0 402.586 4.432 20 0 HIADRP Fc1cncc([C@@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C2CC2)c1 ZINC000519192133 927819814 /nfs/dbraw/zinc/81/98/14/927819814.db2.gz ARQICTZXQUPAAP-VWNXMTODSA-N 2 0 409.549 4.190 20 0 HIADRP CC(C)Oc1cccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000519655455 928036783 /nfs/dbraw/zinc/03/67/83/928036783.db2.gz SPYKXMOGGCYOBQ-XMMPIXPASA-N 2 0 408.586 4.492 20 0 HIADRP CC[NH+](CC)CC1CCN(C(=O)NCc2cccc(C[NH+]3CCCCCC3)c2)CC1 ZINC000519935437 928170084 /nfs/dbraw/zinc/17/00/84/928170084.db2.gz PIDOVYGZZIYQFN-UHFFFAOYSA-N 2 0 414.638 4.326 20 0 HIADRP C[NH+](C)Cc1ccc(-c2ccccc2CNC(=O)N2CC[C@@H]([NH+]3CCCCC3)C2)cc1 ZINC000520756646 928803246 /nfs/dbraw/zinc/80/32/46/928803246.db2.gz QATYKMIAIYGCPN-XMMPIXPASA-N 2 0 420.601 4.185 20 0 HIADRP CCOc1cc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc(Br)c1OC ZINC000520949781 928885634 /nfs/dbraw/zinc/88/56/34/928885634.db2.gz QRRQCPVLLBBHCQ-MRXNPFEDSA-N 2 0 413.400 4.458 20 0 HIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3cnc(-c4ccccc4)nc3)CC2)c1 ZINC000521822801 929479491 /nfs/dbraw/zinc/47/94/91/929479491.db2.gz QYPJCPFBXIBJIL-UHFFFAOYSA-N 2 0 415.585 4.144 20 0 HIADRP C[NH+](C)Cc1c2ccccc2oc1C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000524737453 929814338 /nfs/dbraw/zinc/81/43/38/929814338.db2.gz XIUPJAHOWZCLMI-IIBYNOLFSA-N 2 0 411.571 4.369 20 0 HIADRP CCCOc1ccc(NC(=O)N(CC[NH+](C)C)C[C@H]2CCC[N@@H+]2CC)cc1Cl ZINC000525375465 930204884 /nfs/dbraw/zinc/20/48/84/930204884.db2.gz SMLVIMIVPMHDDF-GOSISDBHSA-N 2 0 410.990 4.009 20 0 HIADRP C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)c2oc3ccccc3c2C[NH+](C)C)CC1 ZINC000525754732 930431415 /nfs/dbraw/zinc/43/14/15/930431415.db2.gz YMNUIRJYWRBVIQ-GOSISDBHSA-N 2 0 405.542 4.450 20 0 HIADRP Cc1ccc([C@H](CCn2cncn2)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1 ZINC000527351758 930644445 /nfs/dbraw/zinc/64/44/45/930644445.db2.gz JRYAIXKNDYCYQM-QHCPKHFHSA-N 2 0 409.603 4.281 20 0 HIADRP C[N@@H+]1CCC[C@H](CNC(=O)[C@@H]2CCCC[NH+]2Cc2ccccc2)[C@@H]1c1cccs1 ZINC000530820763 930831501 /nfs/dbraw/zinc/83/15/01/930831501.db2.gz UNLUDJNQOWQQJG-FUPPJEDESA-N 2 0 411.615 4.302 20 0 HIADRP CC[NH+](CC)[C@@H](C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(C(F)(F)F)c1 ZINC000530822109 930832271 /nfs/dbraw/zinc/83/22/71/930832271.db2.gz DIEGYHADDRVLKI-RAFMOHDBSA-N 2 0 411.512 4.220 20 0 HIADRP C[C@@H]1C[N@@H+](Cc2ccc(-c3nc(-c4ccc(C[NH+](C)C)cc4)no3)cc2)C[C@H](C)O1 ZINC000530871667 930845099 /nfs/dbraw/zinc/84/50/99/930845099.db2.gz RWJKVHVTOAWIPA-HDICACEKSA-N 2 0 406.530 4.074 20 0 HIADRP CC[N@@H+]1CC[C@H]([NH+](C)C[C@H](O)CO[C@H](c2ccccc2)c2ccccc2C)C[C@H]1C ZINC000530902259 930854261 /nfs/dbraw/zinc/85/42/61/930854261.db2.gz QTIRHFHPQLYBHA-BPEMXEAKSA-N 2 0 410.602 4.267 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)CC(=O)Nc2ccccc2)CC1 ZINC000530906669 930854967 /nfs/dbraw/zinc/85/49/67/930854967.db2.gz ZCQPGTUOAICIFT-OALUTQOASA-N 2 0 412.553 4.036 20 0 HIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)Cc3cccc(Br)c3)CC2)CC1 ZINC000531191145 930959106 /nfs/dbraw/zinc/95/91/06/930959106.db2.gz XOXAVUGHUPBYIT-UHFFFAOYSA-N 2 0 408.428 4.077 20 0 HIADRP Cc1ncc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)n1-c1ccccc1 ZINC000531213143 930968330 /nfs/dbraw/zinc/96/83/30/930968330.db2.gz STYQZXMFGSRTPO-UHFFFAOYSA-N 2 0 418.585 4.342 20 0 HIADRP Cc1c[nH+]ccc1N1CCC(C(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)CC1 ZINC000531442146 931057615 /nfs/dbraw/zinc/05/76/15/931057615.db2.gz MSSAQRMZSHFQKA-NRFANRHFSA-N 2 0 420.601 4.386 20 0 HIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000531595327 931114461 /nfs/dbraw/zinc/11/44/61/931114461.db2.gz KRZBDDOFMVTLTD-DHLKQENFSA-N 3 0 420.645 4.360 20 0 HIADRP CCN(CC)[C@@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1ccsc1 ZINC000531597384 931116389 /nfs/dbraw/zinc/11/63/89/931116389.db2.gz JLFRKQAGLAXMHR-DEOSSOPVSA-N 2 0 414.663 4.451 20 0 HIADRP CC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCN(c2ccccc2)CC1)C1CCOCC1 ZINC000531683275 931150558 /nfs/dbraw/zinc/15/05/58/931150558.db2.gz DHNHXQXKTWBQNO-AREMUKBSSA-N 2 0 407.602 4.304 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000531682358 931150872 /nfs/dbraw/zinc/15/08/72/931150872.db2.gz MWQGODATWYXEQO-ZCNNSNEGSA-N 2 0 414.615 4.419 20 0 HIADRP CC[C@H]([NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000531710474 931169305 /nfs/dbraw/zinc/16/93/05/931169305.db2.gz OEELYYAOIXBRIG-VXKWHMMOSA-N 2 0 403.517 4.317 20 0 HIADRP C[C@H](CC(=O)N(C)c1ccccc1)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000531724957 931174830 /nfs/dbraw/zinc/17/48/30/931174830.db2.gz LGCWAJSWHZIGGI-HXUWFJFHSA-N 2 0 405.542 4.443 20 0 HIADRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCOc4c(Cl)c(Cl)ccc43)cn2)CC1 ZINC000531989672 931278533 /nfs/dbraw/zinc/27/85/33/931278533.db2.gz NGYFRSCWPYLONJ-GOSISDBHSA-N 2 0 421.372 4.144 20 0 HIADRP C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000531993721 931279188 /nfs/dbraw/zinc/27/91/88/931279188.db2.gz CNMAATDNOAHERB-GOSISDBHSA-N 2 0 406.014 4.464 20 0 HIADRP CC(C)C(=O)Nc1ccc(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)cc1 ZINC000532106795 931314196 /nfs/dbraw/zinc/31/41/96/931314196.db2.gz FPGXFMKDIWZYOV-UHFFFAOYSA-N 2 0 408.590 4.101 20 0 HIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)c1ccc(SCC(F)(F)F)cc1 ZINC000532197119 931345311 /nfs/dbraw/zinc/34/53/11/931345311.db2.gz GDAJMKZTQAKJAF-INIZCTEOSA-N 2 0 424.536 4.339 20 0 HIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 ZINC000532215463 931357195 /nfs/dbraw/zinc/35/71/95/931357195.db2.gz RJAJDRIQRSRDNA-HNNXBMFYSA-N 2 0 401.473 4.014 20 0 HIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(OC)c(Br)c2)[C@H](C)C1 ZINC000532223229 931360695 /nfs/dbraw/zinc/36/06/95/931360695.db2.gz LSAMSZNWOGLLGC-GJYPPUQNSA-N 2 0 413.400 4.245 20 0 HIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000532269862 931377837 /nfs/dbraw/zinc/37/78/37/931377837.db2.gz FLIRNUHOSQAHNC-XZOQPEGZSA-N 2 0 402.485 4.225 20 0 HIADRP c1c(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)[nH]nc1-c1ccccc1 ZINC000532270186 931378480 /nfs/dbraw/zinc/37/84/80/931378480.db2.gz SVHSOIKFFOBTKN-UHFFFAOYSA-N 2 0 404.558 4.238 20 0 HIADRP CO[C@H](C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1)c1cccc(Cl)c1 ZINC000532358498 931407768 /nfs/dbraw/zinc/40/77/68/931407768.db2.gz JWNPLHYVDRKXCS-HSZRJFAPSA-N 2 0 401.982 4.348 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)nc1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000532451673 931440815 /nfs/dbraw/zinc/44/08/15/931440815.db2.gz JXURWYWZVZUWGO-CVEARBPZSA-N 2 0 423.388 4.086 20 0 HIADRP COc1ccc([C@@H](C)[NH2+][C@H](CN2CC[NH+](C)CC2)c2ccccc2)c2ccccc12 ZINC000532498289 931462767 /nfs/dbraw/zinc/46/27/67/931462767.db2.gz XRFPSMLXWIIRAG-CJFMBICVSA-N 2 0 403.570 4.488 20 0 HIADRP C[N@H+](CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)[C@H]1CCCc2ccccc21 ZINC000533222045 931813726 /nfs/dbraw/zinc/81/37/26/931813726.db2.gz XMSKZNQRDWTKOX-QHCPKHFHSA-N 2 0 409.599 4.183 20 0 HIADRP C[C@@H]([NH2+][C@H](c1ccc(F)cc1)C1CCC1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000533377044 931853088 /nfs/dbraw/zinc/85/30/88/931853088.db2.gz XGVLAYWILWLBHL-CLOONOSVSA-N 2 0 423.576 4.426 20 0 HIADRP O=c1[nH]c2ccccc2n1CCC[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000535680712 933332683 /nfs/dbraw/zinc/33/26/83/933332683.db2.gz OXFQRGINVRMMKO-UHFFFAOYSA-N 2 0 404.558 4.120 20 0 HIADRP C[C@@H]([NH2+]CC(=O)NC1CC[NH+](C2CC2)CC1)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000562902272 945145650 /nfs/dbraw/zinc/14/56/50/945145650.db2.gz DNRLDJWDFDZMOH-OAHLLOKOSA-N 2 0 418.006 4.462 20 0 HIADRP CC(C)COc1ccc(C[N@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)cc1 ZINC000537622588 938337241 /nfs/dbraw/zinc/33/72/41/938337241.db2.gz DHOLRWPDQIQIKP-UHFFFAOYSA-N 2 0 401.639 4.350 20 0 HIADRP CC[NH+](CC)Cc1ccc(CNCc2c(Cl)cccc2N2CC[NH+](C)CC2)cc1 ZINC000537750197 938369083 /nfs/dbraw/zinc/36/90/83/938369083.db2.gz VTBBSYAQPKSYSP-UHFFFAOYSA-N 2 0 415.025 4.223 20 0 HIADRP CC[N@H+](CCC1CCN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC1)CC1CC1 ZINC000537829584 938385212 /nfs/dbraw/zinc/38/52/12/938385212.db2.gz DTWXBECSWZNUEW-UHFFFAOYSA-N 2 0 411.590 4.469 20 0 HIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(I)cc1 ZINC000537934743 938421980 /nfs/dbraw/zinc/42/19/80/938421980.db2.gz BGUIAJCEUSAJOS-HNNXBMFYSA-N 2 0 421.326 4.253 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C(=O)N2CCCCC2)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000537990770 938452541 /nfs/dbraw/zinc/45/25/41/938452541.db2.gz LWOLGYAHKJRDSB-HXUWFJFHSA-N 2 0 409.574 4.104 20 0 HIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2ccc(Br)cc2)C2CC2)CC1 ZINC000538115130 938506095 /nfs/dbraw/zinc/50/60/95/938506095.db2.gz YWIXAQPVZWOZCZ-NJDAHSKKSA-N 2 0 407.396 4.258 20 0 HIADRP C[C@H]([NH2+]CC(=O)Nc1cccc(C[NH+]2CCSCC2)c1)C(C)(C)c1ccccc1 ZINC000538149841 938522329 /nfs/dbraw/zinc/52/23/29/938522329.db2.gz FRNZZPMDOJKKJW-IBGZPJMESA-N 2 0 411.615 4.130 20 0 HIADRP C[C@@H]([NH2+]CC(=O)NCc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1C(F)(F)F ZINC000538258560 938576481 /nfs/dbraw/zinc/57/64/81/938576481.db2.gz VZFQPZVLXMKVAX-QGZVFWFLSA-N 2 0 419.491 4.268 20 0 HIADRP CC[C@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2ccccc2C1 ZINC000538268915 938579741 /nfs/dbraw/zinc/57/97/41/938579741.db2.gz QLTGNLKPBDRMKK-ILBGXUMGSA-N 2 0 419.613 4.401 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+][C@H](c1ccc3c(c1)OCCO3)C1CC1)c1ccccc1O2 ZINC000538294518 938585565 /nfs/dbraw/zinc/58/55/65/938585565.db2.gz RZZZSNGYVMHRGR-BWKNWUBXSA-N 2 0 420.553 4.487 20 0 HIADRP NC(=O)[C@@H]1CCC[N@H+](Cc2cccc(C[NH2+][C@H](CC3CCC3)c3ccccc3)c2)C1 ZINC000538396286 938610574 /nfs/dbraw/zinc/61/05/74/938610574.db2.gz YKCSVOUOSNJIMV-JWQCQUIFSA-N 2 0 405.586 4.405 20 0 HIADRP Cc1nn(-c2ccccc2)c(C)c1[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000538501722 938636898 /nfs/dbraw/zinc/63/68/98/938636898.db2.gz AZHIDTFDRHSFLS-LJQANCHMSA-N 2 0 418.585 4.297 20 0 HIADRP C[NH+](C)C1CCN(c2ccc(N[C@@H]3CCc4c3cccc4Br)nc2)CC1 ZINC000538587693 938656084 /nfs/dbraw/zinc/65/60/84/938656084.db2.gz VFYRDGRJCPEEKE-HXUWFJFHSA-N 2 0 415.379 4.474 20 0 HIADRP Fc1ccc(Br)c2c1CC[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000539038627 938777075 /nfs/dbraw/zinc/77/70/75/938777075.db2.gz GZEAJWBZWPFXBE-IBGZPJMESA-N 2 0 404.327 4.477 20 0 HIADRP CC[C@@H]([NH2+][C@H](C)c1ccc(S(=O)(=O)NCCC[NH+](C)C)cc1)c1ccc(C)cc1 ZINC000539041146 938778076 /nfs/dbraw/zinc/77/80/76/938778076.db2.gz SOYDDGNNIJMYBA-AUSIDOKSSA-N 2 0 417.619 4.027 20 0 HIADRP C[NH+](C)CCOc1cc(C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)ccn1 ZINC000539047367 938781690 /nfs/dbraw/zinc/78/16/90/938781690.db2.gz QMWTWNRFRYHTTJ-HSZRJFAPSA-N 2 0 411.496 4.374 20 0 HIADRP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](c3cccc(C(F)(F)F)c3)C3CC3)cn2)CC1 ZINC000539159808 938813967 /nfs/dbraw/zinc/81/39/67/938813967.db2.gz BHKIRKIRTWEBHU-JOCHJYFZSA-N 2 0 418.507 4.483 20 0 HIADRP COc1ccc([C@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)C(C)C)cc1 ZINC000539217193 938820098 /nfs/dbraw/zinc/82/00/98/938820098.db2.gz LBQYTYQKRDIXEM-XMMPIXPASA-N 2 0 409.574 4.008 20 0 HIADRP C[C@@H]([NH2+][C@H](C)C(C)(C)c1ccccc1)C(=O)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000539254159 938826988 /nfs/dbraw/zinc/82/69/88/938826988.db2.gz NEUAAEZWILLRCF-NHCUHLMSSA-N 2 0 407.602 4.112 20 0 HIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCOCc1ccc(Cl)cc1)c1ccccc1O2 ZINC000539406972 938856087 /nfs/dbraw/zinc/85/60/87/938856087.db2.gz LIUINQSJQLOTMU-NRFANRHFSA-N 2 0 400.950 4.434 20 0 HIADRP COc1ccc(OC)c(CCC[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)c1 ZINC000539409558 938856488 /nfs/dbraw/zinc/85/64/88/938856488.db2.gz JZEWBDXXXUOWFK-QFIPXVFZSA-N 2 0 410.558 4.214 20 0 HIADRP Cc1c([C@H](C)Nc2ccc(N3CC[C@H]([NH+](C)C)C3)cn2)cnn1-c1ccc(F)cc1 ZINC000539658520 938895535 /nfs/dbraw/zinc/89/55/35/938895535.db2.gz AVGKFTBYGSYUKU-KKSFZXQISA-N 2 0 408.525 4.028 20 0 HIADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)Nc2cccc(CC[NH+]3CCC(C)CC3)c2)C1 ZINC000539875566 938963188 /nfs/dbraw/zinc/96/31/88/938963188.db2.gz SVQHTKVLXKAAOM-QFIPXVFZSA-N 2 0 400.611 4.157 20 0 HIADRP COc1ccc(-c2noc([C@H](C)[N@H+](C)CCC3CCN(c4cc[nH+]cc4)CC3)n2)cc1 ZINC000540042400 939046457 /nfs/dbraw/zinc/04/64/57/939046457.db2.gz DFOOOPMDQFAKQN-SFHVURJKSA-N 2 0 421.545 4.440 20 0 HIADRP C[C@H](C(=O)Nc1ccc(F)cc1Cl)[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000540046940 939049151 /nfs/dbraw/zinc/04/91/51/939049151.db2.gz HUJXYQIVNKTCFQ-MRXNPFEDSA-N 2 0 418.944 4.440 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2ccnc(OCC[NH+](C)C)c2)cnn1-c1cccc(Cl)c1 ZINC000540158111 939094823 /nfs/dbraw/zinc/09/48/23/939094823.db2.gz JAPDIKFBCIQRKR-MRXNPFEDSA-N 2 0 413.953 4.020 20 0 HIADRP C[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)c2cccc(Br)c21 ZINC000540159136 939095647 /nfs/dbraw/zinc/09/56/47/939095647.db2.gz XHWADELKWRWHRZ-QRKUABHPSA-N 2 0 407.396 4.355 20 0 HIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)cc1 ZINC000540161099 939096959 /nfs/dbraw/zinc/09/69/59/939096959.db2.gz NUHVPBCWTLKSFG-SDHOMARFSA-N 2 0 412.549 4.086 20 0 HIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(C(=O)NCC[NH+]3CCCC3)cc2)c2ccsc2S1 ZINC000540171086 939101547 /nfs/dbraw/zinc/10/15/47/939101547.db2.gz NETGPXITJNDURZ-OXJNMPFZSA-N 2 0 415.628 4.289 20 0 HIADRP C[NH+](C)CCNC(=O)c1ccc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000540316546 939191900 /nfs/dbraw/zinc/19/19/00/939191900.db2.gz WMVPEQMHMQZNSH-NRFANRHFSA-N 2 0 419.491 4.238 20 0 HIADRP C[C@H](C[NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1)C[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000540389409 939228033 /nfs/dbraw/zinc/22/80/33/939228033.db2.gz MLPMNIJQGVPLTD-QAICKBLRSA-N 2 0 408.586 4.357 20 0 HIADRP C[C@@H]([NH2+]CCC[NH2+][C@@H](C)c1cccc(-n2cccn2)c1)c1cccc(-n2cccn2)c1 ZINC000540390474 939229336 /nfs/dbraw/zinc/22/93/36/939229336.db2.gz XZKYDRRJJWUJGI-OYRHEFFESA-N 2 0 414.557 4.450 20 0 HIADRP C[C@H](C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)N1CCc2ccccc2C1 ZINC000540475599 939267052 /nfs/dbraw/zinc/26/70/52/939267052.db2.gz QJYGWJVLFKAAKO-HYBUGGRVSA-N 2 0 405.586 4.011 20 0 HIADRP CC(C)C(=O)Nc1ccc(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)cc1 ZINC000540495118 939275402 /nfs/dbraw/zinc/27/54/02/939275402.db2.gz FCDNOFWWAQKAAH-QFIPXVFZSA-N 2 0 407.558 4.359 20 0 HIADRP CC1CC[NH+]([C@@H](CNC(=O)c2cccc(Cn3ccnc3)c2)c2ccccc2)CC1 ZINC000540509644 939281637 /nfs/dbraw/zinc/28/16/37/939281637.db2.gz SFZWMVHGDVIMEL-DEOSSOPVSA-N 2 0 402.542 4.134 20 0 HIADRP CC(C)N1CC[C@@H](NC(=O)NCCC2CC[NH+](C)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000540718670 939347713 /nfs/dbraw/zinc/34/77/13/939347713.db2.gz URUCWTRGOLYVAY-NHCUHLMSSA-N 2 0 424.992 4.034 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1ccc(Br)c(F)c1 ZINC000540990877 939426848 /nfs/dbraw/zinc/42/68/48/939426848.db2.gz XJFMRZBBAMLONX-HNAYVOBHSA-N 2 0 421.354 4.396 20 0 HIADRP CC(C)[N@@H+](Cc1ccc(NC(=O)N[C@@H]2CC[NH+](C)[C@H](C)C2)cc1)C[C@@H]1CCCCO1 ZINC000541034152 939437130 /nfs/dbraw/zinc/43/71/30/939437130.db2.gz YLYGBFGVUWUAKL-PTUXOGIPSA-N 2 0 416.610 4.070 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1ccc(C(=O)Nc2ccc(F)cc2)cc1 ZINC000541376978 939500444 /nfs/dbraw/zinc/50/04/44/939500444.db2.gz DYLNLXKOLCWTAW-UHFFFAOYSA-N 2 0 415.472 4.257 20 0 HIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1cccc(NC(=O)c2ccc(F)cc2)c1 ZINC000541390675 939503664 /nfs/dbraw/zinc/50/36/64/939503664.db2.gz PBWPMHXNYHPIIL-UHFFFAOYSA-N 2 0 415.472 4.257 20 0 HIADRP Cc1cc([C@H]([NH2+]CC2(N3CCCCC3)CC[NH+](C)CC2)c2cccnc2)ccc1F ZINC000541543853 939549283 /nfs/dbraw/zinc/54/92/83/939549283.db2.gz SRFLLJJKBYKRCQ-DEOSSOPVSA-N 2 0 410.581 4.158 20 0 HIADRP C[C@H]1[N@H+](Cc2ccc(C[NH+]3CCC4(CCOCC4)[C@@H]3C)cc2)CCC12CCOCC2 ZINC000541719095 939613571 /nfs/dbraw/zinc/61/35/71/939613571.db2.gz YONICPZIYWNLKB-SZPZYZBQSA-N 2 0 412.618 4.469 20 0 HIADRP OC[C@H]([NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000541882577 939649077 /nfs/dbraw/zinc/64/90/77/939649077.db2.gz ULGFQUCHISLPAL-UVUJQTEASA-N 2 0 404.476 4.239 20 0 HIADRP CCCN(C(=O)c1cccs1)C1CC[NH+](Cc2cn(-c3cc[nH+]cc3)nc2C)CC1 ZINC000542464593 939827450 /nfs/dbraw/zinc/82/74/50/939827450.db2.gz BNQZUQLLNUAIJR-UHFFFAOYSA-N 2 0 423.586 4.154 20 0 HIADRP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000542846344 939862593 /nfs/dbraw/zinc/86/25/93/939862593.db2.gz JMAIZSKNODMRKK-IFMALSPDSA-N 2 0 400.950 4.219 20 0 HIADRP COc1ccc([C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2ccc(F)cc2)cc1 ZINC000542848311 939862898 /nfs/dbraw/zinc/86/28/98/939862898.db2.gz XNVNSLYCOXKRLE-RSXGOPAZSA-N 2 0 420.528 4.280 20 0 HIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(F)cc1Br ZINC000542849458 939863014 /nfs/dbraw/zinc/86/30/14/939863014.db2.gz PMUKUYQZXXEAJC-KDOFPFPSSA-N 2 0 407.327 4.006 20 0 HIADRP CC[NH+](CC)CCCC1CC[NH+]([C@@H](C)C(=O)Nc2ccc3c(c2)OCCCO3)CC1 ZINC000542944917 939883456 /nfs/dbraw/zinc/88/34/56/939883456.db2.gz HJAZUWKWWAKXAY-IBGZPJMESA-N 2 0 417.594 4.009 20 0 HIADRP Fc1ccc([C@H]([NH2+]CCCN2CC[NH+](Cc3ccccc3)CC2)c2cccnc2)cc1 ZINC000543406721 940054974 /nfs/dbraw/zinc/05/49/74/940054974.db2.gz PQWNIKKRRBMKHS-SANMLTNESA-N 2 0 418.560 4.108 20 0 HIADRP C[C@@H]1C[C@@H](NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000543420682 940059819 /nfs/dbraw/zinc/05/98/19/940059819.db2.gz BXIUUANKQURJJW-RDGATRHJSA-N 2 0 419.613 4.458 20 0 HIADRP COc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)ccc1SC ZINC000543774514 940181628 /nfs/dbraw/zinc/18/16/28/940181628.db2.gz FUXXSLMKCYBQJQ-UTKZUKDTSA-N 2 0 400.588 4.225 20 0 HIADRP Cc1c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cnn1-c1cc(C)ccc1C ZINC000543776320 940182219 /nfs/dbraw/zinc/18/22/19/940182219.db2.gz FZZOEDGVFFODBI-YKSBVNFPSA-N 2 0 418.585 4.215 20 0 HIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000543775259 940182485 /nfs/dbraw/zinc/18/24/85/940182485.db2.gz QTJXXKZYFBIWEX-JTSKRJEESA-N 2 0 422.598 4.321 20 0 HIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000543776880 940183274 /nfs/dbraw/zinc/18/32/74/940183274.db2.gz PTIMNYZQOXWBIR-JPYJTQIMSA-N 2 0 421.610 4.460 20 0 HIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCCOc2cc3c(cc21)CCC3 ZINC000543776838 940183365 /nfs/dbraw/zinc/18/33/65/940183365.db2.gz XJBVOEBBLPSMCD-ZCYQVOJMSA-N 2 0 406.570 4.136 20 0 HIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1ccc(F)c(Br)c1 ZINC000543778255 940184434 /nfs/dbraw/zinc/18/44/34/940184434.db2.gz ZQIBLXNVBUNSKH-KSSFIOAISA-N 2 0 407.327 4.006 20 0 HIADRP COc1ccc(Cl)cc1NC(=O)C[C@H](C)[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000544001836 940292773 /nfs/dbraw/zinc/29/27/73/940292773.db2.gz DYTCEUCGXIEFSO-AWEZNQCLSA-N 2 0 407.917 4.056 20 0 HIADRP COc1cc(C[NH2+]CC2(SC)CC[NH+](C)CC2)ccc1OCc1ccccc1 ZINC000563840536 945310227 /nfs/dbraw/zinc/31/02/27/945310227.db2.gz IBCFGAYALUUNJP-UHFFFAOYSA-N 2 0 400.588 4.191 20 0 HIADRP O=C(NCCC[NH+]1CCCCC1)C1CC[NH+]([C@H]2CCc3ccc(Cl)cc32)CC1 ZINC000544071108 940317238 /nfs/dbraw/zinc/31/72/38/940317238.db2.gz NLMLXOGBUMSBSQ-QFIPXVFZSA-N 2 0 403.998 4.032 20 0 HIADRP C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000544488735 940453984 /nfs/dbraw/zinc/45/39/84/940453984.db2.gz OVPPTOJHMQTSKJ-GOSISDBHSA-N 2 0 416.997 4.406 20 0 HIADRP Cc1c(Cl)c(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)nc2ccccc12 ZINC000544488265 940454247 /nfs/dbraw/zinc/45/42/47/940454247.db2.gz CIOCPIYRIMSPHS-UHFFFAOYSA-N 2 0 400.998 4.046 20 0 HIADRP CN(c1ccccc1C[NH2+][C@H]1CCO[C@@H](c2ccc(F)cc2)C1)C1CC[NH+](C)CC1 ZINC000544596867 940486924 /nfs/dbraw/zinc/48/69/24/940486924.db2.gz YGTWPKBHEDBDNE-WIOPSUGQSA-N 2 0 411.565 4.366 20 0 HIADRP CN(c1ccccc1C[NH2+][C@@H]1CCO[C@H](c2ccc(F)cc2)C1)C1CC[NH+](C)CC1 ZINC000544596866 940487201 /nfs/dbraw/zinc/48/72/01/940487201.db2.gz YGTWPKBHEDBDNE-RDGATRHJSA-N 2 0 411.565 4.366 20 0 HIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H](Cc2cccnc2)c2ccc(Cl)cc2)C[C@H](C)O1 ZINC000544828912 940518035 /nfs/dbraw/zinc/51/80/35/940518035.db2.gz COQCUMBTAUBXBK-SELNLUPBSA-N 2 0 401.982 4.498 20 0 HIADRP C[C@@H]1C[NH+](Cc2ccc(-c3nc(-c4ccc(F)c(C[NH+](C)C)c4)no3)cc2)C[C@@H](C)O1 ZINC000545751924 940583776 /nfs/dbraw/zinc/58/37/76/940583776.db2.gz NNEPOGLLNPEHGP-IAGOWNOFSA-N 2 0 424.520 4.214 20 0 HIADRP COc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)CC3 ZINC000546606677 940860674 /nfs/dbraw/zinc/86/06/74/940860674.db2.gz JOQGVMWSQPXTFZ-NHCUHLMSSA-N 2 0 403.570 4.188 20 0 HIADRP CC[NH+](CC)Cc1ccc(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000547763790 941075152 /nfs/dbraw/zinc/07/51/52/941075152.db2.gz KLMRCVOFMSSDDK-QILAJZQNSA-N 2 0 405.586 4.454 20 0 HIADRP C[N@H+](CCC(=O)Nc1cccc(NC(=O)CC[NH+]2CCCCC2)c1)C1CCCCC1 ZINC000548061252 941084787 /nfs/dbraw/zinc/08/47/87/941084787.db2.gz UBOODERCOHNFOV-UHFFFAOYSA-N 2 0 414.594 4.094 20 0 HIADRP Cc1nc(CN2CCC(C[NH2+][C@H](C)[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)oc1C ZINC000548155257 941089240 /nfs/dbraw/zinc/08/92/40/941089240.db2.gz APZGYDWHALYKNK-YKSBVNFPSA-N 2 0 410.606 4.004 20 0 HIADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000548155918 941089735 /nfs/dbraw/zinc/08/97/35/941089735.db2.gz JSKXBVONUVAUKY-AFQFEXIYSA-N 2 0 417.601 4.455 20 0 HIADRP Cc1ccc(C[NH+]2CCC(CC[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c(-c2cnn(C)c2)c1 ZINC000549401651 941186488 /nfs/dbraw/zinc/18/64/88/941186488.db2.gz RMIOSQUBVDHWJN-SFTDATJTSA-N 2 0 410.606 4.107 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCC[C@H]([C@@H]4CCOC4)C3)C3(C2)CCOCC3)cc1 ZINC000549876418 941223895 /nfs/dbraw/zinc/22/38/95/941223895.db2.gz KITHQYWRSDAOPS-FQUZAXHOSA-N 2 0 412.618 4.100 20 0 HIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCC[C@H]([C@H]4CCOC4)C3)C3(C2)CCOCC3)cc1 ZINC000549876422 941223945 /nfs/dbraw/zinc/22/39/45/941223945.db2.gz KITHQYWRSDAOPS-OJJQZRKESA-N 2 0 412.618 4.100 20 0 HIADRP CC(C)[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccc(F)cn1 ZINC000550883332 941378519 /nfs/dbraw/zinc/37/85/19/941378519.db2.gz YPOXYHYYOKBCLO-ZJSXRUAMSA-N 2 0 411.565 4.436 20 0 HIADRP CC(C)CO[C@@H]1C[C@H]([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)C1(C)C ZINC000550882008 941378731 /nfs/dbraw/zinc/37/87/31/941378731.db2.gz HFBFDQYOVLQXKH-TZRRMPRUSA-N 2 0 414.634 4.345 20 0 HIADRP C[N@H+](CCOc1cccc(C[NH2+][C@H]2CCCc3ccc(O)cc32)c1)C1CCOCC1 ZINC000550886298 941379403 /nfs/dbraw/zinc/37/94/03/941379403.db2.gz NSEHFLVJEMXXAY-VWLOTQADSA-N 2 0 410.558 4.049 20 0 HIADRP COc1cc(CC[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)ccc1Cl ZINC000550931601 941383189 /nfs/dbraw/zinc/38/31/89/941383189.db2.gz FMTUKZLKIFQMHT-HXUWFJFHSA-N 2 0 400.950 4.469 20 0 HIADRP COc1cc2c(cc1F)CC[C@@H]2[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000551265287 941439298 /nfs/dbraw/zinc/43/92/98/941439298.db2.gz SGHSPRGOSPXOBP-URXFXBBRSA-N 2 0 424.560 4.340 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@@H]3Cc4[nH]c5ccccc5c4C3)C3(C2)CCOCC3)cc1 ZINC000551265280 941439367 /nfs/dbraw/zinc/43/93/67/941439367.db2.gz RYJODZFGTPRSNS-YADHBBJMSA-N 2 0 415.581 4.154 20 0 HIADRP COc1ncc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cc1Cl ZINC000551530210 941496102 /nfs/dbraw/zinc/49/61/02/941496102.db2.gz OZEOGWWUDOGIOW-LSDHHAIUSA-N 2 0 406.933 4.046 20 0 HIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)nc2)cc1Cl ZINC000551537597 941497742 /nfs/dbraw/zinc/49/77/42/941497742.db2.gz AYKPFEIVJREZFU-KRWDZBQOSA-N 2 0 402.970 4.125 20 0 HIADRP C[NH+]1CCC(O)(C[NH2+][C@H](c2sccc2Br)C2CCCCC2)CC1 ZINC000551790907 941545430 /nfs/dbraw/zinc/54/54/30/941545430.db2.gz KLLCADMAOYISSH-INIZCTEOSA-N 2 0 401.414 4.178 20 0 HIADRP COC1CCN(C(C)(C)C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000552043510 941572728 /nfs/dbraw/zinc/57/27/28/941572728.db2.gz PZAMOGKJTXLABX-ICDZXHCJSA-N 2 0 413.650 4.156 20 0 HIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1ccc2c(c1)OCC(=O)N2 ZINC000552050720 941574436 /nfs/dbraw/zinc/57/44/36/941574436.db2.gz PYSRZORKLKOMIT-CEXWTWQISA-N 2 0 407.558 4.346 20 0 HIADRP Cc1cc(C[NH+](C)C)cc(NC(=O)[C@H]2C[N@H+](Cc3ccccc3)CCC2(F)F)c1 ZINC000552133140 941591209 /nfs/dbraw/zinc/59/12/09/941591209.db2.gz YTJMYDAHPVCGMO-OAQYLSRUSA-N 2 0 401.501 4.153 20 0 HIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000552904723 941800634 /nfs/dbraw/zinc/80/06/34/941800634.db2.gz UOJCTZYBLKHJCA-LAUBAEHRSA-N 2 0 410.949 4.433 20 0 HIADRP CC[N@H+](Cc1ccc(C(=O)NC[C@H](c2ccc(SC)cc2)[NH+](C)C)cc1)C1CC1 ZINC000554706900 942206126 /nfs/dbraw/zinc/20/61/26/942206126.db2.gz XCJIJXYBLQSWMX-HSZRJFAPSA-N 2 0 411.615 4.426 20 0 HIADRP C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1C[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000554961100 942334685 /nfs/dbraw/zinc/33/46/85/942334685.db2.gz SHLQOFJWVPDPFP-JMJGKCIBSA-N 2 0 423.626 4.254 20 0 HIADRP c1csc(-c2n[nH]cc2C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000555611646 942670048 /nfs/dbraw/zinc/67/00/48/942670048.db2.gz AAVVSWVOSBBLJB-OAQYLSRUSA-N 2 0 422.598 4.157 20 0 HIADRP c1ccc(COC2CC([NH2+]C[C@@H]3C[N@H+](Cc4ccccc4)CC34CCOCC4)C2)cc1 ZINC000556232388 942823628 /nfs/dbraw/zinc/82/36/28/942823628.db2.gz FARYEYZHIHZUDZ-JDSVYEKJSA-N 2 0 420.597 4.253 20 0 HIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2)c1ccccc1N(C)C ZINC000556232439 942823791 /nfs/dbraw/zinc/82/37/91/942823791.db2.gz FXOKQZSSMWJFQI-FYYLOGMGSA-N 2 0 407.602 4.332 20 0 HIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+][C@@H](C)c2cnc(OC)c(Cl)c2)CC1 ZINC000556582647 942906488 /nfs/dbraw/zinc/90/64/88/942906488.db2.gz CDAVZKPUMBMOSM-HOTGVXAUSA-N 2 0 420.960 4.436 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]([NH2+]CCCc4nnc5n4CCCCC5)[C@@H]3C2)cc1 ZINC000556870679 942945525 /nfs/dbraw/zinc/94/55/25/942945525.db2.gz GUBSJRZUJFJUOI-RBZQAINGSA-N 2 0 421.633 4.218 20 0 HIADRP CC(C)Oc1ccc([C@H](CNC(=O)C2CC[NH+](Cc3ccccc3)CC2)[NH+](C)C)cc1 ZINC000557954644 943339014 /nfs/dbraw/zinc/33/90/14/943339014.db2.gz MWULXDVJKNITNF-VWLOTQADSA-N 2 0 423.601 4.105 20 0 HIADRP CN(CCC[N@H+](C)Cc1ccco1)C(=O)Nc1ccc(CC[NH+]2CCCCC2)cc1 ZINC000558312867 943499648 /nfs/dbraw/zinc/49/96/48/943499648.db2.gz IVGTYRYEPDBXJQ-UHFFFAOYSA-N 2 0 412.578 4.294 20 0 HIADRP CC(C)Sc1cc(Br)ccc1C[N@H+](C)CCCN1CC[NH+](C)CC1 ZINC000558422688 943555665 /nfs/dbraw/zinc/55/56/65/943555665.db2.gz SUHHVKNQVQPXSQ-UHFFFAOYSA-N 2 0 414.457 4.019 20 0 HIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C3(C2)CCOCC3)cc1 ZINC000559891097 944076873 /nfs/dbraw/zinc/07/68/73/944076873.db2.gz NMAWUJLREXRTMM-RPBOFIJWSA-N 2 0 405.586 4.441 20 0 HIADRP Cc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(-c2cnn(C)c2)c1 ZINC000560073255 944149126 /nfs/dbraw/zinc/14/91/26/944149126.db2.gz RKKZWNBFMQBRGK-UHFFFAOYSA-N 2 0 404.558 4.158 20 0 HIADRP CN1CC[NH+](CC2(C)CC[NH+](Cc3cnc(-c4ccc(Cl)cc4)s3)CC2)CC1 ZINC000560256801 944208479 /nfs/dbraw/zinc/20/84/79/944208479.db2.gz JDSPDZIIZLUFJH-UHFFFAOYSA-N 2 0 419.038 4.313 20 0 HIADRP Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@H]1C[N@H+](Cc2ccccc2)CCC1(F)F ZINC000560535188 944245957 /nfs/dbraw/zinc/24/59/57/944245957.db2.gz WSXFQAXXKHHQGJ-HXUWFJFHSA-N 2 0 401.501 4.153 20 0 HIADRP CCOC(=O)COc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000560542408 944249220 /nfs/dbraw/zinc/24/92/20/944249220.db2.gz FVIFCESCICSXAX-UHFFFAOYSA-N 2 0 422.569 4.117 20 0 HIADRP COc1cc(F)c([C@H](C)[NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)cc1OC ZINC000560885647 944364932 /nfs/dbraw/zinc/36/49/32/944364932.db2.gz ZJDLAFCTVNLDDO-IBGZPJMESA-N 2 0 415.553 4.096 20 0 HIADRP O=C1c2ccccc2C(=O)N1[C@@H]1CCCC[C@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000560912281 944368415 /nfs/dbraw/zinc/36/84/15/944368415.db2.gz ZCIKEIIGWVGGSI-FCHUYYIVSA-N 2 0 423.601 4.228 20 0 HIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=O)C[C@@H](c2ncc[nH]2)c2ccccc2)C1 ZINC000561155226 944484688 /nfs/dbraw/zinc/48/46/88/944484688.db2.gz GUQODTSWVOJLDT-HYBUGGRVSA-N 2 0 416.569 4.480 20 0 HIADRP Cc1ccn(-c2ccccc2C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)n1 ZINC000561265297 944533675 /nfs/dbraw/zinc/53/36/75/944533675.db2.gz DQJKJUAYOCZQOB-QFIPXVFZSA-N 2 0 402.542 4.259 20 0 HIADRP CCN(CCC[NH+]1CCCC1)Cc1cn(Cc2ccccc2)nc1-c1cccnc1 ZINC000561980714 944884497 /nfs/dbraw/zinc/88/44/97/944884497.db2.gz JDOIQZCCRPGMGT-UHFFFAOYSA-N 2 0 403.574 4.301 20 0 HIADRP Cc1cccc(C)c1[C@H](C)NC(=O)N(C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000562164489 944991556 /nfs/dbraw/zinc/99/15/56/944991556.db2.gz BZXCGXXDHLIDDO-NRFANRHFSA-N 2 0 414.638 4.202 20 0 HIADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NCc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000564387354 945547671 /nfs/dbraw/zinc/54/76/71/945547671.db2.gz JMQAPCBWAOICMF-NJDAHSKKSA-N 2 0 414.638 4.036 20 0 HIADRP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](CC(Cc3ccccc3)Cc3ccccc3)C2)CC1 ZINC000564526927 945653353 /nfs/dbraw/zinc/65/33/53/945653353.db2.gz AOWJEOCLFAJWIK-HHHXNRCGSA-N 2 0 405.630 4.188 20 0 HIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)N(Cc1ccncc1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000567056455 946229189 /nfs/dbraw/zinc/22/91/89/946229189.db2.gz DQGMNVZKZSBKPM-ZJSXRUAMSA-N 2 0 422.617 4.242 20 0 HIADRP C[C@@H]([NH2+]CCCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000569341952 946859552 /nfs/dbraw/zinc/85/95/52/946859552.db2.gz ZJZXCUSWDMHFJY-WIYYLYMNSA-N 2 0 408.521 4.309 20 0 HIADRP Cc1nn(-c2ccccn2)c(C)c1C[NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000570061528 947080293 /nfs/dbraw/zinc/08/02/93/947080293.db2.gz VNMMYIOTSJLUMB-IBGZPJMESA-N 2 0 403.574 4.406 20 0 HIADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1cccc(NS(C)(=O)=O)c1 ZINC000570439697 947247512 /nfs/dbraw/zinc/24/75/12/947247512.db2.gz XCGRCCHQRKUJEJ-CTNGQTDRSA-N 2 0 415.603 4.011 20 0 HIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1Cl ZINC000570468255 947254423 /nfs/dbraw/zinc/25/44/23/947254423.db2.gz AMEDKEYNPRWLTG-QGZVFWFLSA-N 2 0 402.970 4.125 20 0 HIADRP C[NH+](C)CCCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ccc(C[NH+](C)C)nc1 ZINC000571229333 947555953 /nfs/dbraw/zinc/55/59/53/947555953.db2.gz QXICNRIBWNTVIN-UHFFFAOYSA-N 2 0 423.388 4.044 20 0 HIADRP Cc1ccccc1C[NH+]1CCC(NC(=O)C[N@@H+](C)[C@H]2CCCc3ccccc32)CC1 ZINC000573783513 948298572 /nfs/dbraw/zinc/29/85/72/948298572.db2.gz SNPIKDRKYCXLAV-VWLOTQADSA-N 2 0 405.586 4.085 20 0 HIADRP C[C@H]1C[NH+](CCC2CC[NH+](Cc3ccc(OCc4cccnc4)cc3)CC2)C[C@H](C)O1 ZINC000574062464 948355744 /nfs/dbraw/zinc/35/57/44/948355744.db2.gz UTRPOZFGOSCYSJ-VXKWHMMOSA-N 2 0 423.601 4.372 20 0 HIADRP C[C@H]1C[C@H]1[N@@H+]1CCN(C(=O)c2cccc(C[NH+](C)Cc3ccccc3)c2)C[C@@H](C)C1 ZINC000575773615 948701625 /nfs/dbraw/zinc/70/16/25/948701625.db2.gz ZWHBHWQTGZMQLO-STWLZBDKSA-N 2 0 405.586 4.121 20 0 HIADRP C[C@H](C[NH2+]CC1CC[NH+](CC(=O)NC(C)(C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000576028777 948813734 /nfs/dbraw/zinc/81/37/34/948813734.db2.gz VBKAVFSNDFULPP-MRXNPFEDSA-N 2 0 413.528 4.025 20 0 HIADRP